*HEADER    CONTRACTILE PROTEIN                     03-AUG-00   1FI5              
*TITLE     NMR STRUCTURE OF THE C TERMINAL DOMAIN OF CARDIAC TROPONIN            
*TITLE    2 C BOUND TO THE N TERMINAL DOMAIN OF CARDIAC TROPONIN I.              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TROPONIN C;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 81 - 161;                                         
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                                  
*SOURCE   3 ORGANISM_COMMON: CHICKEN;                                            
*SOURCE   4 ORGAN: HEART;                                                        
*SOURCE   5 TISSUE: MUSCLE;                                                      
*SOURCE   6 CELLULAR_LOCATION: THIN FILAMENT;                                    
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_CELL: MYOCYTE;                                     
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET-23D+;                                 
*SOURCE  11 EXPRESSION_SYSTEM_GENE: CTNC(81-161);                                
*SOURCE  12 OTHER_DETAILS: C TERMINAL DOMAIN OF CARDIAC TROPONIN C (81-          
*SOURCE  13 161) BOUND TO THE N TERMINAL DOMAIN OF CARDIAC TROPONIN I            
*SOURCE  14 (33-80), CALCIUM IONS BOUND AT SITES III AND IV                      
*KEYWDS    TROPONIN C-TROPONIN I INTERACTION, CARDIAC, MUSCLE PROTEIN,           
*KEYWDS   2 CALCIUM BINDING PROTEIN                                              
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    G.M.GASMI-SEABROOK, J.W.HOWARTH, N.FINLEY, E.ABUSAMHADNEH,            
*AUTHOR   2 V.GAPONENKO, R.M.BRITO, R.J.SOLARO, P.R.ROSEVEAR                     
*REVDAT   1   23-AUG-00 1FI5    0                                                
set message=off echo=off end
 
!NH to NHs
!Helix E
assi (resi 93 and name HN) (resi 94 and name HN)     4.0  2.2  1.2
assi (resi 93 and name HN) (resi 96 and name HN)     3.2  1.2  0.5
assi (resi 94 and name HN) (resi 95 and name HN)     2.5  0.8  0.3
assi (resi 94 and name HN) (resi 96 and name HN)     4.0  2.2  1.2
assi (resi 95 and name HN) (resi 96 and name HN)     2.5  0.8  0.3
assi (resi 96 and name HN) (resi 97 and name HN)     2.5  0.8  0.3
assi (resi 96 and name HN) (resi 99 and name HN)     4.8  3.0  1.0
assi (resi 97 and name HN) (resi 94 and name HN)     4.8  3.0  1.0
assi (resi 97 and name HN) (resi 98 and name HN)     2.5  0.8  0.3
assi (resi 98 and name HN) (resi 100 and name HN)    4.0  2.2  1.2 
assi (resi 98 and name HN) (resi 99 and name HN)     2.5  0.8  0.3
assi (resi 98 and name HN) (resi 96 and name HN)     4.0  2.2  1.2
assi (resi 99 and name HN) (resi 100 and name HN)    3.2  1.2  0.5
assi (resi 100 and name HN) (resi 101 and name HN)   2.5  0.8  0.3
assi (resi 101 and name HN) (resi 98 and name HN)    4.8  3.0  1.0
assi (resi 101 and name HN) (resi 102 and name HN)   3.2  1.2  0.5
assi (resi 102 and name HN) (resi 103 and name HN)   2.5  0.8  0.3
assi (resi 103 and name HN) (resi 104 and name HN)   2.5  0.8  0.3
!Ca2+ loop
assi (resi 104 and name HN) (resi 105 and name HN)   2.5  0.8  0.3
assi (resi 105 and name HN) (resi 103 and name HN)   4.0  2.2  1.2
assi (resi 105 and name HN) (resi 106 and name HN)   4.0  2.2  1.2
assi (resi 106 and name HN) (resi 107 and name HN)   2.5  0.8  0.3
assi (resi 107 and name HN) (resi 108 and name HN)   2.5  0.8  0.3
assi (resi 107 and name HN) (resi 109 and name HN)   4.8  3.0  1.0
assi (resi 108 and name HN) (resi 106 and name HN)   4.0  2.2  1.2
assi (resi 108 and name HN) (resi 109 and name HN)   3.2  1.2  0.5
assi (resi 108 and name HN) (resi 110 and name HN)   4.8  3.0  1.0
assi (resi 109 and name HN) (resi 110 and name HN)   2.5  0.8  0.3
assi (resi 109 and name HN) (resi 111 and name HN)   3.2  1.2  0.5
assi (resi 110 and name HN) (resi 111 and name HN)   2.5  0.8  0.3
!Beta-sheet
assi (resi 111 and name HN) (resi 112 and name HN)   4.0  2.2  1.2
assi (resi 112 and name HN) (resi 113 and name HN)   4.0  2.2  1.2
assi (resi 112 and name HN) (resi 148 and name HN)   2.5  0.8  0.3
assi (resi 113 and name HN) (resi 116 and name HN)   3.2  1.2  0.5
assi (resi 113 and name HN) (resi 114 and name HN)   4.0  2.2  1.2 
!Helix F
assi (resi 114 and name HN) (resi 115 and name HN)   2.5  0.8  0.3 
assi (resi 114 and name HN) (resi 148 and name HN)   5.8  4.0  1.2
assi (resi 115 and name HN) (resi 116 and name HN)   2.5  0.8  0.3
assi (resi 116 and name HN) (resi 118 and name HN)   4.0  2.2  1.2
assi (resi 116 and name HN) (resi 117 and name HN)   2.5  0.8  0.3
assi (resi 117 and name HN) (resi 119 and name HN)   4.0  2.2  1.2
assi (resi 117 and name HN) (resi 115 and name HN)   4.0  2.2  1.2
assi (resi 117 and name HN) (resi 120 and name HN)   4.8  3.0  1.0
assi (resi 117 and name HN) (resi 118 and name HN)   2.5  0.8  0.3
assi (resi 119 and name HN) (resi 118 and name HN)   2.5  0.8  0.3
assi (resi 119 and name HN) (resi 120 and name HN)   2.5  0.8  0.3   
assi (resi 119 and name HN) (resi 122 and name HN)   4.8  3.0  1.0
assi (resi 120 and name HN) (resi 121 and name HN)   2.5  0.8  0.3
assi (resi 121 and name HN) (resi 122 and name HN)   2.5  0.8  0.3
assi (resi 122 and name HN) (resi 123 and name HN)   2.5  0.8  0.3
assi (resi 122 and name HN) (resi 124 and name HN)   4.0  2.2  1.2
assi (resi 123 and name HN) (resi 124 and name HN)   2.5  0.8  0.3 
assi (resi 124 and name HN) (resi 125 and name HN)   4.0  2.2  1.2  
!loop
assi (resi 126 and name HN) (resi 127 and name HN)   4.0  2.2  1.2
assi (resi 127 and name HN) (resi 128 and name HN)   4.0  2.2  1.2
assi (resi 128 and name HN) (resi 129 and name HN)   5.8  4.0  1.2
assi (resi 129 and name HN) (resi 131 and name HN)   4.8  3.0  1.0
assi (resi 129 and name HN) (resi 130 and name HN)   4.8  3.0  1.0  
!Helix G
assi (resi 130 and name HN) (resi 131 and name HN)   2.5  0.8  0.3 
assi (resi 130 and name HN) (resi 132 and name HN)   4.8  3.0  1.0
assi (resi 131 and name HN) (resi 133 and name HN)   4.0  2.2  1.2 
assi (resi 131 and name HN) (resi 132 and name HN)   2.5  0.8  0.3
assi (resi 132 and name HN) (resi 133 and name HN)   2.5  0.8  0.3 
assi (resi 133 and name HN) (resi 134 and name HN)   2.5  0.8  0.3 
assi (resi 133 and name HN) (resi 135 and name HN)   4.8  3.0  1.0
assi (resi 133 and name HN) (resi 129 and name HN)   4.8  3.0  1.0
assi (resi 134 and name HN) (resi 135 and name HN)   2.5  0.8  0.3
assi (resi 134 and name HN) (resi 131 and name HN)   4.8  3.0  1.0
assi (resi 135 and name HN) (resi 136 and name HN)   2.5  0.8  0.3
assi (resi 136 and name HN) (resi 139 and name HN)   4.8  3.0  1.0
assi (resi 136 and name HN) (resi 137 and name HN)   2.5  0.8  0.3
assi (resi 137 and name HN) (resi 135 and name HN)   4.0  2.2  1.2
assi (resi 137 and name HN) (resi 138 and name HN)   2.5  0.8  0.3
assi (resi 139 and name HN) (resi 141 and name HN)   4.0  2.2  1.2
assi (resi 139 and name HN) (resi 138 and name HN)   3.2  1.2  0.5
assi (resi 139 and name HN) (resi 137 and name HN)   4.8  3.0  1.0
!Ca2+ loop
assi (resi 140 and name HN) (resi 141 and name HN)   2.5  0.8  0.3
assi (resi 140 and name HN) (resi 137 and name HN)   4.8  3.0  1.0
assi (resi 140 and name HN) (resi 139 and name HN)   2.5  0.8  0.3
assi (resi 141 and name HN) (resi 143 and name HN)   5.8  4.0  1.2
assi (resi 141 and name HN) (resi 142 and name HN)   4.8  3.0  1.0
assi (resi 142 and name HN) (resi 143 and name HN)   2.5  0.8  0.3
assi (resi 143 and name HN) (resi 144 and name HN)   2.5  0.8  0.3
assi (resi 143 and name HN) (resi 145 and name HN)   4.0  2.2  1.2
assi (resi 144 and name HN) (resi 146 and name HN)   4.8  3.0  1.0
assi (resi 144 and name HN) (resi 145 and name HN)   3.2  1.2  0.5
assi (resi 145 and name HN) (resi 146 and name HN)   2.5  0.8  0.3
assi (resi 145 and name HN) (resi 147 and name HN)   4.0  2.2  1.2
assi (resi 146 and name HN) (resi 147 and name HN)   2.5  0.8  0.3
!Beta-sheet
assi (resi 149 and name HN) (resi 152 and name HN)   3.2  1.2  0.5 
assi (resi 149 and name HN) (resi 150 and name HN)   4.8  3.0  1.0
!Helix H
assi (resi 150 and name HN) (resi 151 and name HN)   3.2  1.2  0.5
assi (resi 151 and name HN) (resi 152 and name HN)   2.5  0.8  0.3
assi (resi 151 and name HN) (resi 153 and name HN)   4.0  2.2  1.2 
assi (resi 152 and name HN) (resi 153 and name HN)   3.2  1.2  0.5
assi (resi 152 and name HN) (resi 155 and name HN)   5.8  4.0  1.2
assi (resi 153 and name HN) (resi 156 and name HN)   4.8  3.0  1.0
assi (resi 153 and name HN) (resi 154 and name HN)   2.5  0.8  0.3
assi (resi 153 and name HN) (resi 155 and name HN)   4.8  3.0  1.0
assi (resi 154 and name HN) (resi 155 and name HN)   2.5  0.8  0.3
assi (resi 154 and name HN) (resi 152 and name HN)   4.0  2.2  1.2 
assi (resi 155 and name HN) (resi 156 and name HN)   2.5  0.8  0.3
assi (resi 155 and name HN) (resi 157 and name HN)   4.0  2.2  1.2
assi (resi 155 and name HN) (resi 158 and name HN)   4.8  3.0  1.0
assi (resi 156 and name HN) (resi 158 and name HN)   4.0  2.2  1.2 
assi (resi 156 and name HN) (resi 157 and name HN)   3.2  1.2  0.5
assi (resi 156 and name HN) (resi 154 and name HN)   4.0  2.2  1.2 
!cterm part
assi (resi 157 and name HN) (resi 158 and name HN)   2.5  0.8  0.3  
assi (resi 158 and name HN) (resi 159 and name HN)   4.0  2.2  1.2
assi (resi 158 and name HN) (resi 160 and name HN)   5.8  4.0  1.2
assi (resi 159 and name HN) (resi 160 and name HN)   3.2  1.2  0.5
assi (resi 160 and name HN) (resi 161 and name HN)   3.2  1.2  0.5 

!Ha to NHs     
assi (resi 89 and name HA) (resi 90 and name HN)     3.0  1.2  0.6 
assi (resi 89 and name HA) (resi 89 and name HN)     3.0  1.2  0.6
assi (resi 90 and name HA) (resi 91 and name HN)     2.5  0.8  0.3
assi (resi 91 and name HA#) (resi 91 and name HN)    2.5  0.8  0.3
assi (resi 91 and name HA#) (resi 92 and name HN)    3.0  1.2  0.6
assi (resi 92 and name HA)  (resi 92 and name HN)    3.0  1.2  0.6 
assi (resi 92 and name HA) (resi 93 and name HN)     2.5  0.8  0.3
!Helix E
assi (resi 95 and name HA) (resi 93 and name HN)     5.8  4.0  1.2
assi (resi 95 and name HA) (resi 94 and name HN)     4.8  3.0  1.0
assi (resi 95 and name HA) (resi 95 and name HN)     3.0  1.2  0.6
assi (resi 94 and name HA) (resi 95 and name HN)     3.8  2.0  0.8
assi (resi 94 and name HA) (resi 96 and name HN)     4.8  3.0  1.0
assi (resi 96 and name HA) (resi 96 and name HN)     3.0  1.2  0.6
assi (resi 97 and name HA) (resi 96 and name HN)     5.8  4.0  1.2
assi (resi 96 and name HA) (resi 97 and name HN)     3.8  2.0  0.8
assi (resi 97 and name HA) (resi 98 and name HN)     3.8  2.0  0.8
assi (resi 98 and name HA) (resi 98 and name HN)     3.0  1.2  0.6
assi (resi 96 and name HA) (resi 99 and name HN)     3.8  2.0  0.8
assi (resi 97 and name HA) (resi 99 and name HN)     3.8  2.0  0.8
assi (resi 98 and name HA) (resi 99 and name HN)     3.8  2.0  0.8
assi (resi 98 and name HA) (resi 100 and name HN)    3.8  2.0  0.8
assi (resi 102 and name HA) (resi 101 and name HN)   5.8  4.0  1.2
assi (resi 98 and name HA) (resi 101 and name HN)    3.8  2.0  0.8
assi (resi 102 and name HA) (resi 102 and name HN)   3.0  1.2  0.6
assi (resi 101 and name HA) (resi 102 and name HN)   3.8  2.0  0.8   
assi (resi 100 and name HA) (resi 102 and name HN)   4.8  3.0  1.0
assi (resi 103 and name HA) (resi 103 and name HN)   3.0  1.2  0.6    
assi (resi 100 and name HA) (resi 103 and name HN)   3.8  2.0  0.8    
assi (resi 102 and name HA) (resi 103 and name HN)   3.8  2.0  0.8 
!Ca2+ loop
assi (resi 102 and name HA) (resi 104 and name HN)   3.8  2.0  0.8
assi (resi 104 and name HA) (resi 104 and name HN)   3.0  1.2  0.6 
assi (resi 101 and name HA) (resi 104 and name HN)   3.0  1.2  0.6 
assi (resi 105 and name HA) (resi 105 and name HN)   3.0  1.2  0.6
assi (resi 104 and name HA) (resi 105 and name HN)   3.8  2.0  0.8  
assi (resi 102 and name HA) (resi 105 and name HN)   3.0  1.2  0.6
assi (resi 105 and name HA) (resi 106 and name HN)   2.5  0.8  0.3 
assi (resi 106 and name HA) (resi 106 and name HN)   3.0  1.2  0.6 
assi (resi 116 and name HA) (resi 106 and name HN)   4.8  3.0  1.0   
assi (resi 107 and name HA) (resi 107 and name HN)   3.0  1.2  0.6
assi (resi 105 and name HA) (resi 107 and name HN)   3.8  2.0  0.8
assi (resi 106 and name HA) (resi 107 and name HN)   3.8  2.0  0.8 
assi (resi 105 and name HA) (resi 108 and name HN)   3.8  2.0  0.8
assi (resi 107 and name HA) (resi 108 and name HN)   3.8  2.0  0.8
assi (resi 108 and name HA) (resi 108 and name HN)   2.5  0.8  0.3
assi (resi 109 and name HA) (resi 109 and name HN)   3.0  1.2  0.6
assi (resi 108 and name HA) (resi 109 and name HN)   2.5  0.8  0.3
assi (resi 110 and name HA#) (resi 109 and name HN)  4.8  3.0  1.0
assi (resi 108 and name HA) (resi 110 and name HN)   3.0  1.2  2.6
assi (resi 109 and name HA) (resi 110 and name HN)   3.0  1.2  2.6
assi (resi 110 and name HA#) (resi 110 and name HN)  3.0  1.2  2.6
!Beta-sheet
assi (resi 111 and name HA) (resi 111 and name HN)   3.0  1.2  0.6
assi (resi 149 and name HA) (resi 111 and name HN)   4.8  3.0  1.0
assi (resi 109 and name HA) (resi 111 and name HN)   4.8  3.0  1.0 
assi (resi 108 and name HA)  (resi 111 and name HN)  4.8  3.0  1.0 
assi (resi 110 and name HA#) (resi 111 and name HN)  3.0  1.2  0.6
assi (resi 111 and name HA) (resi 112 and name HN)   2.5  0.8  0.3
assi (resi 149 and name HA) (resi 112 and name HN)   3.8  2.0  0.8
assi (resi 112 and name HA) (resi 112 and name HN)   3.0  1.2  0.6
assi (resi 113 and name HA) (resi 112 and name HN)   4.8  3.0  1.0
assi (resi 112 and name HA) (resi 113 and name HN)   2.5  0.8  0.3
assi (resi 113 and name HA) (resi 113 and name HN)   3.0  1.2  0.6 
assi (resi 105 and name HA) (resi 113 and name HN)   4.8  3.0  1.0
assi (resi 114 and name HA) (resi 113 and name HN)   5.8  4.0  1.2
!Helix F
assi (resi 113 and name HA) (resi 114 and name HN)   2.5  0.8  0.3
assi (resi 114 and name HA) (resi 114 and name HN)   2.5  0.8  0.3
assi (resi 113 and name HA) (resi 115 and name HN)   4.8  3.0  1.0   
assi (resi 115 and name HA) (resi 115 and name HN)   3.0  1.2  0.6
assi (resi 114 and name HA) (resi 115 and name HN)   3.8  2.0  0.8
assi (resi 116 and name HA) (resi 115 and name HN)   4.8  3.0  1.0 
assi (resi 113 and name HA) (resi 116 and name HN)   4.8  3.0  1.0     
assi (resi 115 and name HA) (resi 116 and name HN)   3.8  2.0  0.8 
assi (resi 116 and name HA) (resi 113 and name HN)   4.8  3.0  1.0 
assi (resi 116 and name HA) (resi 116 and name HN)   3.0  1.2  0.6
assi (resi 116 and name HA) (resi 118 and name HN)   4.8  3.0  1.0 
assi (resi 118 and name HA) (resi 119 and name HN)   3.8  2.0  0.8
assi (resi 116 and name HA) (resi 119 and name HN)   3.8  2.0  0.6
assi (resi 119 and name HA) (resi 119 and name HN)   3.0  1.2  0.6  
assi (resi 120 and name HA) (resi 120 and name HN)   3.0  1.2  0.6 
assi (resi 119 and name HA) (resi 120 and name HN)   3.8  2.0  0.8
assi (resi 116 and name HA) (resi 120 and name HN)   4.8  3.0  1.0
assi (resi 121 and name HA) (resi 121 and name HN)   3.0  1.2  0.6 
assi (resi 120 and name HA) (resi 121 and name HN)   3.8  2.0  0.8
assi (resi 122 and name HA) (resi 121 and name HN)   4.8  3.0  1.0
assi (resi 119 and name HA) (resi 121 and name HN)   4.8  3.0  1.0
assi (resi 122 and name HA) (resi 122 and name HN)   3.0  1.2  0.6
assi (resi 123 and name HA) (resi 122 and name HN)   4.8  3.0  1.0
assi (resi 119 and name HA) (resi 122 and name HN)   3.8  2.0  0.8
assi (resi 122 and name HA) (resi 123 and name HN)   3.8  2.0  0.8
assi (resi 123 and name HA) (resi 123 and name HN)   3.0  1.2  0.6
assi (resi 119 and name HA) (resi 123 and name HN)   4.8  3.0  1.0
assi (resi 124 and name HA) (resi 124 and name HN)   3.0  1.2  0.6
assi (resi 121 and name HA) (resi 124 and name HN)   3.0  1.2  0.6
assi (resi 122 and name HA) (resi 124 and name HN)   3.8  2.0  0.8
assi (resi 123 and name HA) (resi 124 and name HN)   3.8  2.0  0.8
assi (resi 125 and name HA#) (resi 124 and name HN)  4.8  3.0  2.0
!loop
assi (resi 125 and name HA#) (resi 125 and name HN)  3.0  1.2  0.6
assi (resi 124 and name HA) (resi 125 and name HN)   2.5  0.8  0.3
assi (resi 126 and name HA) (resi 126 and name HN)   3.0  1.2  0.6
assi (resi 124 and name HA) (resi 126 and name HN)   3.8  2.0  0.8
assi (resi 125 and name HA#) (resi 126 and name HN)  3.0  1.2  0.6
assi (resi 127 and name HA) (resi 127 and name HN)   3.0  1.2  0.6 
assi (resi 126 and name HA) (resi 127 and name HN)   3.0  1.2  0.6   
assi (resi 127 and name HA) (resi 128 and name HN)   2.5  0.8  0.3
assi (resi 126 and name HA) (resi 128 and name HN)   5.8  4.0  1.2
assi (resi 132 and name HA) (resi 129 and name HN)   5.8  4.0  1.2
assi (resi 129 and name HA) (resi 129 and name HN)   3.0  1.2  0.6
!Helix G  
assi (resi 129 and name HA) (resi 130 and name HN)   2.5  0.8  0.3
assi (resi 130 and name HA) (resi 130 and name HN)   3.0  1.2  0.6
assi (resi 131 and name HA) (resi 131 and name HN)   3.0  1.2  0.6
assi (resi 130 and name HA) (resi 131 and name HN)   3.8  2.0  0.8
assi (resi 132 and name HA) (resi 131 and name HN)   4.8  3.0  1.0
assi (resi 132 and name HA) (resi 132 and name HN)   3.0  1.2  0.6
assi (resi 131 and name HA) (resi 132 and name HN)   3.8  2.0  0.8 
assi (resi 130 and name HA) (resi 132 and name HN)   4.8  3.0  1.0
assi (resi 129 and name HA) (resi 132 and name HN)   4.8  3.0  1.0
assi (resi 129 and name HA) (resi 133 and name HN)   4.8  3.0  1.0
assi (resi 132 and name HA) (resi 133 and name HN)   3.8  2.0  0.8
assi (resi 130 and name HA) (resi 133 and name HN)   3.8  2.0  0.8
assi (resi 133 and name HA) (resi 133 and name HN)   3.0  1.2  0.6
assi (resi 131 and name HA) (resi 133 and name HN)   4.8  3.0  1.0
assi (resi 134 and name HA) (resi 133 and name HN)   5.8  4.0  1.2
assi (resi 132 and name HA) (resi 134 and name HN)   4.8  3.0  1.0
assi (resi 134 and name HA) (resi 134 and name HN)   3.0  1.2  0.6
assi (resi 133 and name HA) (resi 134 and name HN)   3.8  2.0  0.8
assi (resi 131 and name HA) (resi 134 and name HN)   3.8  2.0  0.8
assi (resi 135 and name HA) (resi 135 and name HN)   3.0  1.2  0.6 
assi (resi 132 and name HA) (resi 135 and name HN)   3.8  2.0  0.8 
assi (resi 131 and name HA) (resi 135 and name HN)   4.8  3.0  1.0     
assi (resi 136 and name HA) (resi 136 and name HN)   3.0  1.2  0.6
assi (resi 135 and name HA) (resi 136 and name HN)   3.8  2.0  0.8
assi (resi 133 and name HA) (resi 136 and name HN)   3.8  2.0  0.8  
assi (resi 137 and name HA) (resi 137 and name HN)   3.0  1.2  0.6
assi (resi 134 and name HA) (resi 137 and name HN)   3.8  2.0  0.8
assi (resi 133 and name HA) (resi 137 and name HN)   4.8  3.0  1.0
assi (resi 136 and name HA) (resi 137 and name HN)   3.8  2.0  0.8
assi (resi 139 and name HA) (resi 138 and name HN)   5.8  4.0  1.2
assi (resi 138 and name HA) (resi 138 and name HN)   3.0  1.2  0.6
assi (resi 137 and name HA) (resi 138 and name HN)   3.8  2.0  0.8
assi (resi 140 and name HA#) (resi 139 and name HN)  4.8  3.0  1.0
assi (resi 139 and name HA) (resi 139 and name HN)   3.0  1.2  0.6
assi (resi 138 and name HA) (resi 139 and name HN)   3.8  2.0  0.8

!Ca2+ loop   
assi (resi 140 and name HA#) (resi 140 and name HN)  2.5  0.8  0.3 
assi (resi 137 and name HA) (resi 140 and name HN)   3.8  2.0  0.8
assi (resi 139 and name HA) (resi 140 and name HN)   3.8  2.0  0.8
assi (resi 141 and name HA) (resi 141 and name HN)   3.0  1.2  0.6
assi (resi 137 and name HA) (resi 141 and name HN)   3.8  2.0  0.8
assi (resi 138 and name HA) (resi 141 and name HN)   3.8  2.0  0.8
assi (resi 139 and name HA) (resi 141 and name HN)   3.8  2.0  0.8
assi (resi 140 and name HA#) (resi 141 and name HN)  3.0  1.2  0.6
assi (resi 141 and name HA) (resi 142 and name HN)   2.5  0.8  0.3 
assi (resi 142 and name HA) (resi 142 and name HN)   3.0  1.2  0.6
assi (resi 143 and name HA) (resi 142 and name HN)   4.8  3.0  1.0
assi (resi 144 and name HA) (resi 143 and name HN)   3.8  2.0  0.8  
assi (resi 143 and name HA) (resi 143 and name HN)   3.0  1.2  0.6   
assi (resi 142 and name HA) (resi 143 and name HN)   3.8  2.0  0.8 
assi (resi 144 and name HA) (resi 144 and name HN)   2.5  0.8  0.3
assi (resi 143 and name HA) (resi 144 and name HN)   3.0  1.2  0.6 
assi (resi 142 and name HA) (resi 144 and name HN)   3.8  2.0  0.8
assi (resi 145 and name HA) (resi 145 and name HN)   3.0  1.2  0.6
assi (resi 144 and name HA) (resi 145 and name HN)   3.0  1.2  0.6
assi (resi 143 and name HA) (resi 145 and name HN)   4.8  3.0  1.0
assi (resi 146 and name HA#) (resi 146 and name HN)  2.5  0.8  0.3
assi (resi 144 and name HA) (resi 146 and name HN)   3.0  1.2  0.6 
assi (resi 145 and name HA) (resi 146 and name HN)   3.8  2.0  0.8
!Beta-sheet
assi (resi 147 and name HA) (resi 147 and name HN)   3.0  1.2  0.6  
assi (resi 144 and name HA) (resi 147 and name HN)   5.8  4.0  1.2
assi (resi 145 and name HA) (resi 147 and name HN)   4.8  3.0  1.0
assi (resi 146 and name HA#) (resi 147 and name HN)  3.8  2.0  0.8   
assi (resi 111 and name HA) (resi 148 and name HN)   3.8  2.0  0.8 
assi (resi 148 and name HA) (resi 148 and name HN)   3.0  1.2  0.6
assi (resi 113 and name HA) (resi 148 and name HN)   3.8  2.0  0.8
assi (resi 147 and name HA) (resi 148 and name HN)   2.5  0.8  0.3 
assi (resi 149 and name HA) (resi 149 and name HN)   3.0  1.2  0.6
assi (resi 148 and name HA) (resi 149 and name HN)   2.5  0.8  0.3
assi (resi 152 and name HA) (resi 149 and name HN)   4.8  3.0  1.0

!Helix H
assi (resi 149 and name HA) (resi 150 and name HN)   2.5  0.8  0.3 
assi (resi 150 and name HA) (resi 150 and name HN)   3.0  1.2  0.6
assi (resi 149 and name HA) (resi 151 and name HN)   4.8  3.0  1.0
assi (resi 150 and name HA) (resi 151 and name HN)   3.8  2.0  0.8
assi (resi 151 and name HA) (resi 151 and name HN)   3.0  1.2  0.6 
assi (resi 151 and name HA) (resi 152 and name HN)   3.8  2.0  0.8
assi (resi 152 and name HA) (resi 152 and name HN)   3.0  1.2  0.6
assi (resi 148 and name HA) (resi 152 and name HN)   4.8  3.0  1.0
assi (resi 150 and name HA) (resi 152 and name HN)   4.8  3.0  1.0
assi (resi 151 and name HA) (resi 153 and name HN)   4.8  3.0  1.0 
assi (resi 152 and name HA) (resi 153 and name HN)   3.8  2.0  0.8
assi (resi 153 and name HA) (resi 153 and name HN)   3.0  1.2  0.6   
assi (resi 150 and name HA) (resi 153 and name HN)   3.0  1.2  0.6
assi (resi 154 and name HA) (resi 154 and name HN)   3.0  1.2  0.6 
assi (resi 152 and name HA) (resi 154 and name HN)   3.8  2.0  0.8       
assi (resi 150 and name HA) (resi 154 and name HN)   4.8  3.0  1.0
assi (resi 151 and name HA) (resi 154 and name HN)   3.8  2.0  0.8
assi (resi 155 and name HA) (resi 154 and name HN)   4.8  3.0  1.0
assi (resi 155 and name HA) (resi 155 and name HN)   3.0  1.2  0.6
assi (resi 156 and name HA) (resi 155 and name HN)   5.8  4.0  1.2
assi (resi 154 and name HA) (resi 155 and name HN)   3.8  2.0  0.8
assi (resi 151 and name HA) (resi 155 and name HN)   4.8  3.0  1.0
assi (resi 155 and name HA) (resi 156 and name HN)   3.8  2.0  0.8
assi (resi 156 and name HA) (resi 156 and name HN)   3.0  1.2  0.6
assi (resi 154 and name HA) (resi 156 and name HN)   4.8  3.0  1.0

!cterm part
assi (resi 157 and name HA) (resi 157 and name HN)   3.0  1.2  0.6
assi (resi 156 and name HA) (resi 157 and name HN)   3.8  2.0  0.8
assi (resi 154 and name HA) (resi 157 and name HN)   3.8  2.0  0.8
assi (resi 155 and name HA) (resi 157 and name HN)   3.8  2.0  0.8
assi (resi 158 and name HA) (resi 158 and name HN)   3.0  1.2  0.6 
assi (resi 157 and name HA) (resi 158 and name HN)   3.0  1.2  0.6
assi (resi 155 and name HA) (resi 158 and name HN)   3.0  1.2  0.6
assi (resi 156 and name HA) (resi 159 and name HN)   4.8  3.0  1.0   
assi (resi 157 and name HA) (resi 159 and name HN)   4.8  3.0  1.0
assi (resi 159 and name HA#) (resi 159 and name HN)  3.0  1.2  0.6
assi (resi 158 and name HA) (resi 159 and name HN)   3.0  1.2  0.6
assi (resi 160 and name HA) (resi 160 and name HN)   3.0  1.2  0.6
assi (resi 159 and name HA#) (resi 160 and name HN)  3.0  1.2  0.6
assi (resi 157 and name HA) (resi 160 and name HN)   5.8  4.0  1.2
assi (resi 158 and name HA) (resi 160 and name HN)   5.8  4.0  1.2
assi (resi 161 and name HA) (resi 161 and name HN)   3.0  1.2  0.6
assi (resi 160 and name HA) (resi 161 and name HN)   3.0  1.2  0.6   
 
!H-bonds
assi (resi 112 and name HN) (resi 148 and name O)    2.0  0.4  0.3
assi (resi 148 and name HN) (resi 112 and name O)    2.0  0.4  0.3 
assi (resi 110 and name HN) (resi 105 and name OD#)  2.85 0.4  0.3  
assi (resi 146 and name HN) (resi 141 and name OD#)  2.85 0.4  0.3 
 
!HB to NHs
assi (resi 88 and name HB#) (resi 88 and name HN)   3.0  1.2  0.6
assi (resi 89 and name HB#) (resi 89 and name HN)   3.0  1.2  0.6
assi (resi 88 and name HB#) (resi 89 and name HN)   4.8  3.0  1.0
assi (resi 92 and name HB#) (resi 92 and name HN)   3.0  1.2  0.6
assi (resi 96 and name HB#) (resi 93 and name HN)   3.8  2.0  0.8
assi (resi 93 and name HB#) (resi 94 and name HN)   3.0  1.2  0.6
assi (resi 94 and name HB#) (resi 95 and name HN)   3.0  1.2  0.6
assi (resi 97 and name HB#) (resi 97 and name HN)   3.0  1.2  0.6
assi (resi 98 and name HB#) (resi 98 and name HN)   3.0  1.2  0.6
assi (resi 97 and name HB#) (resi 98 and name HN)   3.0  1.2  0.6
assi (resi 95 and name HB#) (resi 98 and name HN)   5.8  4.0  1.2
assi (resi 99 and name HB#) (resi 98 and name HN)   5.8  4.0  1.2
assi (resi 98 and name HB#) (resi 99 and name HN)   3.8  2.0  0.8
assi (resi 99 and name HB#) (resi 99 and name HN)   3.0  1.2  0.6
assi (resi 99 and name HB#) (resi 100 and name HN)  3.0  1.2  0.6
assi (resi 100 and name HB#) (resi 100 and name HN)  3.0  1.2  0.6
assi (resi 101 and name HB#) (resi 100 and name HN)  4.8  3.0  1.0
assi (resi 101 and name HB#) (resi 101 and name HN)  3.0  1.2  0.6
assi (resi 102 and name HB#) (resi 102 and name HN)  3.0  1.2  0.6
assi (resi 101 and name HB#) (resi 102 and name HN)  3.0  1.2  0.6
assi (resi 102 and name HB#) (resi 103 and name HN)  3.8  2.0  0.8
assi (resi 104 and name HB#) (resi 104 and name HN)  3.0  1.2  0.6
assi (resi 103 and name HB#) (resi 104 and name HN)  3.0  1.2  0.6
assi (resi 104 and name HB#) (resi 105 and name HN)  3.0  1.2  0.6
assi (resi 102 and name HB#) (resi 105 and name HN) 4.8  3.0  1.0 
assi (resi 105 and name HB#) (resi 105 and name HN)  3.0  1.2  0.6
assi (resi 106 and name HB#) (resi 106 and name HN)  3.0  1.2  0.6
assi (resi 116 and name HB#) (resi 106 and name HN)  3.8  2.0  0.8 
assi (resi 106 and name HB#) (resi 107 and name HN)  3.0  1.2  0.6
assi (resi 107 and name HB#) (resi 107 and name HN)  3.0  1.2  0.6
assi (resi 107 and name HB2) (resi 108 and name HN)  3.8  2.0  0.8 
assi (resi 106 and name HB#) (resi 108 and name HN)  4.8  3.0  1.0
assi (resi 108 and name HB#) (resi 108 and name HN)  3.8  2.0  0.8
assi (resi 109 and name HB#) (resi 108 and name HN)  5.8  4.0  1.2
assi (resi 109 and name HB#) (resi 109 and name HN)  3.0  1.2  0.6
assi (resi 108 and name HB#) (resi 109 and name HN)  4.8  3.0  1.0
assi (resi 105 and name HB#) (resi 110 and name HN)  4.8  3.0  1.0
assi (resi 109 and name HB#) (resi 110 and name HN)  4.8  3.0  1.0
assi (resi 108 and name HB#) (resi 110 and name HN)  4.8  3.0  1.0
assi (resi 111 and name HB#) (resi 110 and name HN)  5.8  4.0  1.2
assi (resi 109 and name HB#) (resi 111 and name HN)  4.8  3.0  1.0
assi (resi 111 and name HB#) (resi 111 and name HN)  3.8  2.0  0.8
assi (resi 111 and name HB#) (resi 112 and name HN)  3.0  1.2  0.6
assi (resi 112 and name HB)  (resi 112 and name HN)  3.0  1.2  0.6
assi (resi 147 and name HB#) (resi 112 and name HN)  3.8  2.0  0.8
assi (resi 148 and name HB)  (resi 112 and name HN)  3.0  1.2  0.6
assi (resi 113 and name HB#) (resi 113 and name HN)  3.0  1.2  0.6
assi (resi 112 and name HB)  (resi 113 and name HN)  4.8  3.0  1.0
assi (resi 116 and name HB#) (resi 113 and name HN)  3.0  1.2  0.6
assi (resi 113 and name HB#) (resi 114 and name HN)  3.0  1.2  0.6
assi (resi 114 and name HB#) (resi 114 and name HN)  3.0  1.2  0.6
assi (resi 113 and name HB#) (resi 115 and name HN)  3.8  2.0  0.8
assi (resi 114 and name HB#) (resi 115 and name HN)  3.0  1.2  0.6
assi (resi 115 and name HB#) (resi 115 and name HN)  3.0  1.2  0.6
assi (resi 113 and name HB#) (resi 116 and name HN)  3.8  2.0  0.8
assi (resi 116 and name HB#) (resi 116 and name HN)  3.0  1.2  0.6
assi (resi 115 and name HB#) (resi 116 and name HN)  3.0  1.2  0.6
assi (resi 117 and name HB#) (resi 117 and name HN)  3.0  1.2  0.6
assi (resi 116 and name HB#) (resi 117 and name HN)  3.0  1.2  0.6
assi (resi 119 and name HB) (resi 119 and name HN)   3.0  1.2  0.6
assi (resi 119 and name HB) (resi 120 and name HN)   3.0  1.2  0.6
assi (resi 128 and name HB)  (resi 121 and name HN)  5.8  4.0  1.2 
assi (resi 121 and name HB#) (resi 121 and name HN)  3.0  1.2  0.6
assi (resi 122 and name HB#) (resi 122 and name HN)  3.0  1.2  0.6
assi (resi 122 and name HB#) (resi 123 and name HN)  3.0  1.2  0.6
assi (resi 123 and name HB#) (resi 123 and name HN)  3.0  1.2  0.6
assi (resi 124 and name HB)  (resi 124 and name HN)  3.0  1.2  0.6
assi (resi 122 and name HB#) (resi 124 and name HN)  4.8  3.0  1.0
assi (resi 124 and name HB)  (resi 125 and name HN)  3.8  2.0  0.8
assi (resi 126 and name HB#) (resi 126 and name HN)  3.0  1.2  0.6
assi (resi 124 and name HB)  (resi 126 and name HN)  3.8  2.0  0.8
assi (resi 126 and name HB#) (resi 127 and name HN)  3.0  1.2  0.6
assi (resi 128 and name HB)  (resi 128 and name HN)  3.0  1.2  0.6
assi (resi 128 and name HB)  (resi 129 and name HN)  3.8  2.0  0.8
assi (resi 132 and name HB#) (resi 129 and name HN)  3.8  2.0  0.8
assi (resi 130 and name HB#) (resi 130 and name HN)  3.0  1.2  0.6
assi (resi 132 and name HB#) (resi 131 and name HN)  5.8  4.0  1.2
assi (resi 133 and name HB)  (resi 131 and name HN)  4.8  3.0  1.0
assi (resi 132 and name HB#) (resi 132 and name HN)  3.0  1.2  0.6
assi (resi 131 and name HB#) (resi 132 and name HN)  3.0  1.2  0.6
assi (resi 128 and name HB)  (resi 133 and name HN)  4.8  3.0  1.0
assi (resi 132 and name HB#) (resi 133 and name HN)  3.0  1.2  0.6
assi (resi 133 and name HB)  (resi 133 and name HN)  3.0  1.2  0.6
assi (resi 133 and name HB)  (resi 134 and name HN)  3.0  1.2  0.6
assi (resi 134 and name HB#) (resi 135 and name HN)  3.0  1.2  0.6
assi (resi 135 and name HB#) (resi 136 and name HN)  3.8  2.0  0.8
assi (resi 136 and name HB#) (resi 136 and name HN)  3.0  1.2  0.6
assi (resi 136 and name HB#) (resi 137 and name HN)  3.0  1.2  0.6
assi (resi 138 and name HB#) (resi 137 and name HN)  4.8  3.0  1.0
assi (resi 137 and name HB#) (resi 137 and name HN)  3.0  1.2  0.6
assi (resi 138 and name HB#) (resi 138 and name HN)  3.0  1.2  0.6
assi (resi 137 and name HB#) (resi 138 and name HN)  3.0  1.2  0.6
assi (resi 138 and name HB#) (resi 139 and name HN)  3.0  1.2  0.6
assi (resi 139 and name HB#) (resi 139 and name HN)  3.0  1.2  0.6
assi (resi 156 and name HB#) (resi 140 and name HN)  5.8  4.0  1.2
assi (resi 139 and name HB#) (resi 140 and name HN)  3.8  2.0  0.8
assi (resi 139 and name HB#) (resi 141 and name HN)  5.8  4.0  1.2
assi (resi 141 and name HB#) (resi 141 and name HN)  3.0  1.2  0.6
assi (resi 142 and name HB#) (resi 142 and name HN)  3.0  1.2  0.6
assi (resi 152 and name HB2) (resi 142 and name HN)  4.8  3.0  1.0
assi (resi 143 and name HB#) (resi 143 and name HN)  3.0  1.2  0.6
assi (resi 142 and name HB#) (resi 143 and name HN)  3.8  2.0  0.8
assi (resi 144 and name HB#) (resi 144 and name HN)  3.8  2.0  0.8
assi (resi 143 and name HB#) (resi 144 and name HN)  3.8  2.0  0.8
assi (resi 142 and name HB#) (resi 144 and name HN)  4.8  3.0  1.0
assi (resi 145 and name HB#) (resi 145 and name HN)  3.0  1.2  0.6
assi (resi 144 and name HB#) (resi 145 and name HN)  4.8  3.0  1.0
assi (resi 141 and name HB#) (resi 146 and name HN)  4.8  3.0  1.0
assi (resi 144 and name HB#) (resi 146 and name HN)  5.8  4.0  1.2
assi (resi 147 and name HB#) (resi 147 and name HN)  3.0  1.2  0.6
assi (resi 148 and name HB)  (resi 148 and name HN)  3.0  1.2  0.6
assi (resi 111 and name HB#) (resi 148 and name HN)  3.8  2.0  0.8
assi (resi 112 and name HB)  (resi 148 and name HN)  3.8  2.0  0.8
assi (resi 149 and name HB#) (resi 149 and name HN)  3.0  1.2  0.6
assi (resi 148 and name HB)  (resi 149 and name HN)  3.8  2.0  0.8
assi (resi 149 and name HB#) (resi 150 and name HN)  3.0  1.2  0.6
assi (resi 150 and name HB#) (resi 150 and name HN)  3.0  1.2  0.6
assi (resi 151 and name HB#) (resi 151 and name HN)  3.0  1.2  0.6
assi (resi 150 and name HB#) (resi 151 and name HN)  3.0  1.2  0.6
assi (resi 152 and name HB#) (resi 152 and name HN)  3.0  1.2  0.6
assi (resi 151 and name HB#) (resi 152 and name HN)  3.0  1.2  0.6
assi (resi 152 and name HB#) (resi 153 and name HN)  3.8  2.0  0.8
assi (resi 154 and name HB#) (resi 153 and name HN)  4.8  3.0  1.0
assi (resi 153 and name HB#) (resi 154 and name HN)  3.0  1.2  0.6
assi (resi 154 and name HB#) (resi 154 and name HN)  3.0  1.2  0.6
assi (resi 155 and name HB#) (resi 155 and name HN)  3.0  1.2  0.6
assi (resi 154 and name HB#) (resi 155 and name HN)  3.0  1.2  0.6
assi (resi 155 and name HB#) (resi 156 and name HN)  3.0  1.2  0.6
assi (resi 156 and name HB#) (resi 156 and name HN)  3.0  1.2  0.6
assi (resi 157 and name HB#) (resi 156 and name HN)  4.8  3.0  1.0
assi (resi 156 and name HB#) (resi 157 and name HN)  3.8  2.0  0.8
assi (resi 157 and name HB#) (resi 157 and name HN)  3.0  1.2  0.6
assi (resi 158 and name HB#) (resi 158 and name HN)  3.0  1.2  0.6
assi (resi 157 and name HB#) (resi 158 and name HN)  3.8  2.0  0.8
assi (resi 158 and name HB#) (resi 159 and name HN)  3.8  2.0  0.8
assi (resi 160 and name HB) (resi 160 and name HN)   3.0  1.2  0.6
assi (resi 161 and name HB#) (resi 161 and name HN)  3.0  1.2  0.6

!HG to NHs
assi (resi 93 and name HG2#)  (resi 93 and name HN)   4.8  3.0  1.0
assi (resi 96 and name HG#)   (resi 94 and name HN)   4.8  3.0  1.0
assi (resi 93 and name HG2#)  (resi 94 and name HN)   3.8  2.0  0.8
assi (resi 94 and name HG#)   (resi 95 and name HN)   4.8  3.0  1.0
assi (resi 97 and name HG)    (resi 97 and name HN)   3.0  1.2  0.6
assi (resi 100 and name HG)  (resi 100 and name HN)   3.0  1.2  0.6
assi (resi 100 and name HG)  (resi 101 and name HN)   4.8  3.0  1.0
assi (resi 103 and name HG#) (resi 102 and name HN)   4.8  3.0  1.0
assi (resi 103 and name HG#) (resi 103 and name HN)   3.0  1.2  0.6
assi (resi 102 and name HG#) (resi 104 and name HN)   5.8  4.0  1.2
assi (resi 112 and name HG1#) (resi 105 and name HN)  3.8  2.0  0.8
assi (resi 116 and name HG#)  (resi 106 and name HN)  3.8  2.0  0.8
assi (resi 112 and name HG2#) (resi 112 and name HN)  4.8  3.0  1.0
assi (resi 148 and name HG2#) (resi 112 and name HN)  4.8  3.0  1.0
assi (resi 112 and name HG2#) (resi 113 and name HN)  3.8  2.0  0.8 
assi (resi 119 and name HG1#) (resi 119 and name HN)  3.0  1.2  0.6 
assi (resi 119 and name HG2#) (resi 119 and name HN)  4.8  3.0  1.0
assi (resi 122 and name HG#) (resi 119 and name HN)   4.8  3.0  1.0
assi (resi 117 and name HG)  (resi 119 and name HN)   4.8  3.0  1.0
assi (resi 122 and name HG#)  (resi 122 and name HN)  3.8  2.0  0.8
assi (resi 124 and name HG2#) (resi 124 and name HN)  3.8  2.0  0.8 
assi (resi 124 and name HG2#) (resi 125 and name HN)  4.8  3.0  1.0
assi (resi 126 and name HG#)  (resi 125 and name HN)  3.8  2.0  0.8
assi (resi 124 and name HG2#) (resi 126 and name HN)  4.8  3.0  1.0
assi (resi 126 and name HG#)  (resi 126 and name HN)  3.0  1.2  0.6
assi (resi 126 and name HG#) (resi 127 and name HN)   4.8  3.0  1.0
assi (resi 127 and name HG2#) (resi 127 and name HN)  3.8  2.0  0.8
assi (resi 128 and name HG##) (resi 128 and name HN)  3.8  2.0  0.8
assi (resi 129 and name HG2#) (resi 129 and name HN)  3.8  2.0  0.8
assi (resi 130 and name HG#) (resi 130 and name HN)   3.8  2.0  0.8
assi (resi 129 and name HG2#) (resi 130 and name HN)  4.8  3.0  1.0
assi (resi 133 and name HG2#) (resi 133 and name HN)  4.8  3.0  1.0
assi (resi 133 and name HG2#) (resi 134 and name HN)  4.8  3.0  1.0
assi (resi 135 and name HG#) (resi 135 and name HN)   3.0  1.2  0.6
assi (resi 138 and name HG#) (resi 139 and name HN)   4.8  3.0  1.0
assi (resi 147 and name HG#) (resi 147 and name HN)   3.0  1.2  0.6
assi (resi 147 and name HG#) (resi 148 and name HN)   4.8  3.0  1.0
assi (resi 148 and name HG##) (resi 148 and name HN)  3.8  2.0  0.8
assi (resi 148 and name HG##) (resi 149 and name HN)  3.8  2.0  0.8
assi (resi 152 and name HG#)  (resi 149 and name HN)  3.0  1.2  0.6
assi (resi 152 and name HG#) (resi 152 and name HN)   3.0  1.2  0.6
assi (resi 148 and name HG2#) (resi 152 and name HN)  4.8  3.0  1.0
assi (resi 148 and name HG2#) (resi 153 and name HN)  3.8  2.0  0.8
assi (resi 154 and name HG)  (resi 154 and name HN)   3.8  2.0  0.8
assi (resi 155 and name HG#) (resi 155 and name HN)   3.0  1.2  0.6
assi (resi 155 and name HG#) (resi 156 and name HN)   4.8  3.0  1.0
assi (resi 160 and name HG##) (resi 160 and name HN)  3.8  2.0  0.8
assi (resi 160 and name HG##) (resi 161 and name HN)  4.8  3.0  1.0 
assi (resi 161 and name HG#) (resi 161 and name HN)   3.0  1.2  0.6

!HD* to NHs
assi (resi 97 and name HD2#) (resi 97 and name HN)    4.8  3.0  1.0
assi (resi 136 and name HD##) (resi 136 and name HN)  4.8  3.0  1.0
assi (resi 154 and name HD##) (resi 154 and name HN)  3.8  2.0  0.8
assi (resi 97 and name HD2#) (resi 157 and name HN)   5.8  4.0  1.2

!HE* to NHs
assi (resi 137 and name HE#)  (resi 114 and name HN)  4.8  3.0  1.0
 
!HA* to HA*
assi (resi 105 and name HA)  (resi 106 and name HA)   4.8  3.0  1.0
assi (resi 111 and name HA)  (resi 149 and name HA)   3.0  1.2  0.6
assi (resi 113 and name HA)  (resi 114 and name HA)   4.8  3.0  1.0
assi (resi 129 and name HA)  (resi 130 and name HA)   4.8  3.0  1.0
assi (resi 140 and name HA#) (resi 156 and name HA)   4.8  3.0  1.0
assi (resi 150 and name HA)  (resi 151 and name HA)   4.8  3.0  1.0
assi (resi 150 and name HA)  (resi 149 and name HA)   4.8  3.0  1.0
assi (resi 160 and name HA)  (resi 161 and name HA)   4.8  3.0  1.0

assi (resi 145 and name HA)  (resi 146 and name HA#)  4.8  3.0  1.0
assi (resi 144 and name HA)  (resi 145 and name HA)   4.8  3.0  1.0
assi (resi 144 and name HA)  (resi 143 and name HA)   4.8  3.0  1.0
assi (resi 143 and name HA)  (resi 142 and name HA)   4.8  3.0  1.0
assi (resi 140 and name HA#) (resi 141 and name HA)   4.8  3.0  1.0
assi (resi 140 and name HA#) (resi 139 and name HA)   4.8  3.0  1.0
assi (resi 140 and name HA#) (resi 137 and name HA)   4.8  3.0  1.0
assi (resi 135 and name HA)  (resi 132 and name HA)   5.8  4.0  1.2
assi (resi 134 and name HA)  (resi 133 and name HA)   4.8  3.0  1.0
assi (resi 132 and name HA)  (resi 133 and name HA)   4.8  3.0  1.0
assi (resi 132 and name HA)  (resi 134 and name HA)   5.8  4.0  1.2
assi (resi 131 and name HA)  (resi 130 and name HA)   4.8  3.0  1.0
assi (resi 130 and name HA)  (resi 133 and name HA)   5.8  4.0  1.2
assi (resi 129 and name HA)  (resi 128 and name HA)   4.8  3.0  1.0
assi (resi 127 and name HA)  (resi 128 and name HA)   4.8  3.0  1.0
assi (resi 126 and name HA)  (resi 125 and name HA#)  4.8  3.0  1.0
assi (resi 124 and name HA)  (resi 125 and name HA#)  4.8  3.0  1.0
assi (resi 122 and name HA)  (resi 123 and name HA)   4.8  3.0  1.0
assi (resi 122 and name HA)  (resi 119 and name HA)   4.8  3.0  1.0
assi (resi 117 and name HA)  (resi 104 and name HA)   4.8  3.0  1.0
assi (resi 117 and name HA)  (resi 120 and name HA)   4.8  3.0  1.0
assi (resi 113 and name HA)  (resi 147 and name HA)   3.0  1.2  0.6
assi (resi 109 and name HA)  (resi 110 and name HA#)  4.8  3.0  1.0
assi (resi 109 and name HA)  (resi 108 and name HA)   4.8  3.0  1.0
assi (resi 107 and name HA)  (resi 106 and name HA)   4.8  3.0  1.0
assi (resi 105 and name HA)  (resi 112 and name HA)   3.8  2.0  0.8

!HA* to HB*
assi (resi 93 and name HA)   (resi 93 and name HB)    3.0  1.2  0.6
assi (resi 94 and name HA)   (resi 94 and name HB#)   3.0  1.2  0.6
assi (resi 96 and name HA)   (resi 96 and name HB#)   3.0  1.2  0.6
assi (resi 96 and name HA)   (resi 99 and name HB#)   3.8  2.0  0.8
assi (resi 98 and name HA)   (resi 98 and name HB#)   3.0  1.2  0.6
assi (resi 98 and name HA)   (resi 101 and name HB#)  3.0  1.2  0.6
assi (resi 98 and name HA)   (resi 97 and name HB#)   4.8  3.0  1.0
assi (resi 102 and name HA)  (resi 102 and name HB#)  3.0  1.2  0.6
assi (resi 103 and name HA)  (resi 102 and name HB#)  4.8  3.0  1.0
assi (resi 105 and name HA)  (resi 104 and name HB#)  4.8  3.0  1.0
assi (resi 105 and name HA)  (resi 106 and name HB#)  4.8  3.0  1.0
assi (resi 105 and name HA)  (resi 105 and name HB#)  3.0  1.2  0.6
assi (resi 106 and name HA)  (resi 106 and name HB#)  3.0  1.2  0.6 
assi (resi 107 and name HA)  (resi 107 and name HB#)  3.0  1.2  0.6  
assi (resi 108 and name HA)  (resi 108 and name HB#)  3.0  1.2  0.6  
assi (resi 109 and name HA)  (resi 108 and name HB#)  4.8  3.0  1.0
assi (resi 109 and name HA)  (resi 109 and name HB#)  3.0  1.2  0.6
assi (resi 111 and name HA)  (resi 147 and name HB#)  4.8  3.0  1.0
assi (resi 111 and name HA)  (resi 149 and name HB#)  3.8  2.0  0.8
assi (resi 111 and name HA)  (resi 112 and name HB)   4.8  3.0  1.0
assi (resi 111 and name HA)  (resi 111 and name HB#)  3.0  1.2  0.6
assi (resi 112 and name HA)  (resi 111 and name HB#)  4.8  3.0  1.0 
assi (resi 112 and name HA)  (resi 112 and name HB)   3.0  1.2  0.6
assi (resi 113 and name HA)  (resi 147 and name HB#)  3.8  2.0  0.8
assi (resi 113 and name HA)  (resi 113 and name HB#)  3.0  1.2  0.6
assi (resi 115 and name HA)  (resi 115 and name HB#)  3.0  1.2  0.6
assi (resi 116 and name HA)  (resi 116 and name HB#)  3.0  1.2  0.6
assi (resi 119 and name HA)  (resi 120 and name HB#)  5.8  4.0  1.2
assi (resi 123 and name HA)  (resi 123 and name HB#)  3.0  1.2  0.6
assi (resi 124 and name HA)  (resi 123 and name HB#)  4.8  3.0  1.0
assi (resi 124 and name HA)  (resi 124 and name HB)   3.0  1.2  0.6
assi (resi 126 and name HA)  (resi 126 and name HB#)  3.0  1.2  0.6
assi (resi 127 and name HA)  (resi 128 and name HB)   4.8  3.0  1.0
assi (resi 129 and name HA)  (resi 130 and name HB#)  4.8  3.0  1.0
assi (resi 131 and name HA)  (resi 131 and name HB#)  3.0  1.2  0.6
assi (resi 132 and name HA)  (resi 131 and name HB#)  4.8  3.0  1.0
assi (resi 132 and name HA)  (resi 132 and name HB#)  3.0  1.2  0.6
assi (resi 134 and name HA)  (resi 134 and name HB#)  3.0  1.2  0.6
assi (resi 134 and name HA)  (resi 114 and name HB#)  4.8  3.0  1.0
assi (resi 135 and name HA)  (resi 135 and name HB#)  3.0  1.2  0.6
assi (resi 137 and name HA)  (resi 148 and name HB)   4.8  3.0  1.0
assi (resi 139 and name HA)  (resi 138 and name HB#)  4.8  3.0  1.0
assi (resi 139 and name HA)  (resi 139 and name HB#)  3.0  1.2  0.6
assi (resi 141 and name HA)  (resi 142 and name HB#)  4.8  3.0  1.0
assi (resi 141 and name HA)  (resi 141 and name HB#)  3.0  1.2  0.6
assi (resi 142 and name HA)  (resi 142 and name HB#)  3.0  1.2  0.6
assi (resi 143 and name HA)  (resi 144 and name HB#)  4.8  3.0  1.0
assi (resi 143 and name HA)  (resi 143 and name HB#)  3.0  1.2  0.6
assi (resi 144 and name HA)  (resi 144 and name HB#)  3.0  1.2  0.6
assi (resi 145 and name HA)  (resi 145 and name HB#)  3.0  1.2  0.6 
assi (resi 147 and name HA)  (resi 147 and name HB#)  3.0  1.2  0.6
assi (resi 147 and name HA)  (resi 112 and name HB)   4.8  3.0  1.0
assi (resi 149 and name HA)  (resi 150 and name HB#)  4.8  3.0  1.0
assi (resi 149 and name HA)  (resi 149 and name HB#)  3.0  1.2  0.6 
assi (resi 150 and name HA)  (resi 150 and name HB#)  3.0  1.2  0.6 
assi (resi 150 and name HA)  (resi 101 and name HB#)  3.8  2.0  0.8
assi (resi 151 and name HA)  (resi 154 and name HB#)  3.8  2.0  0.8 
assi (resi 151 and name HA)  (resi 151 and name HB#)  3.0  1.2  0.6
assi (resi 152 and name HA)  (resi 155 and name HB#)  3.8  2.0  0.8
assi (resi 152 and name HA)  (resi 152 and name HB#)  3.0  1.2  0.6 
assi (resi 154 and name HA)  (resi 97 and name HB#)   3.8  2.0  0.8
assi (resi 157 and name HA)  (resi 157 and name HB#)  3.0  1.2  0.6
assi (resi 161 and name HA)  (resi 160 and name HB)   4.8  3.0  1.0
assi (resi 161 and name HA)  (resi 161 and name HB#)  3.0  1.2  0.6 

!HA* to HG*
assi (resi 93 and name HA)   (resi 93 and name HG#)   3.0  1.2  0.6
assi (resi 94 and name HA)   (resi 94 and name HG#)   3.0  1.2  0.6
assi (resi 97 and name HA)   (resi 97 and name HG)    3.0  1.2  0.6
assi (resi 102 and name HA)  (resi 102 and name HG#)  3.8  2.0  0.8
assi (resi 105 and name HA)  (resi 112 and name HG1#) 3.0  1.2  0.6
assi (resi 106 and name HA)  (resi 106 and name HG#)  3.0  1.2  0.6
assi (resi 112 and name HA)  (resi 112 and name HG1#) 3.0  1.2  0.6
assi (resi 112 and name HA)  (resi 112 and name HG2#) 3.0  1.2  0.6 
assi (resi 113 and name HA)  (resi 147 and name HG#)  4.8  3.0  1.0
assi (resi 116 and name HA)  (resi 106 and name HG#)  3.8  2.0  1.2
assi (resi 116 and name HA)  (resi 119 and name HG1#) 3.8  2.0  0.8
assi (resi 116 and name HA)  (resi 116 and name HG#)  3.0  1.2  0.6
assi (resi 119 and name HA)  (resi 119 and name HG##) 3.0  1.2  0.6
assi (resi 122 and name HA)  (resi 122 and name HG#)  3.0  1.2  0.6
assi (resi 124 and name HA)  (resi 124 and name HG1)  3.8  2.0  0.8
assi (resi 124 and name HA)  (resi 124 and name HG2#) 3.0  1.2  0.6
assi (resi 126 and name HA)  (resi 127 and name HG2#) 4.8  3.0  1.0
assi (resi 126 and name HA)  (resi 126 and name HG#)  3.0  1.2  0.6
assi (resi 127 and name HA)  (resi 127 and name HG2#) 3.0  1.2  0.6
assi (resi 129 and name HA)  (resi 129 and name HG2#) 3.8  2.0  0.8 
assi (resi 133 and name HA)  (resi 133 and name HG##) 3.0  1.2  0.6
assi (resi 134 and name HA)  (resi 133 and name HG2#) 4.8  3.0  1.0
assi (resi 137 and name HA)  (resi 137 and name HG#)  3.0  1.2  0.6
assi (resi 140 and name HA#) (resi 148 and name HG1#) 3.8  2.0  0.8  
assi (resi 141 and name HA)  (resi 142 and name HG#)  4.8  3.0  1.0
assi (resi 142 and name HA)  (resi 142 and name HG#)  3.0  1.2  0.6
assi (resi 147 and name HA)  (resi 147 and name HG#)  3.0  1.2  0.6
assi (resi 148 and name HA)  (resi 148 and name HG##) 3.0  1.2  0.6
assi (resi 149 and name HA)  (resi 148 and name HG2#) 4.8  3.0  1.0
assi (resi 151 and name HA)  (resi 154 and name HG)   4.8  3.0  1.0  
assi (resi 152 and name HA)  (resi 152 and name HG#)  3.0  1.2  0.6
assi (resi 153 and name HA) (resi 148 and name HG2#)  3.0  1.2  0.6
assi (resi 154 and name HA)  (resi 97 and name HG)    5.8  4.0  1.2
assi (resi 156 and name HA) (resi 160 and name HG1#)  4.8  3.0  1.0              
assi (resi 157 and name HA)  (resi 160 and name HG2#) 3.0  1.2  0.6
assi (resi 157 and name HA)  (resi 160 and name HG1#) 4.8  3.0  1.0
assi (resi 160 and name HA)  (resi 160 and name HG##) 3.0  1.2  0.6 
assi (resi 161 and name HA)  (resi 161 and name HG#)  3.8  2.0  0.8 

!HA* to HD*
assi (resi 97 and name HA)   (resi 97 and name HD1#)  3.8  2.0  0.8 
assi (resi 97 and name HA)   (resi 97 and name HD2#)  3.0  1.2  0.6 
assi (resi 102 and name HA)  (resi 102 and name HD#)  4.8  3.0  1.0
assi (resi 106 and name HA)  (resi 106 and name HD#)  3.0  1.2  0.6
assi (resi 116 and name HA)  (resi 119 and name HD#)  3.8  2.0  0.8 
assi (resi 119 and name HA)  (resi 119 and name HD1#) 4.8  3.0  1.0 
assi (resi 133 and name HA)  (resi 136 and name HD1#) 3.8  2.0  0.8 
assi (resi 137 and name HA)  (resi 148 and name HD1#) 3.8  2.0  0.8
assi (resi 139 and name HA)  (resi 142 and name HD#)  4.8  3.0  1.0
assi (resi 140 and name HA#) (resi 148 and name HD1#) 3.8  2.0  0.8
assi (resi 142 and name HA)  (resi 142 and name HD#)  3.0  1.2  0.6
assi (resi 147 and name HA)  (resi 147 and name HD#)  4.8  3.0  1.0
assi (resi 150 and name HA)  (resi 154 and name HD##) 5.8  4.0  1.2
assi (resi 158 and name HA)  (resi 158 and name HD#)  4.8  3.0  1.0

!HA* to HE*
assi (resi 106 and name HA)  (resi 106 and name HE#)  3.8  2.0  0.8 
assi (resi 113 and name HA)  (resi 137 and name HE#)  3.0  1.2  0.6 
assi (resi 137 and name HA)  (resi 137 and name HE#)  3.8  2.0  0.8
assi (resi 147 and name HA)  (resi 137 and name HE#)  3.0  1.2  0.6 
assi (resi 157 and name HA)  (resi 157 and name HE#)  3.8  2.0  0.8

!Aromatics
assi (resi 101 and name HD#) (resi 102 and name HA)   4.8  3.0  1.0
assi (resi 101 and name HE#) (resi 102 and name HA)   4.8  3.0  1.0
assi (resi 101 and name HE#) (resi 111 and name HA)   3.8  2.0  0.8
assi (resi 101 and name HE#) (resi 112 and name HG1#) 3.8  2.0  0.8
assi (resi 101 and name HE#) (resi 148 and name HG2#) 4.8  3.0  1.0
assi (resi 101 and name HE#) (resi 149 and name HA)   3.8  2.0  0.8
assi (resi 101 and name HE#) (resi 150 and name HA)   4.8  3.0  1.0
assi (resi 101 and name HZ)  (resi 110 and name HA#)  4.8  3.0  1.0 
assi (resi 101 and name HZ)  (resi 111 and name HA)   3.0  1.2  0.6
assi (resi 101 and name HZ)  (resi 149 and name HA)   3.0  1.2  0.6  
assi (resi 101 and name HZ)  (resi 150 and name HA)   4.8  3.0  1.0
assi (resi 111 and name HD#) (resi 111 and name HN)   3.8  2.0  0.8
assi (resi 111 and name HD#) (resi 111 and name HA)   3.8  2.0  0.8
assi (resi 111 and name HD#) (resi 111 and name HB#)  3.0  1.2  0.6
assi (resi 111 and name HD#) (resi 110 and name HA#)  4.8  3.0  1.0
assi (resi 111 and name HD#) (resi 112 and name HN)   4.8  3.0  1.0
assi (resi 111 and name HD#) (resi 147 and name HD#)  4.8  3.0  1.0
assi (resi 111 and name HD#) (resi 147 and name HB#)  4.8  3.0  1.0 
assi (resi 111 and name HD#) (resi 147 and name HG#)  5.8  4.0  1.2 
assi (resi 111 and name HD#) (resi 149 and name HA)   4.8  3.0  1.0
assi (resi 111 and name HD#) (resi 149 and name HB#)  3.8  2.0  0.8
assi (resi 111 and name HE#) (resi 110 and name HA#)  4.8  3.0  1.0 
assi (resi 111 and name HE#) (resi 147 and name HB#)  5.8  4.0  1.2
assi (resi 111 and name HE#) (resi 149 and name HB#)  3.8  2.0  0.8
assi (resi 150 and name HD#) (resi 98 and name HA)    3.8  2.0  0.8
assi (resi 150 and name HD#) (resi 150 and name HN)   4.8  3.0  1.0
assi (resi 150 and name HD#) (resi 150 and name HA)   3.0  1.2  0.6
assi (resi 150 and name HD#) (resi 150 and name HB#)  3.0  1.2  0.6
assi (resi 150 and name HD#) (resi 151 and name HN)   4.8  3.0  1.0
assi (resi 150 and name HD#) (resi 151 and name HA)   4.8  3.0  1.0
assi (resi 150 and name HD#) (resi 153 and name HN)   5.8  4.0  1.2 
assi (resi 150 and name HD#) (resi 154 and name HD2#) 3.8  2.0  0.8
assi (resi 150 and name HE#) (resi 98 and name HB#)   3.8  2.0  0.8
assi (resi 150 and name HE#) (resi 98 and name HN)    4.8  3.0  1.0
assi (resi 150 and name HE#) (resi 98 and name HA)    3.8  2.0  0.8 
assi (resi 150 and name HE#) (resi 99 and name HN)    5.8  4.0  1.2  
assi (resi 150 and name HE#) (resi 101 and name HB#)  5.8  4.0  1.2
assi (resi 150 and name HE#) (resi 150 and name HA)   4.8  3.0  1.0
assi (resi 150 and name HE#) (resi 150 and name HB#)  4.8  3.0  0.8
assi (resi 150 and name HE#) (resi 151 and name HN)   5.8  4.0  1.2
assi (resi 150 and name HE#) (resi 151 and name HA)   5.8  4.0  1.2
assi (resi 150 and name HE#) (resi 154 and name HG)   4.8  3.0  0.8
assi (resi 150 and name HE#) (resi 154 and name HD2#) 3.8  2.0  0.8 
assi (resi 156 and name HD#) (resi 139 and name HN)   5.8  4.0  1.2
assi (resi 156 and name HD#) (resi 140 and name HN)   4.8  3.0  1.0
assi (resi 156 and name HD#) (resi 140 and name HA#)  3.0  1.2  0.6
assi (resi 156 and name HE#) (resi 137 and name HA)   5.8  4.0  1.2
assi (resi 156 and name HE#) (resi 139 and name HN)   5.8  4.0  1.2
assi (resi 156 and name HE#) (resi 139 and name HA)   4.8  3.0  1.0
assi (resi 156 and name HE#) (resi 139 and name HB#)  3.8  2.0  0.8 
assi (resi 156 and name HE#) (resi 140 and name HN)   3.8  2.0  0.8
assi (resi 156 and name HE#) (resi 140 and name HA#)  4.8  3.0  1.0
assi (resi 156 and name HZ)  (resi 139 and name HN)   4.8  3.0  1.0
assi (resi 156 and name HZ)  (resi 139 and name HB#)  4.8  3.0  1.0
assi (resi 156 and name HZ)  (resi 140 and name HN)   5.8  4.0  1.2

!MIX
assi (resi 92 and name HB#) (resi 96 and name HG#)    3.8  2.0  0.8
assi (resi 92 and name HG#) (resi 96 and name HB#)    4.8  3.0  0.0
assi (resi 97 and name HD##) (resi 157 and name HB#)  3.0  1.2  0.6
assi (resi 104 and name HB#) (resi 112 and name HD1#) 3.0  1.2  0.6
assi (resi 111 and name HB#) (resi 147 and name HB#)  3.0  1.2  0.6
assi (resi 111 and name HB#) (resi 147 and name HD#)  3.0  1.2  0.6
assi (resi 111 and name HB#) (resi 147 and name HG#)  4.8  3.0  1.0
assi (resi 117 and name HD2#) (resi 137 and name HE#) 3.8  2.0  0.8 

!not checked
assi (resi 106 and name HB#) (resi 116 and name HG1)  3.8  2.0  0.8
assi (resi 106 and name HB2) (resi 119 and name HD1#) 4.8  3.0  1.0 
assi (resi 106 and name HG2) (resi 116 and name HG1)  3.8  2.0  0.8
assi (resi 106 and name HG2) (resi 119 and name HD1#) 4.8  3.0  1.0
assi (resi 106 and name HD1) (resi 119 and name HD11) 3.8  2.0  0.8 
assi (resi 106 and name HE2) (resi 119 and name HG23) 3.8  2.0  0.8 
assi (resi 106 and name HE2) (resi 119 and name HB)   5.8  4.0  1.2

!NH2's
assi (resi 107 and name HD2#) (resi 107 and name HB#)  3.8  2.0  0.8 
assi (resi 122 and name HE2#) (resi 122 and name HG#)  4.8  3.0  1.0
assi (resi 143 and name HD2#) (resi 143 and name HB#)  3.8  2.0  0.8 
assi (resi 144 and name HD2#) (resi 144 and name HB#)  3.8  2.0  0.8 

!Mets
assi (resi 103 and name HE#)  (resi 103 and name HA)   4.8  3.0  1.0
assi (resi 120 and name HE#)  (resi 104 and name HE#)  4.8  3.0  1.0
assi (resi 120 and name HE#)  (resi 104 and name HD#)  4.8  3.0  1.0
assi (resi 120 and name HE#)  (resi 104 and name HZ)   4.8  3.0  1.0
assi (resi 120 and name HE#)  (resi 120 and name HG#)  3.8  2.0  0.8
assi (resi 120 and name HE#)  (resi 120 and name HB#)  4.8  3.0  1.0
assi (resi 120 and name HE#)  (resi 117 and name HD#)  4.8  3.0  1.0
assi (resi 120 and name HE#)  (resi 121 and name HD1#) 4.8  3.0  1.0
assi (resi 157 and name HE#)  (resi 153 and name HE#)  4.8  3.0  1.0
assi (resi 157 and name HE#)  (resi 153 and name HD#)  5.8  4.0  1.2
assi (resi 157 and name HE#)  (resi 97 and name HD#)   5.8  4.0  1.2

assi (resi 120 and name HE#)  (resi 121 and name HB#)  4.8  3.0  1.0
assi (resi 120 and name HE#)  (resi 124 and name HG2#) 4.8  3.0  1.0
assi (resi 120 and name HE#)  (resi 121 and name HG)   4.8  3.0  1.0

! Leu's
assi (resi 128 and name HG2#)  (resi 121 and name HB#)  4.8  3.0  1.0
assi (resi 128 and name HG2#)  (resi 130 and name HA)   5.8  4.0  1.2
assi (resi 128 and name HG2#)  (resi 132 and name HA)   5.8  4.0  1.2
assi (resi 128 and name HG2#)  (resi 132 and name HB#)  4.8  3.0  1.0

!Ile
assi (resi 133 and name HG2#)  (resi 130 and name HA)   4.8  3.0  1.0
assi (resi 133 and name HG2#)  (resi 118 and name HA)   3.8  2.0  0.8
assi (resi 133 and name HG2#)  (resi 114 and name HA)   4.8  3.0  1.0
assi (resi 133 and name HG2#)  (resi 117 and name HB#)  3.8  2.0  0.8
assi (resi 133 and name HG2#)  (resi 117 and name HG)   3.8  2.0  0.8
assi (resi 148 and name HG1#)  (resi 137 and name HE#)  3.0  1.2  0.6
assi (resi 119 and name HG2#)  (resi 106 and name HB#)  4.8  3.0  1.0


! Ca site III
! removed because Ca is attached to D105
!!!!assi (resi 105 and name OD*)   (resi 162 and name CAL) 3.8 2.0 0.8
assi (resi 107 and name OD1)   (resi 162 and name CAL) 3.0 1.2 0.6
assi (resi 109 and name OD*)   (resi 162 and name CAL) 3.8 2.0 0.8
assi (resi 111 and name O)   (resi 162 and name CAL)   3.0 1.2 0.6
! intervening H20 is ligand from D113
!!!assi (resi 113 and name OD*)   (resi 162 and name CAL) 4.0 3.0 2.0
assi (resi 116 and name OE1)   (resi 162 and name CAL) 3.0 1.2 0.6
assi (resi 116 and name OE2)   (resi 162 and name CAL) 3.0 1.2 0.6

! Ca site IV
! removed because Ca is attached to D141
!!!!assi (resi 141 and name OD*)   (resi 163 and name CAL) 3.8 2.0 0.8
assi (resi 143 and name OD1)   (resi 163 and name CAL) 3.0 1.2 0.6
assi (resi 145 and name OD*)   (resi 163 and name CAL) 3.8 2.0 0.8
assi (resi 147 and name O)   (resi 163 and name CAL) 3.0 1.2 0.6
! intervening H20 is ligand from D149
!!!assi (resi 149 and name  )   (resi 163 and name CAL) 3.8 2.0 0.8
assi (resi 152 and name  OE1)   (resi 163 and name CAL) 3.0 1.2 0.6
assi (resi 152 and name  OE2)   (resi 163 and name CAL) 3.0 1.2 0.6


  assign ( resid 87 and name HN)  ( resid 87 and name N)
         ( resid 87 and name CA)  ( resid 87 and name HA) 1.0 -141.46 30.0 2 
  assign ( resid 88 and name HN)  ( resid 88 and name N)
         ( resid 88 and name CA)  ( resid 88 and name HA) 1.0 -143.02 30.0 2 
  assign ( resid 89 and name HN)  ( resid 89 and name N)
         ( resid 89 and name CA)  ( resid 89 and name HA) 1.0 -137.45 30.0 2 
  assign ( resid 90 and name HN)  ( resid 90 and name N) 
         ( resid 90 and name CA)  ( resid 90 and name HA) 1.0 -149.33 30.0 2 
  assign ( resid 91 and name HN)  ( resid 91 and name N)
         ( resid 91 and name CA)  ( resid 91 and name HA2) 1.0 -138.65 30.0 2 
  assign ( resid 92 and name HN)  ( resid 92 and name N)
         ( resid 92 and name CA)  ( resid 92 and name HA) 1.0 -143.10 30.0 2 
!Helix E       
  assign ( resid 93 and name HN)  ( resid 93 and name N) 
         ( resid 93 and name CA)  ( resid 93 and name HA) 1.0 -141.23 20.0 2 
  assign ( resid 94 and name HN)  ( resid 94 and name N)
         ( resid 94 and name CA)  ( resid 94 and name HA) 1.0 -122.62 20.0 2 
  assign ( resid 95 and name HN)  ( resid 95 and name N)
         ( resid 95 and name CA)  ( resid 95 and name HA) 1.0 -124.00 20.0 2 
  assign ( resid 96 and name HN)  ( resid 96 and name N)
         ( resid 96 and name CA)  ( resid 96 and name HA) 1.0 -131.17 20.0 2
  assign ( resid 97 and name HN)  ( resid 97 and name N)
         ( resid 97 and name CA)  ( resid 97 and name HA) 1.0 -117.0 20.0 2
  assign ( resid 98 and name HN)  ( resid 98 and name N)
         ( resid 98 and name CA)  ( resid 98 and name HA) 1.0 -118.65 20.0 2
  assign ( resid 99 and name HN)  ( resid 99 and name N)
         ( resid 99 and name CA)  ( resid 99 and name HA) 1.0 -126.20 20.0 2 
  assign ( resid 100 and name HN) ( resid 100 and name N)
         ( resid 100 and name CA) ( resid 100 and name HA) 1.0 -123.62 20.0 2
  assign ( resid 101 and name HN) ( resid 101 and name N)
         ( resid 101 and name CA) ( resid 101 and name HA) 1.0 -112.53 20.0 2
  assign ( resid 102 and name HN) ( resid 102 and name N)
         ( resid 102 and name CA) ( resid 102 and name HA) 1.0 -123.08 20.0 2
  assign ( resid 103 and name HN) ( resid 103 and name N)
         ( resid 103 and name CA) ( resid 103 and name HA) 1.0 -132.50 20.0 2 
!Ca2+ loop       
  assign ( resid 104 and name HN) ( resid 104 and name N)
         ( resid 104 and name CA) ( resid 104 and name HA) 1.0 -143.96 30.0 2
  assign ( resid 105 and name HN) ( resid 105 and name N)
         ( resid 105 and name CA) ( resid 105 and name HA) 1.0 -139.48 30.0 2
  assign ( resid 106 and name HN) ( resid 106 and name N)
         ( resid 106 and name CA) ( resid 106 and name HA) 1.0 -128.00 50.0 2 
!!Lys106 value from x-ray
  assign ( resid 107 and name HN) ( resid 107 and name N)
         ( resid 107 and name CA) ( resid 107 and name HA) 1.0 -150.56 30.0 2
  assign ( resid 108 and name HN) ( resid 108 and name N)
         ( resid 108 and name CA) ( resid 108 and name HA) 1.0 +1.00 30.0 2 
!!A108 value from x-ray       
   assign ( resid 109 and name HN) ( resid 109 and name N)
          ( resid 109 and name CA) ( resid 109 and name HA) 1.0 -142.32 30.0 2 
   assign ( resid 109 and name C) ( resid 110 and name N)        
          ( resid 110 and name CA) ( resid 110 and name C) 1.0 +95.00 30.0 2  
!!Gly110 Phi value from x-ray
!Beta-sheet       
   assign ( resid 111 and name HN) ( resid 111 and name N) 
          ( resid 111 and name CA) ( resid 111 and name HA) 1.0 -210.9 20.0 2 
   assign ( resid 112 and name HN) ( resid 112 and name N) 
          ( resid 112 and name CA) ( resid 112 and name HA) 1.0 -210.4 20.0 2 
   assign ( resid 113 and name HN) ( resid 113 and name N) 
          ( resid 113 and name CA) ( resid 113 and name HA) 1.0 -214.1 20.0 2 
!Helix F
   assign ( resid 114 and name HN) ( resid 114 and name N) 
          ( resid 114 and name CA) ( resid 114 and name HA) 1.0 -114.59 40.0 2 
   assign ( resid 115 and name HN) ( resid 115 and name N) 
          ( resid 115 and name CA) ( resid 115 and name HA) 1.0 -129.84 20.0 2 
   assign ( resid 116 and name HN) ( resid 116 and name N) 
          ( resid 116 and name CA) ( resid 116 and name HA) 1.0 -112.44 20.0 2 
   assign ( resid 117 and name HN) ( resid 117 and name N) 
          ( resid 117 and name CA) ( resid 117 and name HA) 1.0 -120.82 20.0 2 
   assign ( resid 118 and name HN) ( resid 118 and name N) 
          ( resid 118 and name CA) ( resid 118 and name HA) 1.0 -117.0 20.0 2 
   assign ( resid 119 and name HN) ( resid 119 and name N) 
          ( resid 119 and name CA) ( resid 119 and name HA) 1.0 -115.38 20.0 2 
   assign ( resid 120 and name HN) ( resid 120 and name N) 
          ( resid 120 and name CA) ( resid 120 and name HA) 1.0 -122.38 20.0 2 
   assign ( resid 121 and name HN) ( resid 121 and name N) 
          ( resid 121 and name CA) ( resid 121 and name HA) 1.0 -117.0 20.0 2 
   assign ( resid 122 and name HN) ( resid 122 and name N) 
          ( resid 122 and name CA) ( resid 122 and name HA) 1.0 -124.84 20.0 2 
   assign ( resid 123 and name HN) ( resid 123 and name N) 
          ( resid 123 and name CA) ( resid 123 and name HA) 1.0 -120.97 20.0 2 
   assign ( resid 124 and name HN) ( resid 124 and name N) 
          ( resid 124 and name CA) ( resid 124 and name HA) 1.0 -128.44 40.0 2 
!Loop 
   assign ( resid 124 and name C)  ( resid 125 and name N) 
          ( resid 125 and name CA) ( resid 125 and name C) 1.0 -84.00 30.0 2 
!! Gly125 Phi value from x-ray       
   assign ( resid 126 and name HN) ( resid 126 and name N) 
          ( resid 126 and name CA) ( resid 126 and name HA) 1.0 -137.90 30.0 2 
   assign ( resid 127 and name HN) ( resid 127 and name N) 
          ( resid 127 and name CA) ( resid 127 and name HA) 1.0 -140.09 40.0 2 
   assign ( resid 128 and name HN) ( resid 128 and name N) 
          ( resid 128 and name CA) ( resid 128 and name HA) 1.0 -142.70 30.0 2 
   assign ( resid 129 and name HN) ( resid 129 and name N) 
          ( resid 129 and name CA) ( resid 129 and name HA) 1.0 -159.38 40.0 2 
!Helix G
   assign ( resid 130 and name HN) ( resid 130 and name N) 
          ( resid 130 and name CA) ( resid 130 and name HA) 1.0 -117.0 20.0 2 
   assign ( resid 131 and name HN) ( resid 131 and name N) 
          ( resid 131 and name CA) ( resid 131 and name HA) 1.0 -120.18 20.0 2 
   assign ( resid 132 and name HN) ( resid 132 and name N) 
          ( resid 132 and name CA) ( resid 132 and name HA) 1.0 -117.0 20.0 2 
   assign ( resid 133 and name HN) ( resid 133 and name N) 
          ( resid 133 and name CA) ( resid 133 and name HA) 1.0 -117.0 20.0 2 
   assign ( resid 134 and name HN) ( resid 134 and name N) 
          ( resid 134 and name CA) ( resid 134 and name HA) 1.0 -118.16 20.0 2 
   assign ( resid 135 and name HN) ( resid 135 and name N) 
          ( resid 135 and name CA) ( resid 135 and name HA) 1.0 -123.46 20.0 2 
   assign ( resid 136 and name HN) ( resid 136 and name N) 
          ( resid 136 and name CA) ( resid 136 and name HA) 1.0 -117.0 20.0 2 
   assign ( resid 137 and name HN) ( resid 137 and name N) 
          ( resid 137 and name CA) ( resid 137 and name HA) 1.0 -128.96 20.0 2 
   assign ( resid 138 and name HN) ( resid 138 and name N) 
          ( resid 138 and name CA) ( resid 138 and name HA) 1.0 -117.0 20.0 2 
   assign ( resid 139 and name HN) ( resid 139 and name N) 
          ( resid 139 and name CA) ( resid 139 and name HA) 1.0 -126.05 20.0 2 
!Ca2+ Loop       
   assign ( resid 140 and name HN) ( resid 140 and name N) 
          ( resid 140 and name CA) ( resid 140 and name HA2) 1.0 -128.73 30.0 2 
!stereo-assignt of G140 checked with xray   
   assign ( resid 141 and name HN) ( resid 141 and name N) 
          ( resid 141 and name CA) ( resid 141 and name HA) 1.0 -129.70 30.0 2 
   assign ( resid 142 and name HN) ( resid 142 and name N) 
          ( resid 142 and name CA) ( resid 142 and name HA) 1.0 -173.00 30.0 2 
   assign ( resid 143 and name HN) ( resid 143 and name N) 
          ( resid 143 and name CA) ( resid 143 and name HA) 1.0 -154.88 30.0 2 
   assign ( resid 145 and name HN) ( resid 145 and name N) 
          ( resid 145 and name CA) ( resid 145 and name HA) 1.0 -155.58 30.0 2 
   assign ( resid 145 and name C) ( resid 146 and name N) 
          ( resid 146 and name CA) ( resid 146 and name C) 1.0 +91.00 30.0 2 
!!Gly146 Phi value from x-ray
!Beta-sheet
   assign ( resid 147 and name HN) ( resid 147 and name N) 
          ( resid 147 and name CA) ( resid 147 and name HA) 1.0 -209.2 20.0 2 
   assign ( resid 148 and name HN) ( resid 148 and name N) 
          ( resid 148 and name CA) ( resid 148 and name HA) 1.0 -198.8 20.0 2 
   assign ( resid 149 and name HN) ( resid 149 and name N) 
          ( resid 149 and name CA) ( resid 149 and name HA) 1.0 -215.6 20.0 2 
!Helix H
   assign ( resid 150 and name HN) ( resid 150 and name N) 
          ( resid 150 and name CA) ( resid 150 and name HA) 1.0 -114.0 20.0 2 
!!Y150 value from x-ray 
   assign ( resid 151 and name HN) ( resid 151 and name N) 
          ( resid 151 and name CA) ( resid 151 and name HA) 1.0 -125.60 20.0 2 
   assign ( resid 152 and name HN) ( resid 152 and name N) 
          ( resid 152 and name CA) ( resid 152 and name HA) 1.0 -120.89 20.0 2 
   assign ( resid 153 and name HN) ( resid 153 and name N) 
          ( resid 153 and name CA) ( resid 153 and name HA) 1.0 -129.77 20.0 2 
   assign ( resid 154 and name HN) ( resid 154 and name N) 
          ( resid 154 and name CA) ( resid 154 and name HA) 1.0 -117.0 20.0 2 
   assign ( resid 155 and name HN) ( resid 155 and name N) 
          ( resid 155 and name CA) ( resid 155 and name HA) 1.0 -134.27 20.0 2 
   assign ( resid 156 and name HN) ( resid 156 and name N) 
          ( resid 156 and name CA) ( resid 156 and name HA) 1.0 -117.33 20.0 2 
!C-term       
   assign ( resid 157 and name HN) ( resid 157 and name N) 
          ( resid 157 and name CA) ( resid 157 and name HA) 1.0 -142.32 30.0 2 
   assign ( resid 158 and name HN) ( resid 158 and name N) 
          ( resid 158 and name CA) ( resid 158 and name HA) 1.0 -121.37 30.0 2 
   assign ( resid 159 and name HN) ( resid 159 and name N) 
          ( resid 159 and name CA) ( resid 159 and name HA1) 1.0 132.94 30.0 2 
   assign ( resid 159 and name HN) ( resid 159 and name N) 
          ( resid 159 and name CA) ( resid 159 and name HA2) 1.0 38.32 30.0 2 
   assign ( resid 160 and name HN) ( resid 160 and name N) 
          ( resid 160 and name CA) ( resid 160 and name HA) 1.0 -144.92 30.0 2 
   assign ( resid 161 and name HN) ( resid 161 and name N) 
          ( resid 161 and name CA) ( resid 161 and name HA) 1.0 -149.59 30.0 2 
!! CHI1's from HNHB
   assign ( resid 100 and name N) ( resid 100 and name CA) 
          ( resid 100 and name CB) ( resid 100 and name CG) 1.0 -91.11 30.0 2 
   assign ( resid 104 and name N) ( resid 104 and name CA) 
          ( resid 104 and name CB) ( resid 104 and name CG) 1.0 -98.89 30.0 2 
   assign ( resid 127 and name N) ( resid 127 and name CA) 
          ( resid 127 and name CB) ( resid 127 and name CG) 1.0 180.00 30.0 2 
   assign ( resid 131 and name N) ( resid 131 and name CA) 
          ( resid 131 and name CB) ( resid 131 and name CG) 1.0 -128.89 30.0 2 
   assign ( resid 132 and name N) ( resid 132 and name CA) 
          ( resid 132 and name CB) ( resid 132 and name CG) 1.0 -91.11 30.0 2 
   assign ( resid 134 and name N) ( resid 134 and name CA) 
          ( resid 134 and name CB) ( resid 134 and name CG) 1.0 -90.0 30.0 2 
   assign ( resid 136 and name N) ( resid 136 and name CA) 
          ( resid 136 and name CB) ( resid 136 and name CG) 1.0 -106.67 30.0 2 
   assign ( resid 139 and name N) ( resid 139 and name CA) 
          ( resid 139 and name CB) ( resid 139 and name CG) 1.0 103.67 30.0 2 
   assign ( resid 141 and name N)( resid 141 and name CA) 
          ( resid 141 and name CB) ( resid 141 and name CG) 1.0 -178.89 30.0 2 
   assign ( resid 145 and name N) ( resid 145 and name CA) 
          ( resid 145 and name CB) ( resid 145 and name CG) 1.0 91.11 30.0 2
   assign ( resid 149 and name N) ( resid 149 and name CA) 
          ( resid 149 and name CB) ( resid 149 and name CG) 1.0 85.5 30.0 2
   assign ( resid 150 and name N) ( resid 150 and name CA) 
          ( resid 150 and name CB) ( resid 150 and name CG) 1.0 -176.67 30.0 2
   assign ( resid 151 and name N) ( resid 151 and name CA) 
          ( resid 151 and name CB) ( resid 151 and name CG) 1.0 -78.89 30.0 2
   assign ( resid 154 and name N) ( resid 154 and name CA) 
          ( resid 154 and name CB) ( resid 154 and name CG) 1.0 -91.11 30.0 2
   assign ( resid 155 and name N) ( resid 155 and name CA) 
          ( resid 155 and name CB) ( resid 155 and name CG) 1.0 -83.33 30.0 2
   assign ( resid 156 and name N) ( resid 156 and name CA) 
          ( resid 156 and name CB) ( resid 156 and name CG) 1.0 180.00 30.0 2
   assign ( resid 157 and name N) ( resid 157 and name CA) 
          ( resid 157 and name CB) ( resid 157 and name CG) 1.0 -96.67 30.0 2
 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET  81          1HT       MET  81  96.242  17.882  -4.371
    2   2H    MET  81          2HT       MET  81  97.481  18.718  -3.528
    3   3H    MET  81          3HT       MET  81  95.994  19.503  -3.873
    4    HA   MET  81           HA       MET  81  95.876  18.944  -1.662
    5   1HB   MET  81          2HB       MET  81  94.134  17.978  -3.552
    6   2HB   MET  81          1HB       MET  81  94.483  16.534  -2.609
    7   1HG   MET  81          2HG       MET  81  92.640  17.397  -1.538
    8   2HG   MET  81          1HG       MET  81  93.969  18.025  -0.568
    9   1HE   MET  81          1HE       MET  81  90.870  18.493  -1.802
   10   2HE   MET  81          2HE       MET  81  90.599  20.169  -2.281
   11   3HE   MET  81          3HE       MET  81  90.852  19.768  -0.583
   12    H    VAL  82           H        VAL  82  95.499  16.791  -0.233
   13    HA   VAL  82           HA       VAL  82  98.109  15.497  -0.217
   14    HB   VAL  82           HB       VAL  82  97.324  14.565   1.988
   15   1HG1  VAL  82          1HG1      VAL  82  97.799  17.403   1.341
   16   2HG1  VAL  82          2HG1      VAL  82  98.670  16.322   2.429
   17   3HG1  VAL  82          3HG1      VAL  82  97.162  17.071   2.952
   18   1HG2  VAL  82          1HG2      VAL  82  95.275  14.973   2.840
   19   2HG2  VAL  82          2HG2      VAL  82  94.835  15.175   1.145
   20   3HG2  VAL  82          3HG2      VAL  82  95.187  16.588   2.140
   21    H    ARG  83           H        ARG  83  98.468  13.379  -0.604
   22    HA   ARG  83           HA       ARG  83  96.205  11.811  -1.598
   23   1HB   ARG  83          2HB       ARG  83  99.189  11.556  -1.933
   24   2HB   ARG  83          1HB       ARG  83  98.082  10.279  -2.418
   25   1HG   ARG  83          2HG       ARG  83  97.453  12.972  -3.432
   26   2HG   ARG  83          1HG       ARG  83  98.928  12.229  -4.056
   27   1HD   ARG  83          2HD       ARG  83  96.390  10.657  -3.968
   28   2HD   ARG  83          1HD       ARG  83  96.648  11.830  -5.259
   29    HE   ARG  83           HE       ARG  83  97.941   9.284  -4.946
   30   1HH1  ARG  83          1HH1      ARG  83  98.208  12.472  -6.341
   31   2HH1  ARG  83          2HH1      ARG  83  99.305  11.973  -7.583
   32   1HH2  ARG  83          1HH2      ARG  83  99.386   8.626  -6.579
   33   2HH2  ARG  83          2HH2      ARG  83  99.974   9.789  -7.720
   34    H    CYS  84           H        CYS  84  96.505   9.348  -1.212
   35    HA   CYS  84           HA       CYS  84  96.676   8.993   1.680
   36   1HB   CYS  84          2HB       CYS  84  94.843   8.103  -0.120
   37   2HB   CYS  84          1HB       CYS  84  95.899   6.699  -0.011
   38    HG   CYS  84           HG       CYS  84  95.201   6.327   2.373
   39    H    MET  85           H        MET  85  97.577   6.912  -1.074
   40    HA   MET  85           HA       MET  85  99.554   5.519   0.402
   41   1HB   MET  85          2HB       MET  85 100.230   4.622  -1.836
   42   2HB   MET  85          1HB       MET  85  98.522   4.428  -1.464
   43   1HG   MET  85          2HG       MET  85  97.922   6.216  -2.912
   44   2HG   MET  85          1HG       MET  85  99.608   6.678  -3.135
   45   1HE   MET  85          1HE       MET  85  98.110   5.462  -6.492
   46   2HE   MET  85          2HE       MET  85  99.694   6.184  -6.208
   47   3HE   MET  85          3HE       MET  85  98.278   6.804  -5.360
   48    H    LYS  86           H        LYS  86  99.678   8.222  -1.862
   49    HA   LYS  86           HA       LYS  86 101.308   9.726  -2.365
   50   1HB   LYS  86          2HB       LYS  86 101.770   8.989   0.427
   51   2HB   LYS  86          1HB       LYS  86 103.221   9.568  -0.380
   52   1HG   LYS  86          2HG       LYS  86 102.474  11.681  -0.492
   53   2HG   LYS  86          1HG       LYS  86 100.818  11.187  -0.845
   54   1HD   LYS  86          2HD       LYS  86 100.400  10.718   1.473
   55   2HD   LYS  86          1HD       LYS  86 102.097  10.986   1.878
   56   1HE   LYS  86          2HE       LYS  86 101.891  13.240   1.831
   57   2HE   LYS  86          1HE       LYS  86 100.716  13.211   0.515
   58   1HZ   LYS  86          1HZ       LYS  86  99.010  13.196   1.939
   59   2HZ   LYS  86          2HZ       LYS  86 100.126  13.758   3.077
   60   3HZ   LYS  86          3HZ       LYS  86  99.752  12.111   3.004
   61    H    ASP  87           H        ASP  87 101.880   8.325  -4.155
   62    HA   ASP  87           HA       ASP  87 104.403   6.865  -3.769
   63   1HB   ASP  87          2HB       ASP  87 102.410   5.652  -4.743
   64   2HB   ASP  87          1HB       ASP  87 102.554   6.698  -6.152
   65    H    ASP  88           H        ASP  88 104.219   9.763  -3.995
   66    HA   ASP  88           HA       ASP  88 105.416  10.254  -6.626
   67   1HB   ASP  88          2HB       ASP  88 103.523  11.689  -5.340
   68   2HB   ASP  88          1HB       ASP  88 104.968  12.517  -4.767
   69    H    SER  89           H        SER  89 106.093  10.312  -3.196
   70    HA   SER  89           HA       SER  89 108.573  11.685  -3.355
   71   1HB   SER  89          2HB       SER  89 107.387   9.858  -1.261
   72   2HB   SER  89          1HB       SER  89 108.951  10.650  -1.066
   73    HG   SER  89           HG       SER  89 107.295  11.889  -0.133
   74    H    LYS  90           H        LYS  90 109.300  10.436  -5.305
   75    HA   LYS  90           HA       LYS  90 110.595   7.905  -4.538
   76   1HB   LYS  90          2HB       LYS  90 108.940   7.967  -6.490
   77   2HB   LYS  90          1HB       LYS  90 110.169   8.875  -7.359
   78   1HG   LYS  90          2HG       LYS  90 111.115   6.388  -6.124
   79   2HG   LYS  90          1HG       LYS  90 109.923   6.184  -7.407
   80   1HD   LYS  90          2HD       LYS  90 111.629   8.065  -8.457
   81   2HD   LYS  90          1HD       LYS  90 112.720   7.010  -7.557
   82   1HE   LYS  90          2HE       LYS  90 112.143   5.137  -8.816
   83   2HE   LYS  90          1HE       LYS  90 110.645   5.868  -9.392
   84   1HZ   LYS  90          1HZ       LYS  90 112.082   7.490 -10.619
   85   2HZ   LYS  90          2HZ       LYS  90 112.159   5.897 -11.183
   86   3HZ   LYS  90          3HZ       LYS  90 113.412   6.518 -10.232
   87    H    GLY  91           H        GLY  91 111.967   9.888  -3.537
   88   1HA   GLY  91          2HA       GLY  91 113.987  10.734  -5.492
   89   2HA   GLY  91          1HA       GLY  91 113.771  11.403  -3.882
   90    H    LYS  92           H        LYS  92 115.853   9.704  -5.670
   91    HA   LYS  92           HA       LYS  92 116.562   7.581  -3.891
   92   1HB   LYS  92          2HB       LYS  92 117.913   8.849  -6.265
   93   2HB   LYS  92          1HB       LYS  92 118.705   7.602  -5.312
   94   1HG   LYS  92          2HG       LYS  92 117.419   5.955  -6.145
   95   2HG   LYS  92          1HG       LYS  92 115.977   6.969  -6.216
   96   1HD   LYS  92          2HD       LYS  92 117.542   8.137  -8.107
   97   2HD   LYS  92          1HD       LYS  92 118.025   6.446  -8.257
   98   1HE   LYS  92          2HE       LYS  92 115.941   5.768  -8.932
   99   2HE   LYS  92          1HE       LYS  92 115.123   7.089  -8.098
  100   1HZ   LYS  92          1HZ       LYS  92 116.254   7.003 -10.769
  101   2HZ   LYS  92          2HZ       LYS  92 116.520   8.439  -9.915
  102   3HZ   LYS  92          3HZ       LYS  92 114.942   7.890 -10.176
  103    H    THR  93           H        THR  93 116.684   8.771  -1.891
  104    HA   THR  93           HA       THR  93 118.941  10.604  -1.610
  105    HB   THR  93           HB       THR  93 118.040  10.883   0.727
  106    HG1  THR  93           HG1      THR  93 116.481   9.656   1.376
  107   1HG2  THR  93          1HG2      THR  93 115.618  11.571  -0.517
  108   2HG2  THR  93          2HG2      THR  93 116.897  11.826  -1.703
  109   3HG2  THR  93          3HG2      THR  93 116.983  12.618  -0.131
  110    H    GLU  94           H        GLU  94 119.919  10.268   0.810
  111    HA   GLU  94           HA       GLU  94 121.683   8.139   0.626
  112   1HB   GLU  94          2HB       GLU  94 120.831   9.393   3.232
  113   2HB   GLU  94          1HB       GLU  94 122.387   8.672   2.843
  114   1HG   GLU  94          2HG       GLU  94 123.128  10.687   2.320
  115   2HG   GLU  94          1HG       GLU  94 122.010  10.698   0.957
  116    H    GLU  95           H        GLU  95 118.442   8.197   1.834
  117    HA   GLU  95           HA       GLU  95 118.451   6.024   3.571
  118   1HB   GLU  95          2HB       GLU  95 116.047   5.812   3.039
  119   2HB   GLU  95          1HB       GLU  95 116.521   7.475   3.360
  120   1HG   GLU  95          2HG       GLU  95 115.360   7.916   1.502
  121   2HG   GLU  95          1HG       GLU  95 116.823   7.381   0.677
  122    H    GLU  96           H        GLU  96 118.383   6.125   0.062
  123    HA   GLU  96           HA       GLU  96 117.895   3.291  -0.191
  124   1HB   GLU  96          2HB       GLU  96 118.109   3.658  -2.582
  125   2HB   GLU  96          1HB       GLU  96 117.063   4.883  -1.879
  126   1HG   GLU  96          2HG       GLU  96 118.370   6.525  -2.586
  127   2HG   GLU  96          1HG       GLU  96 119.811   5.759  -1.922
  128    H    LEU  97           H        LEU  97 120.641   5.420  -0.065
  129    HA   LEU  97           HA       LEU  97 122.529   3.613  -1.199
  130   1HB   LEU  97          2HB       LEU  97 122.572   6.238   0.106
  131   2HB   LEU  97          1HB       LEU  97 124.000   5.271   0.424
  132    HG   LEU  97           HG       LEU  97 122.983   5.817  -2.359
  133   1HD1  LEU  97          1HD1      LEU  97 125.063   7.317  -0.776
  134   2HD1  LEU  97          2HD1      LEU  97 123.507   7.943  -1.324
  135   3HD1  LEU  97          3HD1      LEU  97 124.751   7.518  -2.501
  136   1HD2  LEU  97          1HD2      LEU  97 124.701   3.918  -1.551
  137   2HD2  LEU  97          2HD2      LEU  97 125.819   5.263  -1.772
  138   3HD2  LEU  97          3HD2      LEU  97 124.809   4.727  -3.114
  139    H    SER  98           H        SER  98 121.191   4.069   1.979
  140    HA   SER  98           HA       SER  98 123.140   2.853   3.554
  141   1HB   SER  98          2HB       SER  98 121.458   2.604   5.222
  142   2HB   SER  98          1HB       SER  98 121.042   4.066   4.330
  143    HG   SER  98           HG       SER  98 119.229   3.160   3.821
  144    H    ASP  99           H        ASP  99 120.763   1.463   1.415
  145    HA   ASP  99           HA       ASP  99 120.976  -1.205   2.412
  146   1HB   ASP  99          2HB       ASP  99 119.051  -0.200   1.050
  147   2HB   ASP  99          1HB       ASP  99 120.074  -0.446  -0.363
  148    H    LEU 100           H        LEU 100 122.547   0.640  -0.140
  149    HA   LEU 100           HA       LEU 100 123.852  -1.474  -1.438
  150   1HB   LEU 100          2HB       LEU 100 124.312   1.464  -1.213
  151   2HB   LEU 100          1HB       LEU 100 125.583   0.471  -1.900
  152    HG   LEU 100           HG       LEU 100 123.436  -0.404  -3.322
  153   1HD1  LEU 100          1HD1      LEU 100 122.950   2.496  -3.475
  154   2HD1  LEU 100          2HD1      LEU 100 122.321   1.685  -2.040
  155   3HD1  LEU 100          3HD1      LEU 100 121.832   1.142  -3.644
  156   1HD2  LEU 100          1HD2      LEU 100 124.292   1.550  -4.940
  157   2HD2  LEU 100          2HD2      LEU 100 125.214   0.077  -4.636
  158   3HD2  LEU 100          3HD2      LEU 100 125.602   1.558  -3.759
  159    H    PHE 101           H        PHE 101 124.614   0.288   1.483
  160    HA   PHE 101           HA       PHE 101 127.306  -0.546   1.734
  161   1HB   PHE 101          2HB       PHE 101 126.371   1.364   2.978
  162   2HB   PHE 101          1HB       PHE 101 125.352   0.262   3.899
  163    HD1  PHE 101           HD1      PHE 101 126.220  -0.996   5.718
  164    HD2  PHE 101           HD2      PHE 101 128.814   1.350   3.293
  165    HE1  PHE 101           HE1      PHE 101 128.016  -1.278   7.375
  166    HE2  PHE 101           HE2      PHE 101 130.616   1.072   4.945
  167    HZ   PHE 101           HZ       PHE 101 130.218  -0.244   6.989
  168    H    ARG 102           H        ARG 102 124.270  -1.828   3.051
  169    HA   ARG 102           HA       ARG 102 125.366  -3.892   4.587
  170   1HB   ARG 102          2HB       ARG 102 122.704  -3.870   3.153
  171   2HB   ARG 102          1HB       ARG 102 123.144  -4.915   4.497
  172   1HG   ARG 102          2HG       ARG 102 123.626  -2.529   5.616
  173   2HG   ARG 102          1HG       ARG 102 122.354  -2.075   4.480
  174   1HD   ARG 102          2HD       ARG 102 120.802  -3.515   5.459
  175   2HD   ARG 102          1HD       ARG 102 122.051  -4.460   6.270
  176    HE   ARG 102           HE       ARG 102 122.304  -2.018   7.397
  177   1HH1  ARG 102          1HH1      ARG 102 119.579  -4.143   6.912
  178   2HH1  ARG 102          2HH1      ARG 102 118.742  -3.598   8.326
  179   1HH2  ARG 102          1HH2      ARG 102 121.204  -1.298   9.257
  180   2HH2  ARG 102          2HH2      ARG 102 119.664  -1.981   9.658
  181    H    MET 103           H        MET 103 124.732  -3.659   1.162
  182    HA   MET 103           HA       MET 103 124.852  -6.394   0.513
  183   1HB   MET 103          2HB       MET 103 125.279  -3.852  -1.008
  184   2HB   MET 103          1HB       MET 103 125.701  -5.385  -1.761
  185   1HG   MET 103          2HG       MET 103 123.112  -5.621  -0.606
  186   2HG   MET 103          1HG       MET 103 123.170  -4.148  -1.573
  187   1HE   MET 103          1HE       MET 103 122.122  -5.108  -4.631
  188   2HE   MET 103          2HE       MET 103 121.670  -4.508  -3.036
  189   3HE   MET 103          3HE       MET 103 121.146  -6.109  -3.557
  190    H    PHE 104           H        PHE 104 127.377  -3.903   0.642
  191    HA   PHE 104           HA       PHE 104 129.479  -5.620  -0.192
  192   1HB   PHE 104          2HB       PHE 104 129.191  -2.863   0.703
  193   2HB   PHE 104          1HB       PHE 104 130.663  -3.604   1.318
  194    HD1  PHE 104           HD1      PHE 104 128.903  -4.098  -1.922
  195    HD2  PHE 104           HD2      PHE 104 132.391  -2.704   0.078
  196    HE1  PHE 104           HE1      PHE 104 129.994  -3.724  -4.095
  197    HE2  PHE 104           HE2      PHE 104 133.490  -2.326  -2.092
  198    HZ   PHE 104           HZ       PHE 104 132.290  -2.836  -4.182
  199    H    ASP 105           H        ASP 105 128.250  -4.629   2.969
  200    HA   ASP 105           HA       ASP 105 130.252  -5.772   4.557
  201   1HB   ASP 105          2HB       ASP 105 127.923  -4.361   5.022
  202   2HB   ASP 105          1HB       ASP 105 127.573  -5.937   5.723
  203    H    LYS 106           H        LYS 106 130.202  -7.719   5.830
  204    HA   LYS 106           HA       LYS 106 128.984  -9.943   4.359
  205   1HB   LYS 106          2HB       LYS 106 131.555  -9.599   5.212
  206   2HB   LYS 106          1HB       LYS 106 130.884 -10.564   6.521
  207   1HG   LYS 106          2HG       LYS 106 131.853 -12.049   4.940
  208   2HG   LYS 106          1HG       LYS 106 130.100 -12.201   4.809
  209   1HD   LYS 106          2HD       LYS 106 131.328 -10.190   3.046
  210   2HD   LYS 106          1HD       LYS 106 131.763 -11.866   2.700
  211   1HE   LYS 106          2HE       LYS 106 129.105 -12.128   3.042
  212   2HE   LYS 106          1HE       LYS 106 129.172 -10.476   2.428
  213   1HZ   LYS 106          1HZ       LYS 106 128.945 -12.310   0.729
  214   2HZ   LYS 106          2HZ       LYS 106 130.550 -12.717   1.072
  215   3HZ   LYS 106          3HZ       LYS 106 130.181 -11.188   0.452
  216    H    ASN 107           H        ASN 107 129.635  -9.009   7.739
  217    HA   ASN 107           HA       ASN 107 127.430 -10.718   8.610
  218   1HB   ASN 107          2HB       ASN 107 128.293 -10.135  10.916
  219   2HB   ASN 107          1HB       ASN 107 129.414 -11.030   9.894
  220   1HD2  ASN 107          1HD2      ASN 107 131.186 -10.302  11.061
  221   2HD2  ASN 107          2HD2      ASN 107 131.772  -8.683  10.929
  222    H    ALA 108           H        ALA 108 127.889  -7.529   7.718
  223    HA   ALA 108           HA       ALA 108 126.602  -5.662   7.872
  224   1HB   ALA 108          1HB       ALA 108 124.241  -6.205   9.031
  225   2HB   ALA 108          2HB       ALA 108 124.733  -7.837   8.576
  226   3HB   ALA 108          3HB       ALA 108 124.603  -6.578   7.346
  227    H    ASP 109           H        ASP 109 128.415  -5.364   9.582
  228    HA   ASP 109           HA       ASP 109 127.259  -5.054  12.263
  229   1HB   ASP 109          2HB       ASP 109 129.685  -4.676  12.928
  230   2HB   ASP 109          1HB       ASP 109 129.278  -6.296  12.370
  231    H    GLY 110           H        GLY 110 128.539  -3.289   9.554
  232   1HA   GLY 110          2HA       GLY 110 127.600  -0.967   9.459
  233   2HA   GLY 110          1HA       GLY 110 128.228  -0.782  11.089
  234    H    TYR 111           H        TYR 111 130.579  -2.538   9.964
  235    HA   TYR 111           HA       TYR 111 131.953  -0.359   8.542
  236   1HB   TYR 111          2HB       TYR 111 133.242  -2.082  10.665
  237   2HB   TYR 111          1HB       TYR 111 133.953  -0.697   9.840
  238    HD1  TYR 111           HD1      TYR 111 133.312   1.574  10.445
  239    HD2  TYR 111           HD2      TYR 111 131.638  -1.780  12.457
  240    HE1  TYR 111           HE1      TYR 111 132.497   3.058  12.228
  241    HE2  TYR 111           HE2      TYR 111 130.817  -0.305  14.246
  242    HH   TYR 111           HH       TYR 111 130.772   3.086  13.956
  243    H    ILE 112           H        ILE 112 133.819  -1.055   7.284
  244    HA   ILE 112           HA       ILE 112 133.726  -3.898   6.530
  245    HB   ILE 112           HB       ILE 112 134.075  -1.647   4.552
  246   1HG1  ILE 112          2HG1      ILE 112 131.617  -3.370   4.826
  247   2HG1  ILE 112          1HG1      ILE 112 131.770  -1.836   5.678
  248   1HG2  ILE 112          1HG2      ILE 112 134.983  -3.379   3.432
  249   2HG2  ILE 112          2HG2      ILE 112 133.296  -3.787   3.121
  250   3HG2  ILE 112          3HG2      ILE 112 134.172  -4.589   4.426
  251   1HD1  ILE 112          1HD1      ILE 112 130.554  -1.897   3.415
  252   2HD1  ILE 112          2HD1      ILE 112 132.173  -1.982   2.721
  253   3HD1  ILE 112          3HD1      ILE 112 131.713  -0.603   3.720
  254    H    ASP 113           H        ASP 113 135.666  -4.845   5.982
  255    HA   ASP 113           HA       ASP 113 138.066  -3.153   6.098
  256   1HB   ASP 113          2HB       ASP 113 137.330  -4.730   8.197
  257   2HB   ASP 113          1HB       ASP 113 138.356  -5.836   7.288
  258    H    LEU 114           H        LEU 114 140.055  -4.519   5.430
  259    HA   LEU 114           HA       LEU 114 139.696  -5.339   2.777
  260   1HB   LEU 114          2HB       LEU 114 141.996  -6.100   4.573
  261   2HB   LEU 114          1HB       LEU 114 142.006  -6.013   2.822
  262    HG   LEU 114           HG       LEU 114 141.325  -3.513   4.257
  263   1HD1  LEU 114          1HD1      LEU 114 143.398  -4.862   5.311
  264   2HD1  LEU 114          2HD1      LEU 114 143.324  -3.103   5.213
  265   3HD1  LEU 114          3HD1      LEU 114 144.215  -4.017   3.997
  266   1HD2  LEU 114          1HD2      LEU 114 143.102  -4.161   1.908
  267   2HD2  LEU 114          2HD2      LEU 114 142.669  -2.545   2.464
  268   3HD2  LEU 114          3HD2      LEU 114 141.427  -3.618   1.820
  269    H    GLU 115           H        GLU 115 139.883  -7.186   5.773
  270    HA   GLU 115           HA       GLU 115 140.018  -9.748   4.585
  271   1HB   GLU 115          2HB       GLU 115 140.107  -8.733   7.169
  272   2HB   GLU 115          1HB       GLU 115 138.632  -9.690   7.150
  273   1HG   GLU 115          2HG       GLU 115 139.906 -11.454   7.553
  274   2HG   GLU 115          1HG       GLU 115 140.485 -11.310   5.894
  275    H    GLU 116           H        GLU 116 137.281  -7.869   5.861
  276    HA   GLU 116           HA       GLU 116 135.308  -9.792   5.229
  277   1HB   GLU 116          2HB       GLU 116 135.403  -7.106   6.306
  278   2HB   GLU 116          1HB       GLU 116 134.066  -7.280   5.177
  279   1HG   GLU 116          2HG       GLU 116 133.084  -9.001   6.436
  280   2HG   GLU 116          1HG       GLU 116 134.544  -9.241   7.394
  281    H    LEU 117           H        LEU 117 136.461  -6.905   3.521
  282    HA   LEU 117           HA       LEU 117 134.667  -7.070   1.356
  283   1HB   LEU 117          2HB       LEU 117 136.398  -5.210   2.145
  284   2HB   LEU 117          1HB       LEU 117 137.404  -5.983   0.934
  285    HG   LEU 117           HG       LEU 117 135.584  -5.594  -0.737
  286   1HD1  LEU 117          1HD1      LEU 117 133.630  -4.596  -0.242
  287   2HD1  LEU 117          2HD1      LEU 117 134.356  -3.529   0.962
  288   3HD1  LEU 117          3HD1      LEU 117 133.966  -5.198   1.381
  289   1HD2  LEU 117          1HD2      LEU 117 135.901  -2.956  -0.513
  290   2HD2  LEU 117          2HD2      LEU 117 137.192  -4.028  -1.054
  291   3HD2  LEU 117          3HD2      LEU 117 137.145  -3.480   0.622
  292    H    LYS 118           H        LYS 118 137.696  -8.663   2.036
  293    HA   LYS 118           HA       LYS 118 138.290  -9.552  -0.574
  294   1HB   LYS 118          2HB       LYS 118 139.926  -9.579   1.262
  295   2HB   LYS 118          1HB       LYS 118 138.990 -10.825   2.078
  296   1HG   LYS 118          2HG       LYS 118 139.399 -12.353   0.215
  297   2HG   LYS 118          1HG       LYS 118 140.346 -11.104  -0.596
  298   1HD   LYS 118          2HD       LYS 118 141.559 -11.158   1.820
  299   2HD   LYS 118          1HD       LYS 118 141.047 -12.841   1.678
  300   1HE   LYS 118          2HE       LYS 118 142.713 -11.296  -0.305
  301   2HE   LYS 118          1HE       LYS 118 143.283 -12.563   0.782
  302   1HZ   LYS 118          1HZ       LYS 118 141.527 -13.993  -0.401
  303   2HZ   LYS 118          2HZ       LYS 118 142.979 -13.668  -1.206
  304   3HZ   LYS 118          3HZ       LYS 118 141.579 -12.809  -1.610
  305    H    ILE 119           H        ILE 119 136.088 -10.699   1.866
  306    HA   ILE 119           HA       ILE 119 135.707 -13.312   0.804
  307    HB   ILE 119           HB       ILE 119 133.765 -11.729   2.488
  308   1HG1  ILE 119          2HG1      ILE 119 135.751 -13.704   3.574
  309   2HG1  ILE 119          1HG1      ILE 119 136.213 -12.022   3.335
  310   1HG2  ILE 119          1HG2      ILE 119 133.452 -14.272   3.255
  311   2HG2  ILE 119          2HG2      ILE 119 133.942 -14.536   1.582
  312   3HG2  ILE 119          3HG2      ILE 119 132.529 -13.544   1.941
  313   1HD1  ILE 119          1HD1      ILE 119 134.221 -11.409   4.755
  314   2HD1  ILE 119          2HD1      ILE 119 135.553 -12.218   5.582
  315   3HD1  ILE 119          3HD1      ILE 119 134.099 -13.121   5.155
  316    H    MET 120           H        MET 120 133.632 -10.408   0.706
  317    HA   MET 120           HA       MET 120 131.732 -11.450  -1.065
  318   1HB   MET 120          2HB       MET 120 131.028  -9.141  -1.417
  319   2HB   MET 120          1HB       MET 120 131.354  -9.434   0.287
  320   1HG   MET 120          2HG       MET 120 132.922  -7.866   0.356
  321   2HG   MET 120          1HG       MET 120 133.697  -8.464  -1.109
  322   1HE   MET 120          1HE       MET 120 131.967  -7.451  -3.846
  323   2HE   MET 120          2HE       MET 120 133.548  -7.818  -3.156
  324   3HE   MET 120          3HE       MET 120 133.162  -6.170  -3.649
  325    H    LEU 121           H        LEU 121 134.868 -10.046  -1.628
  326    HA   LEU 121           HA       LEU 121 134.503  -9.526  -4.408
  327   1HB   LEU 121          2HB       LEU 121 136.692  -9.412  -2.463
  328   2HB   LEU 121          1HB       LEU 121 137.211  -9.855  -4.078
  329    HG   LEU 121           HG       LEU 121 135.490  -7.436  -3.621
  330   1HD1  LEU 121          1HD1      LEU 121 138.345  -7.809  -2.977
  331   2HD1  LEU 121          2HD1      LEU 121 137.170  -6.665  -2.328
  332   3HD1  LEU 121          3HD1      LEU 121 137.931  -6.358  -3.889
  333   1HD2  LEU 121          1HD2      LEU 121 136.097  -8.608  -5.907
  334   2HD2  LEU 121          2HD2      LEU 121 137.591  -7.693  -5.708
  335   3HD2  LEU 121          3HD2      LEU 121 136.042  -6.852  -5.759
  336    H    GLN 122           H        GLN 122 135.500 -12.295  -2.528
  337    HA   GLN 122           HA       GLN 122 136.726 -13.818  -4.526
  338   1HB   GLN 122          2HB       GLN 122 135.175 -14.622  -2.068
  339   2HB   GLN 122          1HB       GLN 122 135.977 -15.791  -3.108
  340   1HG   GLN 122          2HG       GLN 122 137.879 -13.807  -2.523
  341   2HG   GLN 122          1HG       GLN 122 137.062 -14.187  -1.008
  342   1HE2  GLN 122          1HE2      GLN 122 136.955 -16.459  -0.396
  343   2HE2  GLN 122          2HE2      GLN 122 138.254 -17.507  -0.840
  344    H    ALA 123           H        ALA 123 133.358 -13.222  -3.829
  345    HA   ALA 123           HA       ALA 123 132.200 -15.330  -5.264
  346   1HB   ALA 123          1HB       ALA 123 130.790 -12.742  -5.341
  347   2HB   ALA 123          2HB       ALA 123 131.221 -13.341  -3.739
  348   3HB   ALA 123          3HB       ALA 123 130.228 -14.328  -4.812
  349    H    THR 124           H        THR 124 133.564 -12.290  -6.316
  350    HA   THR 124           HA       THR 124 132.445 -12.140  -8.878
  351    HB   THR 124           HB       THR 124 134.215 -10.608  -9.411
  352    HG1  THR 124           HG1      THR 124 136.104 -11.334  -8.812
  353   1HG2  THR 124          1HG2      THR 124 133.147  -9.214  -8.050
  354   2HG2  THR 124          2HG2      THR 124 134.448  -9.539  -6.904
  355   3HG2  THR 124          3HG2      THR 124 132.938 -10.445  -6.804
  356    H    GLY 125           H        GLY 125 133.504 -12.546 -10.950
  357   1HA   GLY 125          2HA       GLY 125 134.468 -15.229 -11.102
  358   2HA   GLY 125          1HA       GLY 125 134.303 -14.106 -12.444
  359    H    GLU 126           H        GLU 126 135.984 -12.086 -11.815
  360    HA   GLU 126           HA       GLU 126 138.495 -13.092 -12.533
  361   1HB   GLU 126          2HB       GLU 126 139.300 -10.764 -11.838
  362   2HB   GLU 126          1HB       GLU 126 138.077 -10.852 -13.097
  363   1HG   GLU 126          2HG       GLU 126 136.384 -10.118 -11.668
  364   2HG   GLU 126          1HG       GLU 126 137.339 -10.454 -10.223
  365    H    THR 127           H        THR 127 140.477 -13.157 -11.373
  366    HA   THR 127           HA       THR 127 140.109 -13.888  -8.567
  367    HB   THR 127           HB       THR 127 142.504 -14.744  -8.844
  368    HG1  THR 127           HG1      THR 127 143.347 -14.802 -10.821
  369   1HG2  THR 127          1HG2      THR 127 141.362 -16.406 -10.793
  370   2HG2  THR 127          2HG2      THR 127 140.052 -15.896  -9.730
  371   3HG2  THR 127          3HG2      THR 127 141.479 -16.684  -9.056
  372    H    ILE 128           H        ILE 128 140.065 -11.949  -7.486
  373    HA   ILE 128           HA       ILE 128 142.055  -9.919  -7.963
  374    HB   ILE 128           HB       ILE 128 140.118 -10.071  -5.656
  375   1HG1  ILE 128          2HG1      ILE 128 139.012  -8.289  -7.389
  376   2HG1  ILE 128          1HG1      ILE 128 139.701  -9.453  -8.516
  377   1HG2  ILE 128          1HG2      ILE 128 141.407  -8.327  -5.043
  378   2HG2  ILE 128          2HG2      ILE 128 140.427  -7.453  -6.220
  379   3HG2  ILE 128          3HG2      ILE 128 142.017  -8.065  -6.677
  380   1HD1  ILE 128          1HD1      ILE 128 137.258  -9.712  -7.605
  381   2HD1  ILE 128          2HD1      ILE 128 138.083 -10.469  -6.241
  382   3HD1  ILE 128          3HD1      ILE 128 138.287 -11.120  -7.868
  383    H    THR 129           H        THR 129 143.670  -9.248  -6.522
  384    HA   THR 129           HA       THR 129 144.576 -11.357  -4.691
  385    HB   THR 129           HB       THR 129 146.776 -10.006  -4.843
  386    HG1  THR 129           HG1      THR 129 145.531  -9.075  -7.209
  387   1HG2  THR 129          1HG2      THR 129 147.525 -11.479  -6.333
  388   2HG2  THR 129          2HG2      THR 129 146.340 -10.998  -7.549
  389   3HG2  THR 129          3HG2      THR 129 145.891 -12.140  -6.281
  390    H    GLU 130           H        GLU 130 145.735 -10.617  -2.721
  391    HA   GLU 130           HA       GLU 130 144.095  -9.010  -1.128
  392   1HB   GLU 130          2HB       GLU 130 146.028 -10.770  -0.580
  393   2HB   GLU 130          1HB       GLU 130 146.960  -9.292  -0.381
  394   1HG   GLU 130          2HG       GLU 130 144.724  -8.704   1.038
  395   2HG   GLU 130          1HG       GLU 130 144.861 -10.443   1.303
  396    H    ASP 131           H        ASP 131 146.863  -8.221  -3.101
  397    HA   ASP 131           HA       ASP 131 147.306  -5.632  -1.977
  398   1HB   ASP 131          2HB       ASP 131 148.761  -7.264  -3.605
  399   2HB   ASP 131          1HB       ASP 131 148.166  -6.078  -4.762
  400    H    ASP 132           H        ASP 132 145.436  -6.899  -4.669
  401    HA   ASP 132           HA       ASP 132 144.800  -4.422  -5.867
  402   1HB   ASP 132          2HB       ASP 132 143.847  -7.210  -6.071
  403   2HB   ASP 132          1HB       ASP 132 142.676  -5.980  -6.532
  404    H    ILE 133           H        ILE 133 143.452  -6.174  -3.169
  405    HA   ILE 133           HA       ILE 133 141.008  -4.706  -3.020
  406    HB   ILE 133           HB       ILE 133 142.379  -6.198  -0.782
  407   1HG1  ILE 133          2HG1      ILE 133 140.247  -7.351  -2.561
  408   2HG1  ILE 133          1HG1      ILE 133 141.945  -7.460  -3.012
  409   1HG2  ILE 133          1HG2      ILE 133 140.492  -5.966   0.421
  410   2HG2  ILE 133          2HG2      ILE 133 139.447  -6.128  -0.989
  411   3HG2  ILE 133          3HG2      ILE 133 140.215  -4.582  -0.634
  412   1HD1  ILE 133          1HD1      ILE 133 142.193  -9.224  -1.711
  413   2HD1  ILE 133          2HD1      ILE 133 140.479  -9.145  -1.302
  414   3HD1  ILE 133          3HD1      ILE 133 141.663  -8.296  -0.308
  415    H    GLU 134           H        GLU 134 144.237  -4.263  -1.765
  416    HA   GLU 134           HA       GLU 134 143.734  -2.434   0.279
  417   1HB   GLU 134          2HB       GLU 134 146.110  -2.620  -1.581
  418   2HB   GLU 134          1HB       GLU 134 146.068  -1.659  -0.109
  419   1HG   GLU 134          2HG       GLU 134 145.701  -3.707   1.196
  420   2HG   GLU 134          1HG       GLU 134 145.799  -4.653  -0.288
  421    H    GLU 135           H        GLU 135 143.825  -2.016  -3.186
  422    HA   GLU 135           HA       GLU 135 143.967   0.829  -3.170
  423   1HB   GLU 135          2HB       GLU 135 143.425  -1.280  -5.196
  424   2HB   GLU 135          1HB       GLU 135 142.877   0.349  -5.563
  425   1HG   GLU 135          2HG       GLU 135 145.171   1.171  -5.187
  426   2HG   GLU 135          1HG       GLU 135 145.694  -0.493  -4.924
  427    H    LEU 136           H        LEU 136 141.356  -1.509  -3.088
  428    HA   LEU 136           HA       LEU 136 139.249   0.307  -3.638
  429   1HB   LEU 136          2HB       LEU 136 139.414  -2.428  -2.432
  430   2HB   LEU 136          1HB       LEU 136 137.905  -1.538  -2.363
  431    HG   LEU 136           HG       LEU 136 139.253  -1.835  -5.008
  432   1HD1  LEU 136          1HD1      LEU 136 139.345  -4.068  -4.660
  433   2HD1  LEU 136          2HD1      LEU 136 137.633  -3.961  -5.075
  434   3HD1  LEU 136          3HD1      LEU 136 138.128  -4.033  -3.384
  435   1HD2  LEU 136          1HD2      LEU 136 137.224  -1.306  -5.845
  436   2HD2  LEU 136          2HD2      LEU 136 136.990  -0.606  -4.245
  437   3HD2  LEU 136          3HD2      LEU 136 136.355  -2.211  -4.607
  438    H    MET 137           H        MET 137 140.830  -0.758  -0.678
  439    HA   MET 137           HA       MET 137 138.989   0.652   1.032
  440   1HB   MET 137          2HB       MET 137 141.410  -1.031   1.409
  441   2HB   MET 137          1HB       MET 137 141.024   0.115   2.685
  442   1HG   MET 137          2HG       MET 137 138.810  -1.573   1.701
  443   2HG   MET 137          1HG       MET 137 140.080  -2.375   2.622
  444   1HE   MET 137          1HE       MET 137 137.277  -2.609   4.232
  445   2HE   MET 137          2HE       MET 137 136.895  -1.603   2.837
  446   3HE   MET 137          3HE       MET 137 136.529  -1.029   4.463
  447    H    LYS 138           H        LYS 138 142.079   1.269  -0.467
  448    HA   LYS 138           HA       LYS 138 142.957   3.409   1.105
  449   1HB   LYS 138          2HB       LYS 138 143.828   2.103  -1.199
  450   2HB   LYS 138          1HB       LYS 138 143.577   3.766  -1.712
  451   1HG   LYS 138          2HG       LYS 138 145.162   4.594  -0.219
  452   2HG   LYS 138          1HG       LYS 138 145.140   3.127   0.762
  453   1HD   LYS 138          2HD       LYS 138 146.439   1.944  -0.744
  454   2HD   LYS 138          1HD       LYS 138 146.004   2.991  -2.097
  455   1HE   LYS 138          2HE       LYS 138 147.252   4.816  -0.709
  456   2HE   LYS 138          1HE       LYS 138 148.003   3.429   0.081
  457   1HZ   LYS 138          1HZ       LYS 138 148.367   2.717  -2.412
  458   2HZ   LYS 138          2HZ       LYS 138 149.453   3.743  -1.618
  459   3HZ   LYS 138          3HZ       LYS 138 148.291   4.389  -2.665
  460    H    ASP 139           H        ASP 139 141.041   3.444  -1.897
  461    HA   ASP 139           HA       ASP 139 140.553   6.284  -1.630
  462   1HB   ASP 139          2HB       ASP 139 139.491   6.156  -3.762
  463   2HB   ASP 139          1HB       ASP 139 140.915   5.127  -3.842
  464    H    GLY 140           H        GLY 140 139.031   3.360  -0.672
  465   1HA   GLY 140          2HA       GLY 140 136.358   4.431  -0.544
  466   2HA   GLY 140          1HA       GLY 140 136.899   2.890   0.103
  467    H    ASP 141           H        ASP 141 139.092   4.216   1.610
  468    HA   ASP 141           HA       ASP 141 137.489   4.942   3.926
  469   1HB   ASP 141          2HB       ASP 141 139.404   3.315   4.069
  470   2HB   ASP 141          1HB       ASP 141 140.493   4.662   3.749
  471    H    LYS 142           H        LYS 142 137.145   6.962   4.566
  472    HA   LYS 142           HA       LYS 142 138.820   9.091   3.414
  473   1HB   LYS 142          2HB       LYS 142 135.969   9.259   4.407
  474   2HB   LYS 142          1HB       LYS 142 136.893  10.582   3.709
  475   1HG   LYS 142          2HG       LYS 142 136.422   8.056   2.172
  476   2HG   LYS 142          1HG       LYS 142 135.208   9.336   2.226
  477   1HD   LYS 142          2HD       LYS 142 137.925  10.272   1.639
  478   2HD   LYS 142          1HD       LYS 142 137.253   9.185   0.423
  479   1HE   LYS 142          2HE       LYS 142 135.369  11.219   1.340
  480   2HE   LYS 142          1HE       LYS 142 136.810  11.888   0.575
  481   1HZ   LYS 142          1HZ       LYS 142 136.222  11.090  -1.427
  482   2HZ   LYS 142          2HZ       LYS 142 134.663  11.077  -0.772
  483   3HZ   LYS 142          3HZ       LYS 142 135.576   9.655  -0.806
  484    H    ASN 143           H        ASN 143 137.680   7.646   6.338
  485    HA   ASN 143           HA       ASN 143 138.524   9.904   7.970
  486   1HB   ASN 143          2HB       ASN 143 137.317   7.238   8.728
  487   2HB   ASN 143          1HB       ASN 143 137.703   8.523   9.867
  488   1HD2  ASN 143          1HD2      ASN 143 136.779  10.734   9.047
  489   2HD2  ASN 143          2HD2      ASN 143 135.109  10.685   8.613
  490    H    ASN 144           H        ASN 144 140.219   7.717   6.401
  491    HA   ASN 144           HA       ASN 144 142.135   6.511   6.712
  492   1HB   ASN 144          2HB       ASN 144 143.921   7.805   7.826
  493   2HB   ASN 144          1HB       ASN 144 142.986   8.789   6.706
  494   1HD2  ASN 144          1HD2      ASN 144 143.402   7.979  10.103
  495   2HD2  ASN 144          2HD2      ASN 144 142.823   9.485  10.722
  496    H    ASP 145           H        ASP 145 140.080   5.621   8.434
  497    HA   ASP 145           HA       ASP 145 141.389   5.121  10.997
  498   1HB   ASP 145          2HB       ASP 145 139.238   4.144  11.677
  499   2HB   ASP 145          1HB       ASP 145 139.027   5.772  11.041
  500    H    GLY 146           H        GLY 146 140.589   3.529   8.011
  501   1HA   GLY 146          2HA       GLY 146 142.063   1.613   7.479
  502   2HA   GLY 146          1HA       GLY 146 141.729   1.029   9.103
  503    H    ARG 147           H        ARG 147 138.852   1.995   8.676
  504    HA   ARG 147           HA       ARG 147 137.974  -0.188   6.909
  505   1HB   ARG 147          2HB       ARG 147 136.719   0.566   9.554
  506   2HB   ARG 147          1HB       ARG 147 136.160  -0.697   8.468
  507   1HG   ARG 147          2HG       ARG 147 137.947  -2.091   8.964
  508   2HG   ARG 147          1HG       ARG 147 138.932  -0.766   9.586
  509   1HD   ARG 147          2HD       ARG 147 136.876  -0.626  11.297
  510   2HD   ARG 147          1HD       ARG 147 136.809  -2.345  10.908
  511    HE   ARG 147           HE       ARG 147 139.423  -1.941  11.475
  512   1HH1  ARG 147          1HH1      ARG 147 136.468  -1.192  13.177
  513   2HH1  ARG 147          2HH1      ARG 147 137.188  -1.339  14.745
  514   1HH2  ARG 147          1HH2      ARG 147 140.370  -2.134  13.537
  515   2HH2  ARG 147          2HH2      ARG 147 139.402  -1.872  14.949
  516    H    ILE 148           H        ILE 148 135.577   0.054   6.364
  517    HA   ILE 148           HA       ILE 148 134.982   2.905   5.899
  518    HB   ILE 148           HB       ILE 148 134.128   0.618   4.127
  519   1HG1  ILE 148          2HG1      ILE 148 136.361   2.596   3.631
  520   2HG1  ILE 148          1HG1      ILE 148 136.618   0.947   4.188
  521   1HG2  ILE 148          1HG2      ILE 148 134.207   3.556   3.498
  522   2HG2  ILE 148          2HG2      ILE 148 132.787   2.762   4.180
  523   3HG2  ILE 148          3HG2      ILE 148 133.403   2.268   2.603
  524   1HD1  ILE 148          1HD1      ILE 148 136.931   1.322   1.736
  525   2HD1  ILE 148          2HD1      ILE 148 135.194   1.616   1.631
  526   3HD1  ILE 148          3HD1      ILE 148 135.792   0.044   2.162
  527    H    ASP 149           H        ASP 149 132.924   3.633   6.260
  528    HA   ASP 149           HA       ASP 149 130.924   1.681   7.160
  529   1HB   ASP 149          2HB       ASP 149 130.307   3.123   9.040
  530   2HB   ASP 149          1HB       ASP 149 131.996   2.639   9.158
  531    H    TYR 150           H        TYR 150 128.851   3.316   7.754
  532    HA   TYR 150           HA       TYR 150 127.742   3.929   5.290
  533   1HB   TYR 150          2HB       TYR 150 126.418   3.568   7.330
  534   2HB   TYR 150          1HB       TYR 150 127.005   5.096   7.982
  535    HD1  TYR 150           HD1      TYR 150 126.126   7.202   7.199
  536    HD2  TYR 150           HD2      TYR 150 124.811   3.538   5.481
  537    HE1  TYR 150           HE1      TYR 150 124.255   8.382   6.128
  538    HE2  TYR 150           HE2      TYR 150 122.935   4.708   4.405
  539    HH   TYR 150           HH       TYR 150 122.000   7.843   5.242
  540    H    ASP 151           H        ASP 151 129.159   6.158   7.678
  541    HA   ASP 151           HA       ASP 151 128.737   8.530   6.273
  542   1HB   ASP 151          2HB       ASP 151 130.940   7.781   8.203
  543   2HB   ASP 151          1HB       ASP 151 130.656   9.419   7.622
  544    H    GLU 152           H        GLU 152 131.501   6.305   6.191
  545    HA   GLU 152           HA       GLU 152 133.014   7.845   4.345
  546   1HB   GLU 152          2HB       GLU 152 133.260   4.867   4.734
  547   2HB   GLU 152          1HB       GLU 152 134.513   6.008   4.260
  548   1HG   GLU 152          2HG       GLU 152 134.211   7.060   6.549
  549   2HG   GLU 152          1HG       GLU 152 133.266   5.630   6.962
  550    H    PHE 153           H        PHE 153 130.848   5.064   3.991
  551    HA   PHE 153           HA       PHE 153 131.229   4.651   1.245
  552   1HB   PHE 153          2HB       PHE 153 129.788   3.404   3.206
  553   2HB   PHE 153          1HB       PHE 153 128.508   4.134   2.244
  554    HD1  PHE 153           HD1      PHE 153 131.772   2.583   1.323
  555    HD2  PHE 153           HD2      PHE 153 127.535   2.512   0.942
  556    HE1  PHE 153           HE1      PHE 153 131.953   0.744  -0.300
  557    HE2  PHE 153           HE2      PHE 153 127.707   0.671  -0.682
  558    HZ   PHE 153           HZ       PHE 153 129.919  -0.216  -1.305
  559    H    LEU 154           H        LEU 154 128.808   6.593   2.976
  560    HA   LEU 154           HA       LEU 154 127.379   7.476   0.740
  561   1HB   LEU 154          2HB       LEU 154 127.568   8.157   3.555
  562   2HB   LEU 154          1HB       LEU 154 127.293   9.578   2.567
  563    HG   LEU 154           HG       LEU 154 125.194   8.620   3.389
  564   1HD1  LEU 154          1HD1      LEU 154 124.691   9.735   1.479
  565   2HD1  LEU 154          2HD1      LEU 154 124.267   8.106   0.950
  566   3HD1  LEU 154          3HD1      LEU 154 125.825   8.801   0.502
  567   1HD2  LEU 154          1HD2      LEU 154 124.422   6.456   2.665
  568   2HD2  LEU 154          2HD2      LEU 154 125.974   6.273   3.485
  569   3HD2  LEU 154          3HD2      LEU 154 125.893   6.207   1.724
  570    H    GLU 155           H        GLU 155 130.392   8.570   2.126
  571    HA   GLU 155           HA       GLU 155 130.475  10.976   0.524
  572   1HB   GLU 155          2HB       GLU 155 132.199   9.725   2.600
  573   2HB   GLU 155          1HB       GLU 155 132.970  10.821   1.462
  574   1HG   GLU 155          2HG       GLU 155 130.470  11.731   2.770
  575   2HG   GLU 155          1HG       GLU 155 131.934  11.648   3.751
  576    H    PHE 156           H        PHE 156 131.851   7.746   0.469
  577    HA   PHE 156           HA       PHE 156 133.670   8.260  -1.672
  578   1HB   PHE 156          2HB       PHE 156 133.989   6.422  -0.041
  579   2HB   PHE 156          1HB       PHE 156 132.569   5.616  -0.698
  580    HD1  PHE 156           HD1      PHE 156 135.550   7.267  -2.225
  581    HD2  PHE 156           HD2      PHE 156 133.158   3.762  -1.905
  582    HE1  PHE 156           HE1      PHE 156 136.965   6.152  -3.902
  583    HE2  PHE 156           HE2      PHE 156 134.567   2.641  -3.581
  584    HZ   PHE 156           HZ       PHE 156 136.473   3.837  -4.582
  585    H    MET 157           H        MET 157 130.430   6.850  -1.443
  586    HA   MET 157           HA       MET 157 130.253   6.223  -4.221
  587   1HB   MET 157          2HB       MET 157 128.693   5.782  -1.882
  588   2HB   MET 157          1HB       MET 157 127.655   6.551  -3.077
  589   1HG   MET 157          2HG       MET 157 127.330   4.460  -3.791
  590   2HG   MET 157          1HG       MET 157 128.877   4.689  -4.603
  591   1HE   MET 157          1HE       MET 157 128.535   2.213  -4.774
  592   2HE   MET 157          2HE       MET 157 129.125   1.050  -3.586
  593   3HE   MET 157          3HE       MET 157 130.259   2.109  -4.422
  594    H    LYS 158           H        LYS 158 129.451   8.997  -2.251
  595    HA   LYS 158           HA       LYS 158 127.924  10.317  -4.296
  596   1HB   LYS 158          2HB       LYS 158 127.594  10.701  -1.848
  597   2HB   LYS 158          1HB       LYS 158 129.159  11.501  -1.802
  598   1HG   LYS 158          2HG       LYS 158 128.274  13.114  -3.508
  599   2HG   LYS 158          1HG       LYS 158 126.686  12.387  -3.261
  600   1HD   LYS 158          2HD       LYS 158 127.590  12.905  -0.694
  601   2HD   LYS 158          1HD       LYS 158 128.128  14.304  -1.625
  602   1HE   LYS 158          2HE       LYS 158 125.778  14.458  -2.527
  603   2HE   LYS 158          1HE       LYS 158 125.324  13.251  -1.325
  604   1HZ   LYS 158          1HZ       LYS 158 125.848  14.709   0.421
  605   2HZ   LYS 158          2HZ       LYS 158 124.985  15.650  -0.689
  606   3HZ   LYS 158          3HZ       LYS 158 126.669  15.786  -0.595
  607    H    GLY 159           H        GLY 159 129.883   9.777  -5.793
  608   1HA   GLY 159          2HA       GLY 159 131.071  11.193  -7.324
  609   2HA   GLY 159          1HA       GLY 159 131.466  12.250  -5.977
  610    H    VAL 160           H        VAL 160 132.064   9.005  -7.274
  611    HA   VAL 160           HA       VAL 160 134.362   8.562  -5.626
  612    HB   VAL 160           HB       VAL 160 133.617   7.102  -8.160
  613   1HG1  VAL 160          1HG1      VAL 160 135.660   6.238  -7.730
  614   2HG1  VAL 160          2HG1      VAL 160 134.758   5.266  -6.565
  615   3HG1  VAL 160          3HG1      VAL 160 135.621   6.709  -6.030
  616   1HG2  VAL 160          1HG2      VAL 160 132.242   5.664  -6.940
  617   2HG2  VAL 160          2HG2      VAL 160 131.822   7.263  -6.328
  618   3HG2  VAL 160          3HG2      VAL 160 132.883   6.212  -5.392
  619    H    GLU 161           H        GLU 161 133.902   9.285  -9.082
  620    HA   GLU 161           HA       GLU 161 136.723   9.572  -9.541
  621   1HB   GLU 161          2HB       GLU 161 134.253   9.732 -11.162
  622   2HB   GLU 161          1HB       GLU 161 135.608  10.697 -11.730
  623   1HG   GLU 161          2HG       GLU 161 136.798   8.300 -11.202
  624   2HG   GLU 161          1HG       GLU 161 135.205   7.808 -11.774
  Start of MODEL    2
    1   1H    MET  81          1HT       MET  81  98.084  16.475  14.775
    2   2H    MET  81          2HT       MET  81  98.763  15.857  16.225
    3   3H    MET  81          3HT       MET  81  98.799  17.545  15.909
    4    HA   MET  81           HA       MET  81  97.120  17.282  17.421
    5   1HB   MET  81          2HB       MET  81  96.692  18.285  14.936
    6   2HB   MET  81          1HB       MET  81  95.402  17.093  15.022
    7   1HG   MET  81          2HG       MET  81  94.180  18.436  16.280
    8   2HG   MET  81          1HG       MET  81  95.478  18.575  17.463
    9   1HE   MET  81          1HE       MET  81  93.930  19.584  14.323
   10   2HE   MET  81          2HE       MET  81  95.231  20.510  13.573
   11   3HE   MET  81          3HE       MET  81  93.919  21.346  14.404
   12    H    VAL  82           H        VAL  82  96.840  14.860  14.854
   13    HA   VAL  82           HA       VAL  82  96.207  12.757  16.592
   14    HB   VAL  82           HB       VAL  82  94.068  13.940  16.870
   15   1HG1  VAL  82          1HG1      VAL  82  94.293  14.645  14.271
   16   2HG1  VAL  82          2HG1      VAL  82  92.787  14.709  15.187
   17   3HG1  VAL  82          3HG1      VAL  82  93.131  13.325  14.151
   18   1HG2  VAL  82          1HG2      VAL  82  93.863  11.642  17.198
   19   2HG2  VAL  82          2HG2      VAL  82  94.095  11.279  15.489
   20   3HG2  VAL  82          3HG2      VAL  82  92.586  12.007  16.039
   21    H    ARG  83           H        ARG  83  96.501  10.853  15.572
   22    HA   ARG  83           HA       ARG  83  96.997   9.366  13.925
   23   1HB   ARG  83          2HB       ARG  83  95.165  11.128  12.288
   24   2HB   ARG  83          1HB       ARG  83  95.720   9.530  11.813
   25   1HG   ARG  83          2HG       ARG  83  94.664   8.913  14.184
   26   2HG   ARG  83          1HG       ARG  83  93.674  10.320  13.790
   27   1HD   ARG  83          2HD       ARG  83  92.656   8.218  13.020
   28   2HD   ARG  83          1HD       ARG  83  93.024   9.312  11.687
   29    HE   ARG  83           HE       ARG  83  95.192   7.579  12.032
   30   1HH1  ARG  83          1HH1      ARG  83  91.854   7.477  11.020
   31   2HH1  ARG  83          2HH1      ARG  83  92.084   6.120   9.969
   32   1HH2  ARG  83          1HH2      ARG  83  95.498   5.794  10.651
   33   2HH2  ARG  83          2HH2      ARG  83  94.151   5.163   9.760
   34    H    CYS  84           H        CYS  84  99.159   9.686  13.642
   35    HA   CYS  84           HA       CYS  84  99.943  11.578  11.520
   36   1HB   CYS  84          2HB       CYS  84 100.783  12.171  13.796
   37   2HB   CYS  84          1HB       CYS  84 101.651  10.641  13.834
   38    HG   CYS  84           HG       CYS  84 102.964  11.637  11.660
   39    H    MET  85           H        MET  85 100.256  10.433   9.721
   40    HA   MET  85           HA       MET  85 101.691   7.867   9.927
   41   1HB   MET  85          2HB       MET  85  99.316   7.919   8.972
   42   2HB   MET  85          1HB       MET  85 100.010   8.746   7.585
   43   1HG   MET  85          2HG       MET  85 100.973   6.881   6.782
   44   2HG   MET  85          1HG       MET  85 101.360   6.260   8.385
   45   1HE   MET  85          1HE       MET  85 100.326   4.945   9.669
   46   2HE   MET  85          2HE       MET  85  99.562   3.562   8.885
   47   3HE   MET  85          3HE       MET  85  98.584   4.708   9.805
   48    H    LYS  86           H        LYS  86 101.509  10.949   8.253
   49    HA   LYS  86           HA       LYS  86 103.566  10.412   6.368
   50   1HB   LYS  86          2HB       LYS  86 101.755  12.265   6.346
   51   2HB   LYS  86          1HB       LYS  86 102.880  13.165   7.354
   52   1HG   LYS  86          2HG       LYS  86 104.582  12.998   5.608
   53   2HG   LYS  86          1HG       LYS  86 103.447  12.102   4.595
   54   1HD   LYS  86          2HD       LYS  86 101.909  14.172   4.970
   55   2HD   LYS  86          1HD       LYS  86 103.419  14.986   5.386
   56   1HE   LYS  86          2HE       LYS  86 104.275  13.961   3.156
   57   2HE   LYS  86          1HE       LYS  86 102.559  13.797   2.779
   58   1HZ   LYS  86          1HZ       LYS  86 103.407  16.394   3.776
   59   2HZ   LYS  86          2HZ       LYS  86 102.307  16.010   2.549
   60   3HZ   LYS  86          3HZ       LYS  86 103.969  15.975   2.234
   61    H    ASP  87           H        ASP  87 105.568   9.914   6.983
   62    HA   ASP  87           HA       ASP  87 106.749  11.353   9.259
   63   1HB   ASP  87          2HB       ASP  87 108.457   9.486   9.195
   64   2HB   ASP  87          1HB       ASP  87 106.821   8.998   9.629
   65    H    ASP  88           H        ASP  88 109.220  11.581   9.035
   66    HA   ASP  88           HA       ASP  88 109.725  13.277   6.816
   67   1HB   ASP  88          2HB       ASP  88 111.257  12.327   9.180
   68   2HB   ASP  88          1HB       ASP  88 112.190  12.934   7.815
   69    H    SER  89           H        SER  89 110.535   9.947   7.570
   70    HA   SER  89           HA       SER  89 112.469   9.503   5.594
   71   1HB   SER  89          2HB       SER  89 110.544   7.328   6.299
   72   2HB   SER  89          1HB       SER  89 112.299   7.263   6.133
   73    HG   SER  89           HG       SER  89 112.519   7.833   8.161
   74    H    LYS  90           H        LYS  90 112.101  10.146   3.550
   75    HA   LYS  90           HA       LYS  90 109.527   9.652   2.291
   76   1HB   LYS  90          2HB       LYS  90 111.962  11.234   1.598
   77   2HB   LYS  90          1HB       LYS  90 110.883  10.740   0.302
   78   1HG   LYS  90          2HG       LYS  90 109.059  11.754   1.930
   79   2HG   LYS  90          1HG       LYS  90 110.449  12.678   2.502
   80   1HD   LYS  90          2HD       LYS  90 110.806  13.651   0.394
   81   2HD   LYS  90          1HD       LYS  90 109.782  12.467  -0.420
   82   1HE   LYS  90          2HE       LYS  90 107.945  13.482   1.185
   83   2HE   LYS  90          1HE       LYS  90 109.030  14.873   1.159
   84   1HZ   LYS  90          1HZ       LYS  90 107.484  13.684  -1.037
   85   2HZ   LYS  90          2HZ       LYS  90 108.928  14.489  -1.394
   86   3HZ   LYS  90          3HZ       LYS  90 107.673  15.313  -0.614
   87    H    GLY  91           H        GLY  91 109.929   9.060  -0.230
   88   1HA   GLY  91          2HA       GLY  91 110.504   6.320  -0.265
   89   2HA   GLY  91          1HA       GLY  91 110.349   7.338  -1.688
   90    H    LYS  92           H        LYS  92 112.114   7.727  -2.874
   91    HA   LYS  92           HA       LYS  92 114.551   6.395  -2.247
   92   1HB   LYS  92          2HB       LYS  92 113.422   7.134  -4.559
   93   2HB   LYS  92          1HB       LYS  92 114.509   8.498  -4.347
   94   1HG   LYS  92          2HG       LYS  92 115.764   5.893  -3.907
   95   2HG   LYS  92          1HG       LYS  92 115.155   6.142  -5.545
   96   1HD   LYS  92          2HD       LYS  92 116.483   8.090  -5.834
   97   2HD   LYS  92          1HD       LYS  92 116.892   8.146  -4.118
   98   1HE   LYS  92          2HE       LYS  92 118.041   5.937  -4.420
   99   2HE   LYS  92          1HE       LYS  92 117.789   6.117  -6.156
  100   1HZ   LYS  92          1HZ       LYS  92 120.003   6.871  -5.226
  101   2HZ   LYS  92          2HZ       LYS  92 119.174   8.184  -4.558
  102   3HZ   LYS  92          3HZ       LYS  92 119.197   7.963  -6.235
  103    H    THR  93           H        THR  93 114.993   7.413  -0.175
  104    HA   THR  93           HA       THR  93 115.988  10.165  -0.346
  105    HB   THR  93           HB       THR  93 116.222   9.726   2.236
  106    HG1  THR  93           HG1      THR  93 114.655   8.229   2.947
  107   1HG2  THR  93          1HG2      THR  93 114.334  10.890   2.555
  108   2HG2  THR  93          2HG2      THR  93 113.365   9.804   1.557
  109   3HG2  THR  93          3HG2      THR  93 114.372  11.037   0.798
  110    H    GLU  94           H        GLU  94 117.918  10.404   1.392
  111    HA   GLU  94           HA       GLU  94 120.171   9.271   0.169
  112   1HB   GLU  94          2HB       GLU  94 120.012  10.425   2.958
  113   2HB   GLU  94          1HB       GLU  94 121.457  10.269   1.967
  114   1HG   GLU  94          2HG       GLU  94 120.962  12.081   0.712
  115   2HG   GLU  94          1HG       GLU  94 119.222  11.812   0.810
  116    H    GLU  95           H        GLU  95 118.222   8.227   2.871
  117    HA   GLU  95           HA       GLU  95 119.967   6.394   4.053
  118   1HB   GLU  95          2HB       GLU  95 117.840   5.243   4.805
  119   2HB   GLU  95          1HB       GLU  95 117.981   6.945   5.222
  120   1HG   GLU  95          2HG       GLU  95 116.172   7.492   4.052
  121   2HG   GLU  95          1HG       GLU  95 116.675   6.530   2.663
  122    H    GLU  96           H        GLU  96 118.219   6.240   1.074
  123    HA   GLU  96           HA       GLU  96 117.948   3.511   0.676
  124   1HB   GLU  96          2HB       GLU  96 118.467   5.779  -1.233
  125   2HB   GLU  96          1HB       GLU  96 118.275   4.126  -1.800
  126   1HG   GLU  96          2HG       GLU  96 116.253   5.789  -0.321
  127   2HG   GLU  96          1HG       GLU  96 116.182   5.259  -2.000
  128    H    LEU  97           H        LEU  97 120.798   5.525   0.470
  129    HA   LEU  97           HA       LEU  97 122.484   3.805  -0.957
  130   1HB   LEU  97          2HB       LEU  97 122.837   6.090   0.888
  131   2HB   LEU  97          1HB       LEU  97 124.224   5.034   0.704
  132    HG   LEU  97           HG       LEU  97 122.800   6.385  -1.589
  133   1HD1  LEU  97          1HD1      LEU  97 124.978   7.266   0.200
  134   2HD1  LEU  97          2HD1      LEU  97 123.799   8.210  -0.710
  135   3HD1  LEU  97          3HD1      LEU  97 125.212   7.543  -1.527
  136   1HD2  LEU  97          1HD2      LEU  97 125.367   4.813  -1.423
  137   2HD2  LEU  97          2HD2      LEU  97 124.844   5.736  -2.830
  138   3HD2  LEU  97          3HD2      LEU  97 123.894   4.357  -2.280
  139    H    SER  98           H        SER  98 121.453   3.786   2.375
  140    HA   SER  98           HA       SER  98 123.427   2.143   3.483
  141   1HB   SER  98          2HB       SER  98 121.961   1.834   5.312
  142   2HB   SER  98          1HB       SER  98 121.546   3.424   4.674
  143    HG   SER  98           HG       SER  98 119.662   2.270   5.013
  144    H    ASP  99           H        ASP  99 120.552   1.373   1.620
  145    HA   ASP  99           HA       ASP  99 120.452  -1.385   2.107
  146   1HB   ASP  99          2HB       ASP  99 118.736   0.117   0.909
  147   2HB   ASP  99          1HB       ASP  99 119.710  -0.143  -0.536
  148    H    LEU 100           H        LEU 100 122.364   0.520  -0.136
  149    HA   LEU 100           HA       LEU 100 123.389  -1.779  -1.535
  150   1HB   LEU 100          2HB       LEU 100 123.680   1.151  -1.700
  151   2HB   LEU 100          1HB       LEU 100 125.094   0.234  -2.186
  152    HG   LEU 100           HG       LEU 100 122.328  -0.091  -3.353
  153   1HD1  LEU 100          1HD1      LEU 100 124.769   1.388  -4.282
  154   2HD1  LEU 100          2HD1      LEU 100 123.117   1.980  -4.116
  155   3HD1  LEU 100          3HD1      LEU 100 123.520   0.841  -5.400
  156   1HD2  LEU 100          1HD2      LEU 100 124.928  -1.499  -3.770
  157   2HD2  LEU 100          2HD2      LEU 100 123.810  -1.308  -5.120
  158   3HD2  LEU 100          3HD2      LEU 100 123.296  -2.158  -3.664
  159    H    PHE 101           H        PHE 101 124.359   0.227   1.153
  160    HA   PHE 101           HA       PHE 101 127.075  -0.518   1.274
  161   1HB   PHE 101          2HB       PHE 101 126.151   1.406   2.501
  162   2HB   PHE 101          1HB       PHE 101 125.231   0.312   3.526
  163    HD1  PHE 101           HD1      PHE 101 126.203  -0.679   5.418
  164    HD2  PHE 101           HD2      PHE 101 128.658   1.336   2.585
  165    HE1  PHE 101           HE1      PHE 101 128.106  -0.823   6.970
  166    HE2  PHE 101           HE2      PHE 101 130.566   1.194   4.131
  167    HZ   PHE 101           HZ       PHE 101 130.292   0.114   6.327
  168    H    ARG 102           H        ARG 102 124.156  -1.946   2.652
  169    HA   ARG 102           HA       ARG 102 125.377  -3.843   4.311
  170   1HB   ARG 102          2HB       ARG 102 122.707  -3.427   3.143
  171   2HB   ARG 102          1HB       ARG 102 123.085  -5.103   3.519
  172   1HG   ARG 102          2HG       ARG 102 123.321  -4.668   5.794
  173   2HG   ARG 102          1HG       ARG 102 123.507  -2.933   5.538
  174   1HD   ARG 102          2HD       ARG 102 121.286  -2.577   5.476
  175   2HD   ARG 102          1HD       ARG 102 120.973  -4.058   4.572
  176    HE   ARG 102           HE       ARG 102 121.685  -4.780   7.168
  177   1HH1  ARG 102          1HH1      ARG 102 119.104  -3.096   5.532
  178   2HH1  ARG 102          2HH1      ARG 102 117.909  -3.528   6.707
  179   1HH2  ARG 102          1HH2      ARG 102 120.112  -5.348   8.716
  180   2HH2  ARG 102          2HH2      ARG 102 118.480  -4.806   8.514
  181    H    MET 103           H        MET 103 124.776  -3.821   0.870
  182    HA   MET 103           HA       MET 103 125.104  -6.549   0.326
  183   1HB   MET 103          2HB       MET 103 125.695  -4.109  -1.349
  184   2HB   MET 103          1HB       MET 103 125.794  -5.751  -1.969
  185   1HG   MET 103          2HG       MET 103 123.273  -5.197  -0.632
  186   2HG   MET 103          1HG       MET 103 123.578  -4.130  -2.003
  187   1HE   MET 103          1HE       MET 103 122.378  -4.813  -4.195
  188   2HE   MET 103          2HE       MET 103 123.084  -6.186  -5.046
  189   3HE   MET 103          3HE       MET 103 124.127  -4.931  -4.379
  190    H    PHE 104           H        PHE 104 127.445  -3.960   0.760
  191    HA   PHE 104           HA       PHE 104 129.701  -5.524  -0.050
  192   1HB   PHE 104          2HB       PHE 104 129.193  -2.801   0.764
  193   2HB   PHE 104          1HB       PHE 104 130.607  -3.433   1.601
  194    HD1  PHE 104           HD1      PHE 104 129.188  -3.633  -1.850
  195    HD2  PHE 104           HD2      PHE 104 132.597  -2.936   0.599
  196    HE1  PHE 104           HE1      PHE 104 130.547  -3.239  -3.862
  197    HE2  PHE 104           HE2      PHE 104 133.964  -2.540  -1.409
  198    HZ   PHE 104           HZ       PHE 104 132.939  -2.692  -3.643
  199    H    ASP 105           H        ASP 105 128.336  -4.541   3.075
  200    HA   ASP 105           HA       ASP 105 130.292  -5.699   4.709
  201   1HB   ASP 105          2HB       ASP 105 127.942  -4.273   5.108
  202   2HB   ASP 105          1HB       ASP 105 127.614  -5.834   5.855
  203    H    LYS 106           H        LYS 106 130.516  -7.694   5.646
  204    HA   LYS 106           HA       LYS 106 129.341  -9.901   4.227
  205   1HB   LYS 106          2HB       LYS 106 131.705  -9.904   4.959
  206   2HB   LYS 106          1HB       LYS 106 131.170  -9.912   6.633
  207   1HG   LYS 106          2HG       LYS 106 131.762 -12.134   6.067
  208   2HG   LYS 106          1HG       LYS 106 130.002 -12.071   6.163
  209   1HD   LYS 106          2HD       LYS 106 130.459 -11.477   3.531
  210   2HD   LYS 106          1HD       LYS 106 131.747 -12.633   3.880
  211   1HE   LYS 106          2HE       LYS 106 130.272 -14.339   4.344
  212   2HE   LYS 106          1HE       LYS 106 128.967 -13.235   4.776
  213   1HZ   LYS 106          1HZ       LYS 106 128.921 -12.610   2.355
  214   2HZ   LYS 106          2HZ       LYS 106 128.389 -14.174   2.714
  215   3HZ   LYS 106          3HZ       LYS 106 129.932 -13.937   2.065
  216    H    ASN 107           H        ASN 107 129.487  -9.088   7.702
  217    HA   ASN 107           HA       ASN 107 126.972 -10.572   8.056
  218   1HB   ASN 107          2HB       ASN 107 127.651 -10.591  10.500
  219   2HB   ASN 107          1HB       ASN 107 128.667 -11.538   9.417
  220   1HD2  ASN 107          1HD2      ASN 107 130.492 -11.468  10.641
  221   2HD2  ASN 107          2HD2      ASN 107 131.388 -10.023  10.938
  222    H    ALA 108           H        ALA 108 127.509  -7.649   7.266
  223    HA   ALA 108           HA       ALA 108 126.661  -5.578   7.697
  224   1HB   ALA 108          1HB       ALA 108 124.394  -6.676   9.243
  225   2HB   ALA 108          2HB       ALA 108 124.610  -7.294   7.605
  226   3HB   ALA 108          3HB       ALA 108 124.404  -5.563   7.874
  227    H    ASP 109           H        ASP 109 128.610  -5.629   9.289
  228    HA   ASP 109           HA       ASP 109 127.750  -5.405  12.072
  229   1HB   ASP 109          2HB       ASP 109 129.990  -6.505  11.009
  230   2HB   ASP 109          1HB       ASP 109 130.577  -4.888  11.382
  231    H    GLY 110           H        GLY 110 128.761  -3.452   9.379
  232   1HA   GLY 110          2HA       GLY 110 127.898  -1.118   9.527
  233   2HA   GLY 110          1HA       GLY 110 128.636  -1.066  11.121
  234    H    TYR 111           H        TYR 111 130.893  -2.748   9.781
  235    HA   TYR 111           HA       TYR 111 132.192  -0.530   8.356
  236   1HB   TYR 111          2HB       TYR 111 133.474  -2.243  10.494
  237   2HB   TYR 111          1HB       TYR 111 134.299  -1.022   9.531
  238    HD1  TYR 111           HD1      TYR 111 133.547   1.395   9.760
  239    HD2  TYR 111           HD2      TYR 111 132.347  -1.658  12.470
  240    HE1  TYR 111           HE1      TYR 111 132.952   3.110  11.420
  241    HE2  TYR 111           HE2      TYR 111 131.748   0.049  14.136
  242    HH   TYR 111           HH       TYR 111 131.462   3.329  13.388
  243    H    ILE 112           H        ILE 112 134.103  -1.230   7.095
  244    HA   ILE 112           HA       ILE 112 133.912  -4.038   6.233
  245    HB   ILE 112           HB       ILE 112 134.327  -1.709   4.357
  246   1HG1  ILE 112          2HG1      ILE 112 131.867  -3.390   4.276
  247   2HG1  ILE 112          1HG1      ILE 112 131.975  -2.162   5.533
  248   1HG2  ILE 112          1HG2      ILE 112 134.256  -4.669   4.050
  249   2HG2  ILE 112          2HG2      ILE 112 135.300  -3.475   3.277
  250   3HG2  ILE 112          3HG2      ILE 112 133.631  -3.665   2.741
  251   1HD1  ILE 112          1HD1      ILE 112 131.943  -0.428   4.022
  252   2HD1  ILE 112          2HD1      ILE 112 130.865  -1.598   3.266
  253   3HD1  ILE 112          3HD1      ILE 112 132.525  -1.432   2.696
  254    H    ASP 113           H        ASP 113 135.812  -5.070   5.925
  255    HA   ASP 113           HA       ASP 113 138.277  -3.472   5.899
  256   1HB   ASP 113          2HB       ASP 113 137.493  -4.763   8.144
  257   2HB   ASP 113          1HB       ASP 113 138.400  -6.048   7.351
  258    H    LEU 114           H        LEU 114 140.203  -5.133   5.513
  259    HA   LEU 114           HA       LEU 114 139.936  -6.066   2.894
  260   1HB   LEU 114          2HB       LEU 114 142.058  -5.472   4.192
  261   2HB   LEU 114          1HB       LEU 114 141.977  -7.094   4.850
  262    HG   LEU 114           HG       LEU 114 141.760  -7.456   2.091
  263   1HD1  LEU 114          1HD1      LEU 114 144.052  -6.281   1.537
  264   2HD1  LEU 114          2HD1      LEU 114 143.500  -5.140   2.763
  265   3HD1  LEU 114          3HD1      LEU 114 142.516  -5.441   1.331
  266   1HD2  LEU 114          1HD2      LEU 114 143.835  -7.886   4.178
  267   2HD2  LEU 114          2HD2      LEU 114 144.283  -8.118   2.488
  268   3HD2  LEU 114          3HD2      LEU 114 142.965  -9.058   3.187
  269    H    GLU 115           H        GLU 115 139.498  -7.688   5.970
  270    HA   GLU 115           HA       GLU 115 139.424 -10.332   4.910
  271   1HB   GLU 115          2HB       GLU 115 139.098  -9.054   7.503
  272   2HB   GLU 115          1HB       GLU 115 137.962 -10.376   7.276
  273   1HG   GLU 115          2HG       GLU 115 139.661 -11.952   7.026
  274   2HG   GLU 115          1HG       GLU 115 140.882 -10.718   6.716
  275    H    GLU 116           H        GLU 116 136.912  -8.016   5.885
  276    HA   GLU 116           HA       GLU 116 134.739  -9.711   5.188
  277   1HB   GLU 116          2HB       GLU 116 135.098  -6.921   6.069
  278   2HB   GLU 116          1HB       GLU 116 133.670  -7.209   5.083
  279   1HG   GLU 116          2HG       GLU 116 132.705  -8.597   6.640
  280   2HG   GLU 116          1HG       GLU 116 134.249  -9.011   7.383
  281    H    LEU 117           H        LEU 117 136.634  -7.337   3.449
  282    HA   LEU 117           HA       LEU 117 134.862  -7.228   1.190
  283   1HB   LEU 117          2HB       LEU 117 136.769  -5.565   2.098
  284   2HB   LEU 117          1HB       LEU 117 137.700  -6.432   0.891
  285    HG   LEU 117           HG       LEU 117 135.978  -5.816  -0.807
  286   1HD1  LEU 117          1HD1      LEU 117 134.127  -4.627  -0.338
  287   2HD1  LEU 117          2HD1      LEU 117 134.927  -3.666   0.908
  288   3HD1  LEU 117          3HD1      LEU 117 134.355  -5.294   1.277
  289   1HD2  LEU 117          1HD2      LEU 117 138.110  -4.417   0.031
  290   2HD2  LEU 117          2HD2      LEU 117 136.841  -3.227   0.322
  291   3HD2  LEU 117          3HD2      LEU 117 137.068  -3.896  -1.294
  292    H    LYS 118           H        LYS 118 137.659  -9.091   2.132
  293    HA   LYS 118           HA       LYS 118 138.384 -10.100  -0.389
  294   1HB   LYS 118          2HB       LYS 118 138.954 -10.728   2.418
  295   2HB   LYS 118          1HB       LYS 118 139.020 -12.128   1.358
  296   1HG   LYS 118          2HG       LYS 118 140.645 -11.012  -0.057
  297   2HG   LYS 118          1HG       LYS 118 140.547  -9.565   0.949
  298   1HD   LYS 118          2HD       LYS 118 142.360 -10.502   1.936
  299   2HD   LYS 118          1HD       LYS 118 141.121 -11.375   2.840
  300   1HE   LYS 118          2HE       LYS 118 141.881 -12.594   0.277
  301   2HE   LYS 118          1HE       LYS 118 143.166 -12.545   1.483
  302   1HZ   LYS 118          1HZ       LYS 118 141.154 -13.421   2.971
  303   2HZ   LYS 118          2HZ       LYS 118 142.192 -14.457   2.128
  304   3HZ   LYS 118          3HZ       LYS 118 140.684 -14.060   1.475
  305    H    ILE 119           H        ILE 119 135.838 -10.962   1.824
  306    HA   ILE 119           HA       ILE 119 135.270 -13.528   0.735
  307    HB   ILE 119           HB       ILE 119 133.363 -11.713   2.212
  308   1HG1  ILE 119          2HG1      ILE 119 134.926 -13.889   3.545
  309   2HG1  ILE 119          1HG1      ILE 119 135.703 -12.333   3.265
  310   1HG2  ILE 119          1HG2      ILE 119 133.295 -14.517   1.311
  311   2HG2  ILE 119          2HG2      ILE 119 131.977 -13.380   1.589
  312   3HG2  ILE 119          3HG2      ILE 119 132.721 -14.219   2.951
  313   1HD1  ILE 119          1HD1      ILE 119 133.411 -11.499   4.377
  314   2HD1  ILE 119          2HD1      ILE 119 134.864 -11.884   5.300
  315   3HD1  ILE 119          3HD1      ILE 119 133.572 -13.076   5.151
  316    H    MET 120           H        MET 120 133.639 -10.375   0.375
  317    HA   MET 120           HA       MET 120 131.747 -11.188  -1.514
  318   1HB   MET 120          2HB       MET 120 131.493  -8.810  -2.039
  319   2HB   MET 120          1HB       MET 120 131.588  -9.069  -0.303
  320   1HG   MET 120          2HG       MET 120 133.539  -7.960  -0.101
  321   2HG   MET 120          1HG       MET 120 134.133  -8.495  -1.671
  322   1HE   MET 120          1HE       MET 120 134.552  -6.686  -3.498
  323   2HE   MET 120          2HE       MET 120 133.122  -5.867  -4.125
  324   3HE   MET 120          3HE       MET 120 133.119  -7.619  -3.930
  325    H    LEU 121           H        LEU 121 135.108 -10.342  -1.869
  326    HA   LEU 121           HA       LEU 121 135.047  -9.936  -4.691
  327   1HB   LEU 121          2HB       LEU 121 137.290 -10.519  -2.765
  328   2HB   LEU 121          1HB       LEU 121 137.548 -10.253  -4.479
  329    HG   LEU 121           HG       LEU 121 136.184  -8.216  -2.732
  330   1HD1  LEU 121          1HD1      LEU 121 138.441  -8.736  -1.850
  331   2HD1  LEU 121          2HD1      LEU 121 138.289  -7.090  -2.469
  332   3HD1  LEU 121          3HD1      LEU 121 139.114  -8.321  -3.427
  333   1HD2  LEU 121          1HD2      LEU 121 135.766  -7.745  -4.983
  334   2HD2  LEU 121          2HD2      LEU 121 137.385  -8.230  -5.482
  335   3HD2  LEU 121          3HD2      LEU 121 137.152  -6.731  -4.580
  336    H    GLN 122           H        GLN 122 135.354 -12.714  -2.614
  337    HA   GLN 122           HA       GLN 122 136.528 -14.536  -4.374
  338   1HB   GLN 122          2HB       GLN 122 134.447 -15.064  -2.243
  339   2HB   GLN 122          1HB       GLN 122 135.473 -16.280  -2.991
  340   1HG   GLN 122          2HG       GLN 122 137.352 -14.576  -2.116
  341   2HG   GLN 122          1HG       GLN 122 136.095 -14.290  -0.913
  342   1HE2  GLN 122          1HE2      GLN 122 138.489 -15.346  -0.162
  343   2HE2  GLN 122          2HE2      GLN 122 138.289 -17.000   0.294
  344    H    ALA 123           H        ALA 123 133.267 -13.312  -4.188
  345    HA   ALA 123           HA       ALA 123 132.012 -15.299  -5.765
  346   1HB   ALA 123          1HB       ALA 123 131.002 -12.502  -5.795
  347   2HB   ALA 123          2HB       ALA 123 131.034 -13.365  -4.258
  348   3HB   ALA 123          3HB       ALA 123 130.123 -14.021  -5.618
  349    H    THR 124           H        THR 124 133.342 -12.103  -6.579
  350    HA   THR 124           HA       THR 124 132.705 -12.131  -9.304
  351    HB   THR 124           HB       THR 124 134.629 -10.494  -9.506
  352    HG1  THR 124           HG1      THR 124 135.617  -9.867  -7.589
  353   1HG2  THR 124          1HG2      THR 124 133.604  -8.733  -8.240
  354   2HG2  THR 124          2HG2      THR 124 132.728  -9.903  -7.253
  355   3HG2  THR 124          3HG2      THR 124 132.348  -9.736  -8.968
  356    H    GLY 125           H        GLY 125 134.156 -12.390 -11.143
  357   1HA   GLY 125          2HA       GLY 125 135.905 -14.718 -10.745
  358   2HA   GLY 125          1HA       GLY 125 135.182 -14.225 -12.269
  359    H    GLU 126           H        GLU 126 136.746 -11.945 -10.138
  360    HA   GLU 126           HA       GLU 126 138.777 -11.498 -12.203
  361   1HB   GLU 126          2HB       GLU 126 137.917  -9.771  -9.874
  362   2HB   GLU 126          1HB       GLU 126 139.160  -9.340 -11.041
  363   1HG   GLU 126          2HG       GLU 126 137.214  -9.791 -12.761
  364   2HG   GLU 126          1HG       GLU 126 136.213  -9.432 -11.353
  365    H    THR 127           H        THR 127 140.986 -11.268 -11.665
  366    HA   THR 127           HA       THR 127 141.777 -12.913  -9.388
  367    HB   THR 127           HB       THR 127 143.930 -13.084 -10.448
  368    HG1  THR 127           HG1      THR 127 142.985 -11.090 -12.228
  369   1HG2  THR 127          1HG2      THR 127 141.892 -14.285 -11.505
  370   2HG2  THR 127          2HG2      THR 127 143.432 -14.250 -12.362
  371   3HG2  THR 127          3HG2      THR 127 142.137 -13.146 -12.828
  372    H    ILE 128           H        ILE 128 141.373 -11.397  -7.721
  373    HA   ILE 128           HA       ILE 128 143.119  -9.033  -7.698
  374    HB   ILE 128           HB       ILE 128 140.850  -9.632  -5.802
  375   1HG1  ILE 128          2HG1      ILE 128 140.029  -7.556  -7.433
  376   2HG1  ILE 128          1HG1      ILE 128 140.823  -8.653  -8.560
  377   1HG2  ILE 128          1HG2      ILE 128 142.861  -7.884  -5.468
  378   2HG2  ILE 128          2HG2      ILE 128 141.228  -7.616  -4.858
  379   3HG2  ILE 128          3HG2      ILE 128 141.734  -6.877  -6.378
  380   1HD1  ILE 128          1HD1      ILE 128 138.809  -9.687  -6.614
  381   2HD1  ILE 128          2HD1      ILE 128 139.310 -10.353  -8.168
  382   3HD1  ILE 128          3HD1      ILE 128 138.301  -8.908  -8.112
  383    H    THR 129           H        THR 129 144.791  -8.896  -6.332
  384    HA   THR 129           HA       THR 129 145.380 -11.172  -4.633
  385    HB   THR 129           HB       THR 129 147.121  -8.742  -4.786
  386    HG1  THR 129           HG1      THR 129 147.007 -10.739  -6.795
  387   1HG2  THR 129          1HG2      THR 129 148.228 -10.256  -3.506
  388   2HG2  THR 129          2HG2      THR 129 148.799 -10.743  -5.101
  389   3HG2  THR 129          3HG2      THR 129 147.501 -11.644  -4.315
  390    H    GLU 130           H        GLU 130 146.162 -10.845  -2.409
  391    HA   GLU 130           HA       GLU 130 144.270  -9.559  -0.811
  392   1HB   GLU 130          2HB       GLU 130 145.811 -10.006   1.061
  393   2HB   GLU 130          1HB       GLU 130 145.605 -11.407   0.020
  394   1HG   GLU 130          2HG       GLU 130 147.760 -11.435  -0.584
  395   2HG   GLU 130          1HG       GLU 130 147.858  -9.678  -0.699
  396    H    ASP 131           H        ASP 131 147.260  -8.406  -2.179
  397    HA   ASP 131           HA       ASP 131 147.411  -6.066  -0.514
  398   1HB   ASP 131          2HB       ASP 131 149.041  -7.329  -2.571
  399   2HB   ASP 131          1HB       ASP 131 148.976  -5.579  -2.762
  400    H    ASP 132           H        ASP 132 146.234  -6.839  -3.741
  401    HA   ASP 132           HA       ASP 132 145.787  -4.219  -4.643
  402   1HB   ASP 132          2HB       ASP 132 144.947  -6.927  -5.436
  403   2HB   ASP 132          1HB       ASP 132 143.826  -5.650  -5.899
  404    H    ILE 133           H        ILE 133 143.960  -6.288  -2.516
  405    HA   ILE 133           HA       ILE 133 141.500  -4.878  -2.646
  406    HB   ILE 133           HB       ILE 133 142.532  -6.533  -0.342
  407   1HG1  ILE 133          2HG1      ILE 133 140.712  -7.585  -2.478
  408   2HG1  ILE 133          1HG1      ILE 133 142.450  -7.555  -2.758
  409   1HG2  ILE 133          1HG2      ILE 133 139.873  -6.934  -0.402
  410   2HG2  ILE 133          2HG2      ILE 133 139.950  -5.278  -1.006
  411   3HG2  ILE 133          3HG2      ILE 133 140.651  -5.679   0.562
  412   1HD1  ILE 133          1HD1      ILE 133 142.195  -8.686  -0.249
  413   2HD1  ILE 133          2HD1      ILE 133 142.514  -9.532  -1.763
  414   3HD1  ILE 133          3HD1      ILE 133 140.859  -9.371  -1.175
  415    H    GLU 134           H        GLU 134 144.440  -4.458  -0.804
  416    HA   GLU 134           HA       GLU 134 143.454  -2.779   1.222
  417   1HB   GLU 134          2HB       GLU 134 146.114  -3.396   0.066
  418   2HB   GLU 134          1HB       GLU 134 145.982  -1.881   0.949
  419   1HG   GLU 134          2HG       GLU 134 144.772  -3.557   2.679
  420   2HG   GLU 134          1HG       GLU 134 145.927  -4.652   1.921
  421    H    GLU 135           H        GLU 135 144.345  -2.161  -2.100
  422    HA   GLU 135           HA       GLU 135 144.296   0.710  -1.792
  423   1HB   GLU 135          2HB       GLU 135 144.469  -1.059  -4.236
  424   2HB   GLU 135          1HB       GLU 135 144.530   0.699  -4.286
  425   1HG   GLU 135          2HG       GLU 135 146.496  -1.136  -2.938
  426   2HG   GLU 135          1HG       GLU 135 146.755  -0.197  -4.408
  427    H    LEU 136           H        LEU 136 142.123  -1.826  -2.822
  428    HA   LEU 136           HA       LEU 136 140.200  -0.289  -4.151
  429   1HB   LEU 136          2HB       LEU 136 140.224  -2.921  -2.769
  430   2HB   LEU 136          1HB       LEU 136 138.660  -2.205  -3.112
  431    HG   LEU 136           HG       LEU 136 140.449  -2.178  -5.422
  432   1HD1  LEU 136          1HD1      LEU 136 139.903  -4.726  -3.977
  433   2HD1  LEU 136          2HD1      LEU 136 141.343  -4.214  -4.858
  434   3HD1  LEU 136          3HD1      LEU 136 139.901  -4.716  -5.741
  435   1HD2  LEU 136          1HD2      LEU 136 138.293  -1.731  -6.006
  436   2HD2  LEU 136          2HD2      LEU 136 137.620  -2.787  -4.764
  437   3HD2  LEU 136          3HD2      LEU 136 138.293  -3.479  -6.240
  438    H    MET 137           H        MET 137 140.878  -0.667  -0.764
  439    HA   MET 137           HA       MET 137 138.360   0.530   0.048
  440   1HB   MET 137          2HB       MET 137 140.718  -0.074   1.825
  441   2HB   MET 137          1HB       MET 137 139.030   0.097   2.285
  442   1HG   MET 137          2HG       MET 137 138.707  -1.948   0.684
  443   2HG   MET 137          1HG       MET 137 140.424  -2.193   0.996
  444   1HE   MET 137          1HE       MET 137 137.668  -0.879   3.821
  445   2HE   MET 137          2HE       MET 137 136.949  -2.484   3.937
  446   3HE   MET 137          3HE       MET 137 136.988  -1.646   2.385
  447    H    LYS 138           H        LYS 138 141.617   1.491  -0.603
  448    HA   LYS 138           HA       LYS 138 141.871   3.781   0.945
  449   1HB   LYS 138          2HB       LYS 138 143.504   2.584  -0.756
  450   2HB   LYS 138          1HB       LYS 138 142.884   3.799  -1.866
  451   1HG   LYS 138          2HG       LYS 138 144.580   5.031  -1.079
  452   2HG   LYS 138          1HG       LYS 138 143.487   5.341   0.272
  453   1HD   LYS 138          2HD       LYS 138 144.485   3.417   1.466
  454   2HD   LYS 138          1HD       LYS 138 145.626   3.217   0.135
  455   1HE   LYS 138          2HE       LYS 138 145.475   5.926   1.273
  456   2HE   LYS 138          1HE       LYS 138 146.106   4.688   2.360
  457   1HZ   LYS 138          1HZ       LYS 138 147.743   4.102   0.683
  458   2HZ   LYS 138          2HZ       LYS 138 147.872   5.739   1.092
  459   3HZ   LYS 138          3HZ       LYS 138 147.137   5.287  -0.362
  460    H    ASP 139           H        ASP 139 140.353   3.377  -2.231
  461    HA   ASP 139           HA       ASP 139 139.746   6.133  -2.569
  462   1HB   ASP 139          2HB       ASP 139 138.513   5.472  -4.501
  463   2HB   ASP 139          1HB       ASP 139 139.923   4.422  -4.414
  464    H    GLY 140           H        GLY 140 138.295   3.623  -0.738
  465   1HA   GLY 140          2HA       GLY 140 135.737   5.048  -0.578
  466   2HA   GLY 140          1HA       GLY 140 136.055   3.430   0.027
  467    H    ASP 141           H        ASP 141 138.607   4.421   1.275
  468    HA   ASP 141           HA       ASP 141 137.388   5.307   3.758
  469   1HB   ASP 141          2HB       ASP 141 139.051   3.479   3.776
  470   2HB   ASP 141          1HB       ASP 141 140.266   4.593   3.157
  471    H    LYS 142           H        LYS 142 137.289   7.352   4.362
  472    HA   LYS 142           HA       LYS 142 139.130   9.279   3.106
  473   1HB   LYS 142          2HB       LYS 142 136.240   9.408   3.798
  474   2HB   LYS 142          1HB       LYS 142 137.180  10.884   3.975
  475   1HG   LYS 142          2HG       LYS 142 136.230  10.935   1.816
  476   2HG   LYS 142          1HG       LYS 142 137.941  10.560   1.603
  477   1HD   LYS 142          2HD       LYS 142 137.006   8.073   1.753
  478   2HD   LYS 142          1HD       LYS 142 135.547   8.864   1.153
  479   1HE   LYS 142          2HE       LYS 142 136.752   8.130  -0.752
  480   2HE   LYS 142          1HE       LYS 142 136.974   9.878  -0.656
  481   1HZ   LYS 142          1HZ       LYS 142 139.075   9.051   0.736
  482   2HZ   LYS 142          2HZ       LYS 142 139.119   9.306  -0.937
  483   3HZ   LYS 142          3HZ       LYS 142 138.915   7.742  -0.324
  484    H    ASN 143           H        ASN 143 137.981   7.965   6.082
  485    HA   ASN 143           HA       ASN 143 139.019  10.132   7.700
  486   1HB   ASN 143          2HB       ASN 143 137.823   7.452   8.434
  487   2HB   ASN 143          1HB       ASN 143 138.350   8.654   9.609
  488   1HD2  ASN 143          1HD2      ASN 143 137.442  10.942   8.979
  489   2HD2  ASN 143          2HD2      ASN 143 135.737  10.969   8.700
  490    H    ASN 144           H        ASN 144 140.282   7.384   6.200
  491    HA   ASN 144           HA       ASN 144 142.308   6.364   6.272
  492   1HB   ASN 144          2HB       ASN 144 142.807   8.966   7.599
  493   2HB   ASN 144          1HB       ASN 144 144.009   7.711   7.883
  494   1HD2  ASN 144          1HD2      ASN 144 145.623   8.641   6.712
  495   2HD2  ASN 144          2HD2      ASN 144 145.574   8.821   4.994
  496    H    ASP 145           H        ASP 145 140.228   5.682   8.179
  497    HA   ASP 145           HA       ASP 145 141.595   5.044  10.651
  498   1HB   ASP 145          2HB       ASP 145 139.452   4.049  11.325
  499   2HB   ASP 145          1HB       ASP 145 139.229   5.686  10.710
  500    H    GLY 146           H        GLY 146 140.765   3.486   7.651
  501   1HA   GLY 146          2HA       GLY 146 142.265   1.589   7.090
  502   2HA   GLY 146          1HA       GLY 146 141.917   0.974   8.699
  503    H    ARG 147           H        ARG 147 139.046   1.920   8.303
  504    HA   ARG 147           HA       ARG 147 138.180  -0.200   6.452
  505   1HB   ARG 147          2HB       ARG 147 137.003   0.417   9.168
  506   2HB   ARG 147          1HB       ARG 147 136.349  -0.743   8.020
  507   1HG   ARG 147          2HG       ARG 147 138.261  -2.149   8.235
  508   2HG   ARG 147          1HG       ARG 147 139.117  -0.931   9.181
  509   1HD   ARG 147          2HD       ARG 147 136.630  -1.453  10.454
  510   2HD   ARG 147          1HD       ARG 147 137.394  -2.999  10.086
  511    HE   ARG 147           HE       ARG 147 139.018  -0.959  11.397
  512   1HH1  ARG 147          1HH1      ARG 147 137.202  -3.934  11.665
  513   2HH1  ARG 147          2HH1      ARG 147 137.943  -4.393  13.159
  514   1HH2  ARG 147          1HH2      ARG 147 139.985  -1.567  13.363
  515   2HH2  ARG 147          2HH2      ARG 147 139.519  -3.052  14.123
  516    H    ILE 148           H        ILE 148 135.672   0.042   6.120
  517    HA   ILE 148           HA       ILE 148 135.131   2.896   5.614
  518    HB   ILE 148           HB       ILE 148 134.090   0.586   3.977
  519   1HG1  ILE 148          2HG1      ILE 148 136.278   2.505   3.175
  520   2HG1  ILE 148          1HG1      ILE 148 136.616   0.936   3.901
  521   1HG2  ILE 148          1HG2      ILE 148 134.203   3.489   3.214
  522   2HG2  ILE 148          2HG2      ILE 148 132.830   2.796   4.080
  523   3HG2  ILE 148          3HG2      ILE 148 133.259   2.192   2.480
  524   1HD1  ILE 148          1HD1      ILE 148 136.697   0.239   1.780
  525   2HD1  ILE 148          2HD1      ILE 148 135.773   1.617   1.184
  526   3HD1  ILE 148          3HD1      ILE 148 134.938   0.235   1.893
  527    H    ASP 149           H        ASP 149 133.120   3.697   6.068
  528    HA   ASP 149           HA       ASP 149 131.129   1.853   7.184
  529   1HB   ASP 149          2HB       ASP 149 130.660   3.492   8.994
  530   2HB   ASP 149          1HB       ASP 149 132.276   2.800   9.099
  531    H    TYR 150           H        TYR 150 128.977   3.008   7.498
  532    HA   TYR 150           HA       TYR 150 128.068   3.974   5.047
  533   1HB   TYR 150          2HB       TYR 150 126.583   2.935   6.683
  534   2HB   TYR 150          1HB       TYR 150 126.828   4.284   7.788
  535    HD1  TYR 150           HD1      TYR 150 125.377   3.338   4.513
  536    HD2  TYR 150           HD2      TYR 150 125.537   6.258   7.605
  537    HE1  TYR 150           HE1      TYR 150 123.458   4.500   3.507
  538    HE2  TYR 150           HE2      TYR 150 123.618   7.428   6.607
  539    HH   TYR 150           HH       TYR 150 121.699   6.881   5.116
  540    H    ASP 151           H        ASP 151 129.506   5.649   7.717
  541    HA   ASP 151           HA       ASP 151 128.512   8.240   7.173
  542   1HB   ASP 151          2HB       ASP 151 130.898   7.196   8.674
  543   2HB   ASP 151          1HB       ASP 151 130.669   8.927   8.437
  544    H    GLU 152           H        GLU 152 131.723   6.841   6.465
  545    HA   GLU 152           HA       GLU 152 132.404   8.998   4.708
  546   1HB   GLU 152          2HB       GLU 152 134.463   7.799   4.314
  547   2HB   GLU 152          1HB       GLU 152 134.091   7.762   6.034
  548   1HG   GLU 152          2HG       GLU 152 132.937   5.481   5.344
  549   2HG   GLU 152          1HG       GLU 152 134.130   5.571   4.047
  550    H    PHE 153           H        PHE 153 131.120   5.761   4.332
  551    HA   PHE 153           HA       PHE 153 131.561   5.414   1.590
  552   1HB   PHE 153          2HB       PHE 153 130.732   3.687   3.258
  553   2HB   PHE 153          1HB       PHE 153 129.136   4.410   3.084
  554    HD1  PHE 153           HD1      PHE 153 131.881   2.869   1.106
  555    HD2  PHE 153           HD2      PHE 153 127.717   3.691   1.403
  556    HE1  PHE 153           HE1      PHE 153 131.466   1.460  -0.869
  557    HE2  PHE 153           HE2      PHE 153 127.293   2.284  -0.570
  558    HZ   PHE 153           HZ       PHE 153 129.169   1.166  -1.709
  559    H    LEU 154           H        LEU 154 129.227   7.322   3.318
  560    HA   LEU 154           HA       LEU 154 127.354   7.675   1.229
  561   1HB   LEU 154          2HB       LEU 154 127.868   8.800   3.873
  562   2HB   LEU 154          1HB       LEU 154 127.224   9.982   2.751
  563    HG   LEU 154           HG       LEU 154 125.257   8.643   2.371
  564   1HD1  LEU 154          1HD1      LEU 154 126.823   6.484   2.991
  565   2HD1  LEU 154          2HD1      LEU 154 125.071   6.459   2.800
  566   3HD1  LEU 154          3HD1      LEU 154 125.781   6.619   4.407
  567   1HD2  LEU 154          1HD2      LEU 154 125.533   8.467   5.327
  568   2HD2  LEU 154          2HD2      LEU 154 124.205   9.092   4.350
  569   3HD2  LEU 154          3HD2      LEU 154 125.673  10.048   4.560
  570    H    GLU 155           H        GLU 155 130.191   9.538   2.252
  571    HA   GLU 155           HA       GLU 155 129.851  11.579   0.287
  572   1HB   GLU 155          2HB       GLU 155 132.109  10.786   2.107
  573   2HB   GLU 155          1HB       GLU 155 132.314  12.045   0.895
  574   1HG   GLU 155          2HG       GLU 155 130.240  13.120   1.950
  575   2HG   GLU 155          1HG       GLU 155 130.533  12.025   3.300
  576    H    PHE 156           H        PHE 156 131.661   8.569   0.462
  577    HA   PHE 156           HA       PHE 156 133.198   8.958  -1.884
  578   1HB   PHE 156          2HB       PHE 156 133.812   7.303  -0.184
  579   2HB   PHE 156          1HB       PHE 156 132.347   6.389  -0.530
  580    HD1  PHE 156           HD1      PHE 156 133.117   4.356  -1.339
  581    HD2  PHE 156           HD2      PHE 156 134.728   7.972  -2.902
  582    HE1  PHE 156           HE1      PHE 156 134.322   3.073  -3.058
  583    HE2  PHE 156           HE2      PHE 156 135.936   6.695  -4.624
  584    HZ   PHE 156           HZ       PHE 156 135.732   4.243  -4.704
  585    H    MET 157           H        MET 157 129.989   7.679  -1.285
  586    HA   MET 157           HA       MET 157 129.630   6.605  -3.910
  587   1HB   MET 157          2HB       MET 157 127.977   6.965  -1.485
  588   2HB   MET 157          1HB       MET 157 127.099   6.929  -3.008
  589   1HG   MET 157          2HG       MET 157 129.115   4.814  -2.452
  590   2HG   MET 157          1HG       MET 157 127.543   4.738  -1.658
  591   1HE   MET 157          1HE       MET 157 128.778   2.677  -4.858
  592   2HE   MET 157          2HE       MET 157 127.362   2.013  -4.044
  593   3HE   MET 157          3HE       MET 157 128.705   2.649  -3.096
  594    H    LYS 158           H        LYS 158 128.940   9.667  -2.339
  595    HA   LYS 158           HA       LYS 158 127.478  10.684  -4.623
  596   1HB   LYS 158          2HB       LYS 158 127.112  11.259  -2.111
  597   2HB   LYS 158          1HB       LYS 158 128.451  12.375  -2.342
  598   1HG   LYS 158          2HG       LYS 158 126.695  13.759  -2.772
  599   2HG   LYS 158          1HG       LYS 158 127.015  13.159  -4.400
  600   1HD   LYS 158          2HD       LYS 158 124.674  13.010  -4.093
  601   2HD   LYS 158          1HD       LYS 158 125.292  11.365  -3.937
  602   1HE   LYS 158          2HE       LYS 158 125.234  11.575  -1.501
  603   2HE   LYS 158          1HE       LYS 158 124.621  13.222  -1.657
  604   1HZ   LYS 158          1HZ       LYS 158 123.115  11.156  -3.043
  605   2HZ   LYS 158          2HZ       LYS 158 122.565  12.499  -2.174
  606   3HZ   LYS 158          3HZ       LYS 158 123.056  11.104  -1.353
  607    H    GLY 159           H        GLY 159 129.373  10.229  -6.057
  608   1HA   GLY 159          2HA       GLY 159 130.652  11.614  -7.542
  609   2HA   GLY 159          1HA       GLY 159 131.064  12.636  -6.173
  610    H    VAL 160           H        VAL 160 131.498   9.325  -7.394
  611    HA   VAL 160           HA       VAL 160 133.714   8.724  -5.736
  612    HB   VAL 160           HB       VAL 160 133.205   7.456  -8.419
  613   1HG1  VAL 160          1HG1      VAL 160 135.206   7.023  -6.680
  614   2HG1  VAL 160          2HG1      VAL 160 134.538   5.770  -7.725
  615   3HG1  VAL 160          3HG1      VAL 160 134.007   5.896  -6.047
  616   1HG2  VAL 160          1HG2      VAL 160 131.070   7.373  -7.442
  617   2HG2  VAL 160          2HG2      VAL 160 131.725   7.068  -5.833
  618   3HG2  VAL 160          3HG2      VAL 160 131.799   5.812  -7.070
  619    H    GLU 161           H        GLU 161 133.420  10.059  -8.986
  620    HA   GLU 161           HA       GLU 161 136.241  10.021  -9.498
  621   1HB   GLU 161          2HB       GLU 161 135.608  11.477 -11.453
  622   2HB   GLU 161          1HB       GLU 161 134.800   9.916 -11.395
  623   1HG   GLU 161          2HG       GLU 161 133.337  12.060 -10.054
  624   2HG   GLU 161          1HG       GLU 161 133.576  12.317 -11.782
  Start of MODEL    3
    1   1H    MET  81          1HT       MET  81  91.824   6.181  -0.977
    2   2H    MET  81          2HT       MET  81  92.034   7.487  -2.071
    3   3H    MET  81          3HT       MET  81  90.554   7.306  -1.222
    4    HA   MET  81           HA       MET  81  92.096   9.046  -0.398
    5   1HB   MET  81          2HB       MET  81  90.425   7.140   0.895
    6   2HB   MET  81          1HB       MET  81  91.795   7.440   1.955
    7   1HG   MET  81          2HG       MET  81  91.332   9.889   1.704
    8   2HG   MET  81          1HG       MET  81  89.847   9.450   0.862
    9   1HE   MET  81          1HE       MET  81  89.491  11.328   3.105
   10   2HE   MET  81          2HE       MET  81  88.342  10.599   4.227
   11   3HE   MET  81          3HE       MET  81  88.056  10.511   2.488
   12    H    VAL  82           H        VAL  82  94.113   9.544   0.206
   13    HA   VAL  82           HA       VAL  82  95.862   7.674   1.489
   14    HB   VAL  82           HB       VAL  82  96.087   6.892  -0.828
   15   1HG1  VAL  82          1HG1      VAL  82  95.723   9.439  -1.598
   16   2HG1  VAL  82          2HG1      VAL  82  96.474   8.213  -2.620
   17   3HG1  VAL  82          3HG1      VAL  82  97.479   9.340  -1.711
   18   1HG2  VAL  82          1HG2      VAL  82  98.005   6.776   0.706
   19   2HG2  VAL  82          2HG2      VAL  82  98.545   8.356   0.135
   20   3HG2  VAL  82          3HG2      VAL  82  98.511   6.982  -0.971
   21    H    ARG  83           H        ARG  83  97.052   8.826   2.852
   22    HA   ARG  83           HA       ARG  83  97.738  11.599   2.125
   23   1HB   ARG  83          2HB       ARG  83  96.060  10.931   4.139
   24   2HB   ARG  83          1HB       ARG  83  97.596  10.904   4.995
   25   1HG   ARG  83          2HG       ARG  83  97.875  13.238   3.744
   26   2HG   ARG  83          1HG       ARG  83  96.114  13.177   3.822
   27   1HD   ARG  83          2HD       ARG  83  96.193  12.894   6.222
   28   2HD   ARG  83          1HD       ARG  83  97.954  12.817   6.184
   29    HE   ARG  83           HE       ARG  83  98.021  15.104   6.047
   30   1HH1  ARG  83          1HH1      ARG  83  94.774  14.020   5.367
   31   2HH1  ARG  83          2HH1      ARG  83  94.105  15.617   5.378
   32   1HH2  ARG  83          1HH2      ARG  83  97.143  17.205   6.059
   33   2HH2  ARG  83          2HH2      ARG  83  95.450  17.424   5.771
   34    H    CYS  84           H        CYS  84  99.842  11.785   1.765
   35    HA   CYS  84           HA       CYS  84 101.759   9.866   2.551
   36   1HB   CYS  84          2HB       CYS  84 102.007  12.671   1.471
   37   2HB   CYS  84          1HB       CYS  84 103.411  11.673   1.830
   38    HG   CYS  84           HG       CYS  84 103.114  10.948  -0.500
   39    H    MET  85           H        MET  85 102.540   9.537   4.516
   40    HA   MET  85           HA       MET  85 103.340  11.793   6.161
   41   1HB   MET  85          2HB       MET  85 100.894  11.076   6.677
   42   2HB   MET  85          1HB       MET  85 101.639   9.682   7.450
   43   1HG   MET  85          2HG       MET  85 103.010  11.939   8.403
   44   2HG   MET  85          1HG       MET  85 101.295  12.344   8.440
   45   1HE   MET  85          1HE       MET  85 101.357  11.972  11.796
   46   2HE   MET  85          2HE       MET  85  99.901  11.161  11.217
   47   3HE   MET  85          3HE       MET  85 100.553  12.542  10.334
   48    H    LYS  86           H        LYS  86 105.198  11.384   7.178
   49    HA   LYS  86           HA       LYS  86 107.030  10.297   7.972
   50   1HB   LYS  86          2HB       LYS  86 104.820   8.405   8.533
   51   2HB   LYS  86          1HB       LYS  86 106.445   7.736   8.580
   52   1HG   LYS  86          2HG       LYS  86 106.996   9.709  10.126
   53   2HG   LYS  86          1HG       LYS  86 105.247   9.884  10.286
   54   1HD   LYS  86          2HD       LYS  86 106.578   7.234  10.724
   55   2HD   LYS  86          1HD       LYS  86 106.516   8.439  12.011
   56   1HE   LYS  86          2HE       LYS  86 104.094   8.487  11.886
   57   2HE   LYS  86          1HE       LYS  86 104.119   7.356  10.535
   58   1HZ   LYS  86          1HZ       LYS  86 105.488   5.980  12.348
   59   2HZ   LYS  86          2HZ       LYS  86 103.809   5.867  12.173
   60   3HZ   LYS  86          3HZ       LYS  86 104.469   6.860  13.374
   61    H    ASP  87           H        ASP  87 105.494   7.460   6.500
   62    HA   ASP  87           HA       ASP  87 107.832   6.644   5.168
   63   1HB   ASP  87          2HB       ASP  87 105.928   5.147   5.763
   64   2HB   ASP  87          1HB       ASP  87 104.981   5.901   4.484
   65    H    ASP  88           H        ASP  88 108.791   7.815   3.635
   66    HA   ASP  88           HA       ASP  88 107.234   9.434   1.801
   67   1HB   ASP  88          2HB       ASP  88 110.076   9.229   2.590
   68   2HB   ASP  88          1HB       ASP  88 109.785   9.686   0.914
   69    H    SER  89           H        SER  89 108.440   9.377  -0.551
   70    HA   SER  89           HA       SER  89 107.442   7.084  -1.807
   71   1HB   SER  89          2HB       SER  89 109.075   9.419  -2.633
   72   2HB   SER  89          1HB       SER  89 109.151   8.001  -3.678
   73    HG   SER  89           HG       SER  89 106.704   9.117  -2.801
   74    H    LYS  90           H        LYS  90 108.481   5.329  -2.815
   75    HA   LYS  90           HA       LYS  90 110.961   4.534  -1.479
   76   1HB   LYS  90          2HB       LYS  90 108.681   3.142  -1.802
   77   2HB   LYS  90          1HB       LYS  90 109.529   2.639  -3.257
   78   1HG   LYS  90          2HG       LYS  90 111.393   1.840  -1.930
   79   2HG   LYS  90          1HG       LYS  90 110.608   2.410  -0.455
   80   1HD   LYS  90          2HD       LYS  90 108.661   0.891  -1.120
   81   2HD   LYS  90          1HD       LYS  90 109.785   0.161  -2.268
   82   1HE   LYS  90          2HE       LYS  90 110.760   0.465   0.502
   83   2HE   LYS  90          1HE       LYS  90 109.464  -0.703   0.259
   84   1HZ   LYS  90          1HZ       LYS  90 111.918  -0.697  -1.396
   85   2HZ   LYS  90          2HZ       LYS  90 110.772  -1.928  -1.236
   86   3HZ   LYS  90          3HZ       LYS  90 111.807  -1.566   0.050
   87    H    GLY  91           H        GLY  91 111.213   6.482  -3.482
   88   1HA   GLY  91          2HA       GLY  91 112.025   5.193  -5.939
   89   2HA   GLY  91          1HA       GLY  91 112.168   6.903  -5.559
   90    H    LYS  92           H        LYS  92 114.276   7.068  -6.310
   91    HA   LYS  92           HA       LYS  92 116.305   5.441  -4.958
   92   1HB   LYS  92          2HB       LYS  92 116.164   6.886  -7.541
   93   2HB   LYS  92          1HB       LYS  92 117.730   6.878  -6.740
   94   1HG   LYS  92          2HG       LYS  92 117.704   4.445  -6.683
   95   2HG   LYS  92          1HG       LYS  92 116.117   4.437  -7.454
   96   1HD   LYS  92          2HD       LYS  92 116.956   5.019  -9.497
   97   2HD   LYS  92          1HD       LYS  92 118.306   5.920  -8.807
   98   1HE   LYS  92          2HE       LYS  92 119.656   4.132  -8.821
   99   2HE   LYS  92          1HE       LYS  92 118.389   3.058  -8.229
  100   1HZ   LYS  92          1HZ       LYS  92 117.522   3.444 -10.687
  101   2HZ   LYS  92          2HZ       LYS  92 118.621   2.220 -10.301
  102   3HZ   LYS  92          3HZ       LYS  92 119.175   3.671 -10.969
  103    H    THR  93           H        THR  93 116.064   6.585  -2.944
  104    HA   THR  93           HA       THR  93 117.035   9.352  -2.947
  105    HB   THR  93           HB       THR  93 116.417   8.941  -0.372
  106    HG1  THR  93           HG1      THR  93 115.306   7.205  -0.093
  107   1HG2  THR  93          1HG2      THR  93 114.883  10.462  -0.810
  108   2HG2  THR  93          2HG2      THR  93 113.905   9.278  -1.678
  109   3HG2  THR  93          3HG2      THR  93 115.146  10.196  -2.532
  110    H    GLU  94           H        GLU  94 118.238   9.705  -0.627
  111    HA   GLU  94           HA       GLU  94 120.806   8.660  -0.974
  112   1HB   GLU  94          2HB       GLU  94 119.557  10.549   0.709
  113   2HB   GLU  94          1HB       GLU  94 120.384   9.418   1.770
  114   1HG   GLU  94          2HG       GLU  94 121.955  11.080   1.365
  115   2HG   GLU  94          1HG       GLU  94 122.420   9.775   0.275
  116    H    GLU  95           H        GLU  95 118.080   7.482   0.855
  117    HA   GLU  95           HA       GLU  95 119.367   5.721   2.595
  118   1HB   GLU  95          2HB       GLU  95 116.651   5.548   1.285
  119   2HB   GLU  95          1HB       GLU  95 117.191   4.455   2.552
  120   1HG   GLU  95          2HG       GLU  95 117.663   6.717   3.822
  121   2HG   GLU  95          1HG       GLU  95 116.437   7.320   2.707
  122    H    GLU  96           H        GLU  96 118.775   5.498  -0.816
  123    HA   GLU  96           HA       GLU  96 118.949   2.727  -1.176
  124   1HB   GLU  96          2HB       GLU  96 119.953   4.850  -3.076
  125   2HB   GLU  96          1HB       GLU  96 119.471   3.210  -3.487
  126   1HG   GLU  96          2HG       GLU  96 117.434   4.854  -2.139
  127   2HG   GLU  96          1HG       GLU  96 117.882   5.349  -3.771
  128    H    LEU  97           H        LEU  97 121.467   5.214  -1.058
  129    HA   LEU  97           HA       LEU  97 123.655   3.626  -1.744
  130   1HB   LEU  97          2HB       LEU  97 123.345   6.102  -0.085
  131   2HB   LEU  97          1HB       LEU  97 124.908   5.319  -0.217
  132    HG   LEU  97           HG       LEU  97 123.501   5.906  -2.760
  133   1HD1  LEU  97          1HD1      LEU  97 124.257   7.967  -0.791
  134   2HD1  LEU  97          2HD1      LEU  97 123.078   8.021  -2.101
  135   3HD1  LEU  97          3HD1      LEU  97 124.793   8.237  -2.448
  136   1HD2  LEU  97          1HD2      LEU  97 126.361   6.273  -1.878
  137   2HD2  LEU  97          2HD2      LEU  97 125.742   6.330  -3.529
  138   3HD2  LEU  97          3HD2      LEU  97 125.721   4.812  -2.630
  139    H    SER  98           H        SER  98 121.901   3.910   1.257
  140    HA   SER  98           HA       SER  98 123.850   2.664   2.913
  141   1HB   SER  98          2HB       SER  98 122.247   2.744   4.619
  142   2HB   SER  98          1HB       SER  98 121.811   4.114   3.597
  143    HG   SER  98           HG       SER  98 119.930   3.075   3.873
  144    H    ASP  99           H        ASP  99 121.249   1.499   0.887
  145    HA   ASP  99           HA       ASP  99 121.064  -1.118   1.910
  146   1HB   ASP  99          2HB       ASP  99 120.356   0.155  -0.714
  147   2HB   ASP  99          1HB       ASP  99 120.241  -1.591  -0.524
  148    H    LEU 100           H        LEU 100 122.990   0.230  -0.753
  149    HA   LEU 100           HA       LEU 100 124.182  -2.182  -1.563
  150   1HB   LEU 100          2HB       LEU 100 124.689   0.699  -1.969
  151   2HB   LEU 100          1HB       LEU 100 126.078  -0.349  -2.191
  152    HG   LEU 100           HG       LEU 100 123.477  -0.882  -3.598
  153   1HD1  LEU 100          1HD1      LEU 100 125.658   0.480  -5.053
  154   2HD1  LEU 100          2HD1      LEU 100 124.697   1.468  -3.951
  155   3HD1  LEU 100          3HD1      LEU 100 123.909   0.587  -5.261
  156   1HD2  LEU 100          1HD2      LEU 100 126.108  -1.511  -4.769
  157   2HD2  LEU 100          2HD2      LEU 100 124.611  -2.444  -4.767
  158   3HD2  LEU 100          3HD2      LEU 100 125.650  -2.439  -3.342
  159    H    PHE 101           H        PHE 101 124.902   0.016   1.043
  160    HA   PHE 101           HA       PHE 101 127.539  -0.708   1.604
  161   1HB   PHE 101          2HB       PHE 101 126.405   1.200   2.661
  162   2HB   PHE 101          1HB       PHE 101 125.365   0.093   3.550
  163    HD1  PHE 101           HD1      PHE 101 128.692   1.554   3.304
  164    HD2  PHE 101           HD2      PHE 101 126.240  -1.227   5.396
  165    HE1  PHE 101           HE1      PHE 101 130.347   1.467   5.122
  166    HE2  PHE 101           HE2      PHE 101 127.891  -1.319   7.217
  167    HZ   PHE 101           HZ       PHE 101 129.949   0.031   7.082
  168    H    ARG 102           H        ARG 102 124.497  -2.248   2.473
  169    HA   ARG 102           HA       ARG 102 125.495  -4.081   4.354
  170   1HB   ARG 102          2HB       ARG 102 123.104  -4.155   2.522
  171   2HB   ARG 102          1HB       ARG 102 123.447  -5.444   3.667
  172   1HG   ARG 102          2HG       ARG 102 123.311  -3.850   5.509
  173   2HG   ARG 102          1HG       ARG 102 122.980  -2.551   4.362
  174   1HD   ARG 102          2HD       ARG 102 121.272  -4.999   4.794
  175   2HD   ARG 102          1HD       ARG 102 120.930  -3.388   5.421
  176    HE   ARG 102           HE       ARG 102 121.149  -2.976   2.759
  177   1HH1  ARG 102          1HH1      ARG 102 119.286  -5.219   4.677
  178   2HH1  ARG 102          2HH1      ARG 102 117.986  -5.308   3.536
  179   1HH2  ARG 102          1HH2      ARG 102 119.440  -3.092   1.258
  180   2HH2  ARG 102          2HH2      ARG 102 118.072  -4.101   1.595
  181    H    MET 103           H        MET 103 125.250  -4.216   0.840
  182    HA   MET 103           HA       MET 103 125.935  -6.926   0.516
  183   1HB   MET 103          2HB       MET 103 126.242  -4.539  -1.303
  184   2HB   MET 103          1HB       MET 103 126.651  -6.176  -1.801
  185   1HG   MET 103          2HG       MET 103 124.157  -6.567  -0.865
  186   2HG   MET 103          1HG       MET 103 124.027  -4.904  -1.435
  187   1HE   MET 103          1HE       MET 103 124.805  -8.743  -3.589
  188   2HE   MET 103          2HE       MET 103 123.121  -8.433  -3.169
  189   3HE   MET 103          3HE       MET 103 124.361  -8.410  -1.915
  190    H    PHE 104           H        PHE 104 127.891  -4.013   0.818
  191    HA   PHE 104           HA       PHE 104 130.371  -5.237   0.177
  192   1HB   PHE 104          2HB       PHE 104 129.436  -2.630   0.948
  193   2HB   PHE 104          1HB       PHE 104 130.850  -3.051   1.908
  194    HD1  PHE 104           HD1      PHE 104 132.850  -2.328   1.074
  195    HD2  PHE 104           HD2      PHE 104 129.752  -3.380  -1.648
  196    HE1  PHE 104           HE1      PHE 104 134.309  -1.728  -0.814
  197    HE2  PHE 104           HE2      PHE 104 131.207  -2.784  -3.540
  198    HZ   PHE 104           HZ       PHE 104 133.489  -1.958  -3.124
  199    H    ASP 105           H        ASP 105 128.622  -4.699   3.190
  200    HA   ASP 105           HA       ASP 105 130.752  -5.710   4.835
  201   1HB   ASP 105          2HB       ASP 105 128.936  -4.018   5.512
  202   2HB   ASP 105          1HB       ASP 105 127.879  -5.416   5.689
  203    H    LYS 106           H        LYS 106 130.836  -7.679   5.915
  204    HA   LYS 106           HA       LYS 106 129.112  -9.777   4.777
  205   1HB   LYS 106          2HB       LYS 106 131.899  -9.588   4.855
  206   2HB   LYS 106          1HB       LYS 106 131.498 -10.761   6.102
  207   1HG   LYS 106          2HG       LYS 106 131.827 -12.016   4.156
  208   2HG   LYS 106          1HG       LYS 106 130.076 -11.918   4.346
  209   1HD   LYS 106          2HD       LYS 106 129.985 -10.115   2.710
  210   2HD   LYS 106          1HD       LYS 106 131.742 -10.156   2.548
  211   1HE   LYS 106          2HE       LYS 106 131.673 -11.898   1.148
  212   2HE   LYS 106          1HE       LYS 106 130.506 -12.762   2.148
  213   1HZ   LYS 106          1HZ       LYS 106 129.596 -10.473   0.552
  214   2HZ   LYS 106          2HZ       LYS 106 128.742 -11.847   1.041
  215   3HZ   LYS 106          3HZ       LYS 106 129.862 -11.954  -0.221
  216    H    ASN 107           H        ASN 107 130.501  -8.476   7.727
  217    HA   ASN 107           HA       ASN 107 129.291 -10.500   9.396
  218   1HB   ASN 107          2HB       ASN 107 130.859  -7.992   9.982
  219   2HB   ASN 107          1HB       ASN 107 130.135  -8.966  11.257
  220   1HD2  ASN 107          1HD2      ASN 107 131.426 -10.398  12.133
  221   2HD2  ASN 107          2HD2      ASN 107 132.784 -11.152  11.379
  222    H    ALA 108           H        ALA 108 128.453  -7.384   8.158
  223    HA   ALA 108           HA       ALA 108 126.554  -6.139   8.305
  224   1HB   ALA 108          1HB       ALA 108 125.057  -8.067   9.955
  225   2HB   ALA 108          2HB       ALA 108 125.651  -8.678   8.411
  226   3HB   ALA 108          3HB       ALA 108 124.604  -7.260   8.453
  227    H    ASP 109           H        ASP 109 128.575  -5.758  10.211
  228    HA   ASP 109           HA       ASP 109 127.142  -5.267  12.721
  229   1HB   ASP 109          2HB       ASP 109 129.411  -4.807  13.649
  230   2HB   ASP 109          1HB       ASP 109 129.241  -6.433  12.993
  231    H    GLY 110           H        GLY 110 128.498  -3.654   9.978
  232   1HA   GLY 110          2HA       GLY 110 127.546  -1.405   9.585
  233   2HA   GLY 110          1HA       GLY 110 127.915  -1.058  11.266
  234    H    TYR 111           H        TYR 111 130.169  -2.892   9.366
  235    HA   TYR 111           HA       TYR 111 131.727  -0.605   8.568
  236   1HB   TYR 111          2HB       TYR 111 132.773  -2.458  10.719
  237   2HB   TYR 111          1HB       TYR 111 133.727  -1.236   9.885
  238    HD1  TYR 111           HD1      TYR 111 133.183   1.181  10.216
  239    HD2  TYR 111           HD2      TYR 111 131.362  -1.883  12.539
  240    HE1  TYR 111           HE1      TYR 111 132.508   2.857  11.884
  241    HE2  TYR 111           HE2      TYR 111 130.681  -0.215  14.214
  242    HH   TYR 111           HH       TYR 111 130.226   2.304  14.226
  243    H    ILE 112           H        ILE 112 133.575  -1.183   7.273
  244    HA   ILE 112           HA       ILE 112 133.567  -3.980   6.350
  245    HB   ILE 112           HB       ILE 112 133.840  -1.590   4.524
  246   1HG1  ILE 112          2HG1      ILE 112 131.499  -3.411   4.343
  247   2HG1  ILE 112          1HG1      ILE 112 131.512  -2.269   5.683
  248   1HG2  ILE 112          1HG2      ILE 112 133.827  -4.556   4.103
  249   2HG2  ILE 112          2HG2      ILE 112 134.981  -3.355   3.525
  250   3HG2  ILE 112          3HG2      ILE 112 133.373  -3.448   2.808
  251   1HD1  ILE 112          1HD1      ILE 112 131.804  -1.527   2.783
  252   2HD1  ILE 112          2HD1      ILE 112 131.691  -0.417   4.149
  253   3HD1  ILE 112          3HD1      ILE 112 130.311  -1.427   3.717
  254    H    ASP 113           H        ASP 113 135.528  -4.886   6.050
  255    HA   ASP 113           HA       ASP 113 137.888  -3.136   6.053
  256   1HB   ASP 113          2HB       ASP 113 139.002  -4.939   7.497
  257   2HB   ASP 113          1HB       ASP 113 137.853  -3.869   8.293
  258    H    LEU 114           H        LEU 114 139.907  -4.791   5.755
  259    HA   LEU 114           HA       LEU 114 139.773  -5.627   3.091
  260   1HB   LEU 114          2HB       LEU 114 141.779  -5.167   4.825
  261   2HB   LEU 114          1HB       LEU 114 141.783  -6.921   4.836
  262    HG   LEU 114           HG       LEU 114 141.893  -5.375   2.260
  263   1HD1  LEU 114          1HD1      LEU 114 143.775  -4.987   4.139
  264   2HD1  LEU 114          2HD1      LEU 114 144.110  -5.000   2.407
  265   3HD1  LEU 114          3HD1      LEU 114 144.402  -6.446   3.373
  266   1HD2  LEU 114          1HD2      LEU 114 143.238  -7.971   2.647
  267   2HD2  LEU 114          2HD2      LEU 114 142.315  -7.361   1.273
  268   3HD2  LEU 114          3HD2      LEU 114 141.475  -7.995   2.689
  269    H    GLU 115           H        GLU 115 139.686  -7.547   6.087
  270    HA   GLU 115           HA       GLU 115 139.593 -10.075   4.923
  271   1HB   GLU 115          2HB       GLU 115 138.500 -10.796   7.050
  272   2HB   GLU 115          1HB       GLU 115 139.972  -9.863   7.279
  273   1HG   GLU 115          2HG       GLU 115 138.610  -7.866   7.722
  274   2HG   GLU 115          1HG       GLU 115 137.153  -8.846   7.556
  275    H    GLU 116           H        GLU 116 136.915  -7.915   5.818
  276    HA   GLU 116           HA       GLU 116 134.874  -9.694   4.952
  277   1HB   GLU 116          2HB       GLU 116 135.012  -6.852   5.804
  278   2HB   GLU 116          1HB       GLU 116 133.617  -7.331   4.849
  279   1HG   GLU 116          2HG       GLU 116 132.708  -7.920   6.789
  280   2HG   GLU 116          1HG       GLU 116 133.762  -9.330   6.707
  281    H    LEU 117           H        LEU 117 136.460  -6.901   3.448
  282    HA   LEU 117           HA       LEU 117 134.930  -6.847   1.096
  283   1HB   LEU 117          2HB       LEU 117 136.478  -5.053   1.895
  284   2HB   LEU 117          1HB       LEU 117 137.827  -6.055   1.395
  285    HG   LEU 117           HG       LEU 117 136.976  -5.965  -0.940
  286   1HD1  LEU 117          1HD1      LEU 117 135.065  -3.905   0.150
  287   2HD1  LEU 117          2HD1      LEU 117 134.617  -5.528  -0.374
  288   3HD1  LEU 117          3HD1      LEU 117 135.264  -4.373  -1.539
  289   1HD2  LEU 117          1HD2      LEU 117 138.515  -4.188   0.365
  290   2HD2  LEU 117          2HD2      LEU 117 137.224  -3.122  -0.193
  291   3HD2  LEU 117          3HD2      LEU 117 138.145  -4.078  -1.355
  292    H    LYS 118           H        LYS 118 137.710  -8.760   2.032
  293    HA   LYS 118           HA       LYS 118 138.444  -9.719  -0.502
  294   1HB   LYS 118          2HB       LYS 118 139.459  -9.998   1.989
  295   2HB   LYS 118          1HB       LYS 118 138.718 -11.579   1.782
  296   1HG   LYS 118          2HG       LYS 118 140.455 -10.511  -0.386
  297   2HG   LYS 118          1HG       LYS 118 141.202 -11.148   1.080
  298   1HD   LYS 118          2HD       LYS 118 139.207 -12.990   0.302
  299   2HD   LYS 118          1HD       LYS 118 140.110 -12.566  -1.154
  300   1HE   LYS 118          2HE       LYS 118 141.425 -13.386   1.427
  301   2HE   LYS 118          1HE       LYS 118 140.997 -14.531   0.156
  302   1HZ   LYS 118          1HZ       LYS 118 142.531 -12.211  -0.685
  303   2HZ   LYS 118          2HZ       LYS 118 142.666 -13.829  -1.159
  304   3HZ   LYS 118          3HZ       LYS 118 143.353 -13.315   0.300
  305    H    ILE 119           H        ILE 119 136.009 -10.789   1.795
  306    HA   ILE 119           HA       ILE 119 135.379 -13.206   0.401
  307    HB   ILE 119           HB       ILE 119 133.635 -11.735   2.376
  308   1HG1  ILE 119          2HG1      ILE 119 135.502 -13.980   3.087
  309   2HG1  ILE 119          1HG1      ILE 119 136.067 -12.313   3.085
  310   1HG2  ILE 119          1HG2      ILE 119 132.831 -13.727   0.874
  311   2HG2  ILE 119          2HG2      ILE 119 132.400 -13.658   2.583
  312   3HG2  ILE 119          3HG2      ILE 119 133.722 -14.695   2.049
  313   1HD1  ILE 119          1HD1      ILE 119 133.787 -12.112   4.548
  314   2HD1  ILE 119          2HD1      ILE 119 135.407 -12.317   5.214
  315   3HD1  ILE 119          3HD1      ILE 119 134.361 -13.721   4.989
  316    H    MET 120           H        MET 120 134.248  -9.901   0.304
  317    HA   MET 120           HA       MET 120 131.859 -10.385  -1.150
  318   1HB   MET 120          2HB       MET 120 132.330  -8.309   0.144
  319   2HB   MET 120          1HB       MET 120 133.516  -7.858  -1.073
  320   1HG   MET 120          2HG       MET 120 131.431  -8.221  -2.675
  321   2HG   MET 120          1HG       MET 120 130.559  -7.833  -1.193
  322   1HE   MET 120          1HE       MET 120 131.769  -6.328  -4.349
  323   2HE   MET 120          2HE       MET 120 133.347  -6.702  -3.658
  324   3HE   MET 120          3HE       MET 120 132.868  -5.023  -3.905
  325    H    LEU 121           H        LEU 121 135.145  -9.473  -2.119
  326    HA   LEU 121           HA       LEU 121 134.504  -9.379  -4.909
  327   1HB   LEU 121          2HB       LEU 121 137.023  -9.230  -3.302
  328   2HB   LEU 121          1HB       LEU 121 137.116  -9.473  -5.036
  329    HG   LEU 121           HG       LEU 121 135.539  -7.188  -3.901
  330   1HD1  LEU 121          1HD1      LEU 121 138.509  -7.345  -4.332
  331   2HD1  LEU 121          2HD1      LEU 121 137.637  -6.840  -2.884
  332   3HD1  LEU 121          3HD1      LEU 121 137.623  -5.820  -4.323
  333   1HD2  LEU 121          1HD2      LEU 121 135.460  -6.425  -6.023
  334   2HD2  LEU 121          2HD2      LEU 121 135.722  -8.123  -6.416
  335   3HD2  LEU 121          3HD2      LEU 121 137.081  -7.001  -6.406
  336    H    GLN 122           H        GLN 122 135.639 -11.807  -2.686
  337    HA   GLN 122           HA       GLN 122 136.665 -13.643  -4.573
  338   1HB   GLN 122          2HB       GLN 122 135.810 -13.754  -1.728
  339   2HB   GLN 122          1HB       GLN 122 135.915 -15.282  -2.593
  340   1HG   GLN 122          2HG       GLN 122 138.235 -13.549  -2.969
  341   2HG   GLN 122          1HG       GLN 122 137.970 -14.046  -1.297
  342   1HE2  GLN 122          1HE2      GLN 122 139.691 -15.413  -1.157
  343   2HE2  GLN 122          2HE2      GLN 122 139.816 -16.889  -2.048
  344    H    ALA 123           H        ALA 123 133.438 -12.885  -3.519
  345    HA   ALA 123           HA       ALA 123 132.157 -15.263  -4.350
  346   1HB   ALA 123          1HB       ALA 123 130.746 -14.108  -3.010
  347   2HB   ALA 123          2HB       ALA 123 130.173 -13.482  -4.555
  348   3HB   ALA 123          3HB       ALA 123 131.305 -12.538  -3.588
  349    H    THR 124           H        THR 124 132.873 -12.224  -6.010
  350    HA   THR 124           HA       THR 124 131.389 -12.663  -8.336
  351    HB   THR 124           HB       THR 124 132.891 -11.037  -9.400
  352    HG1  THR 124           HG1      THR 124 134.837 -11.822  -8.422
  353   1HG2  THR 124          1HG2      THR 124 131.936  -9.363  -8.319
  354   2HG2  THR 124          2HG2      THR 124 132.873  -9.692  -6.862
  355   3HG2  THR 124          3HG2      THR 124 131.351 -10.536  -7.141
  356    H    GLY 125           H        GLY 125 132.569 -12.877 -10.562
  357   1HA   GLY 125          2HA       GLY 125 134.121 -15.375 -10.413
  358   2HA   GLY 125          1HA       GLY 125 133.134 -14.875 -11.776
  359    H    GLU 126           H        GLU 126 135.403 -12.803 -10.064
  360    HA   GLU 126           HA       GLU 126 136.956 -12.591 -12.551
  361   1HB   GLU 126          2HB       GLU 126 136.444 -10.670 -10.298
  362   2HB   GLU 126          1HB       GLU 126 137.812 -10.448 -11.380
  363   1HG   GLU 126          2HG       GLU 126 136.361 -10.244 -13.272
  364   2HG   GLU 126          1HG       GLU 126 134.955 -10.665 -12.294
  365    H    THR 127           H        THR 127 139.321 -11.944 -12.125
  366    HA   THR 127           HA       THR 127 140.394 -13.809 -10.122
  367    HB   THR 127           HB       THR 127 142.388 -13.945 -11.487
  368    HG1  THR 127           HG1      THR 127 141.135 -12.001 -13.126
  369   1HG2  THR 127          1HG2      THR 127 140.864 -14.218 -13.827
  370   2HG2  THR 127          2HG2      THR 127 139.828 -14.695 -12.482
  371   3HG2  THR 127          3HG2      THR 127 141.389 -15.479 -12.714
  372    H    ILE 128           H        ILE 128 139.601 -11.473  -9.041
  373    HA   ILE 128           HA       ILE 128 141.559  -9.424  -9.030
  374    HB   ILE 128           HB       ILE 128 139.608 -10.021  -6.810
  375   1HG1  ILE 128          2HG1      ILE 128 138.587  -7.988  -8.470
  376   2HG1  ILE 128          1HG1      ILE 128 139.095  -9.279  -9.554
  377   1HG2  ILE 128          1HG2      ILE 128 141.039  -8.369  -6.043
  378   2HG2  ILE 128          2HG2      ILE 128 139.708  -7.437  -6.731
  379   3HG2  ILE 128          3HG2      ILE 128 141.208  -7.633  -7.637
  380   1HD1  ILE 128          1HD1      ILE 128 136.715  -9.378  -8.786
  381   2HD1  ILE 128          2HD1      ILE 128 137.326  -9.729  -7.169
  382   3HD1  ILE 128          3HD1      ILE 128 137.661 -10.839  -8.498
  383    H    THR 129           H        THR 129 143.092  -8.891  -7.436
  384    HA   THR 129           HA       THR 129 144.017 -11.195  -5.851
  385    HB   THR 129           HB       THR 129 146.241  -9.854  -5.912
  386    HG1  THR 129           HG1      THR 129 146.427  -8.537  -7.745
  387   1HG2  THR 129          1HG2      THR 129 147.011 -11.097  -7.648
  388   2HG2  THR 129          2HG2      THR 129 145.578 -10.813  -8.637
  389   3HG2  THR 129          3HG2      THR 129 145.515 -11.964  -7.302
  390    H    GLU 130           H        GLU 130 145.359 -10.501  -3.898
  391    HA   GLU 130           HA       GLU 130 143.718  -9.082  -2.122
  392   1HB   GLU 130          2HB       GLU 130 145.864 -10.748  -1.858
  393   2HB   GLU 130          1HB       GLU 130 146.573  -9.203  -1.413
  394   1HG   GLU 130          2HG       GLU 130 144.201  -9.217  -0.026
  395   2HG   GLU 130          1HG       GLU 130 144.721 -10.900   0.045
  396    H    ASP 131           H        ASP 131 146.360  -8.062  -4.163
  397    HA   ASP 131           HA       ASP 131 146.892  -5.581  -2.924
  398   1HB   ASP 131          2HB       ASP 131 148.185  -6.925  -4.796
  399   2HB   ASP 131          1HB       ASP 131 147.220  -5.922  -5.876
  400    H    ASP 132           H        ASP 132 144.597  -6.582  -5.397
  401    HA   ASP 132           HA       ASP 132 143.747  -3.979  -6.129
  402   1HB   ASP 132          2HB       ASP 132 142.715  -6.749  -6.530
  403   2HB   ASP 132          1HB       ASP 132 141.615  -5.405  -6.817
  404    H    ILE 133           H        ILE 133 142.542  -6.347  -3.790
  405    HA   ILE 133           HA       ILE 133 140.232  -4.952  -3.013
  406    HB   ILE 133           HB       ILE 133 141.888  -6.777  -1.269
  407   1HG1  ILE 133          2HG1      ILE 133 139.516  -7.838  -2.672
  408   2HG1  ILE 133          1HG1      ILE 133 140.890  -7.466  -3.706
  409   1HG2  ILE 133          1HG2      ILE 133 139.761  -7.227  -0.146
  410   2HG2  ILE 133          2HG2      ILE 133 138.957  -6.069  -1.204
  411   3HG2  ILE 133          3HG2      ILE 133 140.186  -5.517  -0.064
  412   1HD1  ILE 133          1HD1      ILE 133 141.715  -8.908  -1.351
  413   2HD1  ILE 133          2HD1      ILE 133 141.963  -9.289  -3.054
  414   3HD1  ILE 133          3HD1      ILE 133 140.474  -9.781  -2.248
  415    H    GLU 134           H        GLU 134 143.583  -4.618  -2.092
  416    HA   GLU 134           HA       GLU 134 143.178  -3.092   0.259
  417   1HB   GLU 134          2HB       GLU 134 145.450  -3.791  -1.486
  418   2HB   GLU 134          1HB       GLU 134 145.622  -2.272  -0.617
  419   1HG   GLU 134          2HG       GLU 134 145.090  -3.520   1.486
  420   2HG   GLU 134          1HG       GLU 134 145.186  -5.008   0.547
  421    H    GLU 135           H        GLU 135 143.443  -2.268  -3.143
  422    HA   GLU 135           HA       GLU 135 143.734   0.524  -2.822
  423   1HB   GLU 135          2HB       GLU 135 142.804  -1.221  -5.083
  424   2HB   GLU 135          1HB       GLU 135 142.746   0.531  -5.214
  425   1HG   GLU 135          2HG       GLU 135 145.260   0.321  -4.444
  426   2HG   GLU 135          1HG       GLU 135 145.084  -1.293  -5.131
  427    H    LEU 136           H        LEU 136 140.945  -1.596  -2.932
  428    HA   LEU 136           HA       LEU 136 138.946   0.332  -3.315
  429   1HB   LEU 136          2HB       LEU 136 139.054  -2.424  -2.218
  430   2HB   LEU 136          1HB       LEU 136 137.631  -1.471  -1.846
  431    HG   LEU 136           HG       LEU 136 137.448  -1.071  -4.371
  432   1HD1  LEU 136          1HD1      LEU 136 139.874  -2.177  -4.524
  433   2HD1  LEU 136          2HD1      LEU 136 138.704  -2.242  -5.843
  434   3HD1  LEU 136          3HD1      LEU 136 138.889  -3.621  -4.758
  435   1HD2  LEU 136          1HD2      LEU 136 135.914  -2.725  -4.452
  436   2HD2  LEU 136          2HD2      LEU 136 136.290  -2.862  -2.735
  437   3HD2  LEU 136          3HD2      LEU 136 137.050  -3.953  -3.894
  438    H    MET 137           H        MET 137 140.636  -0.739  -0.429
  439    HA   MET 137           HA       MET 137 138.935   0.682   1.389
  440   1HB   MET 137          2HB       MET 137 141.706  -0.455   1.803
  441   2HB   MET 137          1HB       MET 137 140.635   0.116   3.075
  442   1HG   MET 137          2HG       MET 137 139.189  -1.770   1.555
  443   2HG   MET 137          1HG       MET 137 140.782  -2.457   1.869
  444   1HE   MET 137          1HE       MET 137 137.263  -2.795   4.098
  445   2HE   MET 137          2HE       MET 137 137.503  -1.701   2.735
  446   3HE   MET 137          3HE       MET 137 137.482  -1.068   4.380
  447    H    LYS 138           H        LYS 138 141.922   1.347  -0.313
  448    HA   LYS 138           HA       LYS 138 142.765   3.600   1.123
  449   1HB   LYS 138          2HB       LYS 138 143.129   2.939  -1.805
  450   2HB   LYS 138          1HB       LYS 138 144.000   4.203  -0.948
  451   1HG   LYS 138          2HG       LYS 138 144.351   1.880   0.573
  452   2HG   LYS 138          1HG       LYS 138 144.552   1.391  -1.112
  453   1HD   LYS 138          2HD       LYS 138 145.962   3.740   0.148
  454   2HD   LYS 138          1HD       LYS 138 146.662   2.126   0.008
  455   1HE   LYS 138          2HE       LYS 138 146.600   2.229  -2.376
  456   2HE   LYS 138          1HE       LYS 138 145.656   3.718  -2.343
  457   1HZ   LYS 138          1HZ       LYS 138 148.512   3.319  -1.936
  458   2HZ   LYS 138          2HZ       LYS 138 147.773   4.494  -0.971
  459   3HZ   LYS 138          3HZ       LYS 138 147.689   4.612  -2.655
  460    H    ASP 139           H        ASP 139 140.820   3.417  -1.860
  461    HA   ASP 139           HA       ASP 139 140.212   6.238  -1.722
  462   1HB   ASP 139          2HB       ASP 139 139.112   5.954  -3.819
  463   2HB   ASP 139          1HB       ASP 139 140.571   4.973  -3.878
  464    H    GLY 140           H        GLY 140 138.761   3.260  -0.723
  465   1HA   GLY 140          2HA       GLY 140 136.087   4.297  -0.503
  466   2HA   GLY 140          1HA       GLY 140 136.669   2.764   0.131
  467    H    ASP 141           H        ASP 141 138.873   4.079   1.590
  468    HA   ASP 141           HA       ASP 141 137.328   4.818   3.939
  469   1HB   ASP 141          2HB       ASP 141 139.304   3.184   3.933
  470   2HB   ASP 141          1HB       ASP 141 140.329   4.607   3.778
  471    H    LYS 142           H        LYS 142 136.806   6.874   4.251
  472    HA   LYS 142           HA       LYS 142 138.612   8.965   3.248
  473   1HB   LYS 142          2HB       LYS 142 135.679   9.089   3.960
  474   2HB   LYS 142          1HB       LYS 142 136.639  10.469   3.447
  475   1HG   LYS 142          2HG       LYS 142 136.693   8.134   1.654
  476   2HG   LYS 142          1HG       LYS 142 135.149   8.976   1.785
  477   1HD   LYS 142          2HD       LYS 142 136.928  11.045   1.543
  478   2HD   LYS 142          1HD       LYS 142 137.645   9.810   0.507
  479   1HE   LYS 142          2HE       LYS 142 135.306   9.552  -0.492
  480   2HE   LYS 142          1HE       LYS 142 134.928  11.074   0.314
  481   1HZ   LYS 142          1HZ       LYS 142 137.347  11.000  -1.313
  482   2HZ   LYS 142          2HZ       LYS 142 136.228  12.249  -1.094
  483   3HZ   LYS 142          3HZ       LYS 142 135.872  10.969  -2.140
  484    H    ASN 143           H        ASN 143 138.089   7.358   6.029
  485    HA   ASN 143           HA       ASN 143 138.432   9.743   7.718
  486   1HB   ASN 143          2HB       ASN 143 137.382   6.986   8.360
  487   2HB   ASN 143          1HB       ASN 143 137.799   8.164   9.601
  488   1HD2  ASN 143          1HD2      ASN 143 135.769   8.449  10.391
  489   2HD2  ASN 143          2HD2      ASN 143 134.488   9.181   9.494
  490    H    ASN 144           H        ASN 144 139.970   6.919   6.527
  491    HA   ASN 144           HA       ASN 144 142.082   6.114   6.764
  492   1HB   ASN 144          2HB       ASN 144 142.318   8.850   7.338
  493   2HB   ASN 144          1HB       ASN 144 143.187   8.031   8.632
  494   1HD2  ASN 144          1HD2      ASN 144 144.094   5.806   7.229
  495   2HD2  ASN 144          2HD2      ASN 144 145.264   6.324   6.067
  496    H    ASP 145           H        ASP 145 139.995   5.293   8.521
  497    HA   ASP 145           HA       ASP 145 141.321   4.912  11.099
  498   1HB   ASP 145          2HB       ASP 145 139.162   4.014  11.855
  499   2HB   ASP 145          1HB       ASP 145 138.973   5.613  11.141
  500    H    GLY 146           H        GLY 146 140.547   3.223   8.178
  501   1HA   GLY 146          2HA       GLY 146 142.003   1.247   7.796
  502   2HA   GLY 146          1HA       GLY 146 141.533   0.721   9.405
  503    H    ARG 147           H        ARG 147 138.732   1.723   8.835
  504    HA   ARG 147           HA       ARG 147 137.892  -0.416   6.995
  505   1HB   ARG 147          2HB       ARG 147 136.430   0.319   9.532
  506   2HB   ARG 147          1HB       ARG 147 136.083  -1.023   8.451
  507   1HG   ARG 147          2HG       ARG 147 138.239  -2.040   9.052
  508   2HG   ARG 147          1HG       ARG 147 138.531  -0.711  10.176
  509   1HD   ARG 147          2HD       ARG 147 136.210  -1.405  11.148
  510   2HD   ARG 147          1HD       ARG 147 136.540  -2.935  10.336
  511    HE   ARG 147           HE       ARG 147 138.760  -2.136  11.902
  512   1HH1  ARG 147          1HH1      ARG 147 135.549  -3.474  12.173
  513   2HH1  ARG 147          2HH1      ARG 147 135.885  -4.305  13.655
  514   1HH2  ARG 147          1HH2      ARG 147 139.204  -3.227  13.850
  515   2HH2  ARG 147          2HH2      ARG 147 137.960  -4.164  14.608
  516    H    ILE 148           H        ILE 148 135.374  -0.104   6.608
  517    HA   ILE 148           HA       ILE 148 134.950   2.748   5.987
  518    HB   ILE 148           HB       ILE 148 133.957   0.401   4.364
  519   1HG1  ILE 148          2HG1      ILE 148 136.143   2.356   3.635
  520   2HG1  ILE 148          1HG1      ILE 148 136.459   0.766   4.323
  521   1HG2  ILE 148          1HG2      ILE 148 133.988   3.323   3.640
  522   2HG2  ILE 148          2HG2      ILE 148 132.593   2.507   4.345
  523   3HG2  ILE 148          3HG2      ILE 148 133.209   2.002   2.771
  524   1HD1  ILE 148          1HD1      ILE 148 136.251  -0.201   2.344
  525   2HD1  ILE 148          2HD1      ILE 148 136.188   1.414   1.639
  526   3HD1  ILE 148          3HD1      ILE 148 134.693   0.576   2.058
  527    H    ASP 149           H        ASP 149 132.964   3.622   6.406
  528    HA   ASP 149           HA       ASP 149 130.875   1.844   7.449
  529   1HB   ASP 149          2HB       ASP 149 130.407   3.474   9.258
  530   2HB   ASP 149          1HB       ASP 149 132.006   2.748   9.400
  531    H    TYR 150           H        TYR 150 128.732   2.876   7.529
  532    HA   TYR 150           HA       TYR 150 127.966   3.956   5.109
  533   1HB   TYR 150          2HB       TYR 150 126.397   2.896   6.655
  534   2HB   TYR 150          1HB       TYR 150 126.580   4.235   7.782
  535    HD1  TYR 150           HD1      TYR 150 125.669   3.661   4.198
  536    HD2  TYR 150           HD2      TYR 150 124.952   5.867   7.765
  537    HE1  TYR 150           HE1      TYR 150 123.815   4.837   3.091
  538    HE2  TYR 150           HE2      TYR 150 123.094   7.049   6.668
  539    HH   TYR 150           HH       TYR 150 121.496   6.535   4.695
  540    H    ASP 151           H        ASP 151 129.208   5.591   7.918
  541    HA   ASP 151           HA       ASP 151 128.265   8.186   7.351
  542   1HB   ASP 151          2HB       ASP 151 130.859   7.511   8.744
  543   2HB   ASP 151          1HB       ASP 151 129.893   8.969   8.931
  544    H    GLU 152           H        GLU 152 131.473   6.754   6.727
  545    HA   GLU 152           HA       GLU 152 132.218   8.953   5.025
  546   1HB   GLU 152          2HB       GLU 152 134.249   7.461   4.578
  547   2HB   GLU 152          1HB       GLU 152 134.023   8.053   6.217
  548   1HG   GLU 152          2HG       GLU 152 133.633   6.000   7.054
  549   2HG   GLU 152          1HG       GLU 152 132.810   5.441   5.599
  550    H    PHE 153           H        PHE 153 130.774   5.837   4.610
  551    HA   PHE 153           HA       PHE 153 131.463   5.243   1.980
  552   1HB   PHE 153          2HB       PHE 153 130.070   3.892   3.722
  553   2HB   PHE 153          1HB       PHE 153 128.692   4.723   3.010
  554    HD1  PHE 153           HD1      PHE 153 131.240   2.180   2.538
  555    HD2  PHE 153           HD2      PHE 153 128.061   4.314   0.683
  556    HE1  PHE 153           HE1      PHE 153 131.174   0.505   0.736
  557    HE2  PHE 153           HE2      PHE 153 127.989   2.644  -1.123
  558    HZ   PHE 153           HZ       PHE 153 129.546   0.737  -1.097
  559    H    LEU 154           H        LEU 154 128.831   7.262   3.227
  560    HA   LEU 154           HA       LEU 154 127.584   7.819   0.785
  561   1HB   LEU 154          2HB       LEU 154 127.350   8.654   3.481
  562   2HB   LEU 154          1HB       LEU 154 127.450  10.106   2.504
  563    HG   LEU 154           HG       LEU 154 125.130   9.464   2.863
  564   1HD1  LEU 154          1HD1      LEU 154 125.989   8.979   0.015
  565   2HD1  LEU 154          2HD1      LEU 154 125.750  10.560   0.758
  566   3HD1  LEU 154          3HD1      LEU 154 124.383   9.465   0.555
  567   1HD2  LEU 154          1HD2      LEU 154 125.956   6.912   2.823
  568   2HD2  LEU 154          2HD2      LEU 154 125.334   7.049   1.178
  569   3HD2  LEU 154          3HD2      LEU 154 124.281   7.394   2.550
  570    H    GLU 155           H        GLU 155 130.460   9.129   2.250
  571    HA   GLU 155           HA       GLU 155 130.626  11.382   0.460
  572   1HB   GLU 155          2HB       GLU 155 132.430  10.227   2.567
  573   2HB   GLU 155          1HB       GLU 155 133.010  11.476   1.475
  574   1HG   GLU 155          2HG       GLU 155 130.880  12.756   2.236
  575   2HG   GLU 155          1HG       GLU 155 130.924  11.640   3.600
  576    H    PHE 156           H        PHE 156 131.763   8.098   0.544
  577    HA   PHE 156           HA       PHE 156 133.802   8.421  -1.434
  578   1HB   PHE 156          2HB       PHE 156 133.890   6.586   0.183
  579   2HB   PHE 156          1HB       PHE 156 132.386   5.930  -0.458
  580    HD1  PHE 156           HD1      PHE 156 132.823   3.935  -1.502
  581    HD2  PHE 156           HD2      PHE 156 135.484   7.200  -2.109
  582    HE1  PHE 156           HE1      PHE 156 134.097   2.591  -3.122
  583    HE2  PHE 156           HE2      PHE 156 136.763   5.862  -3.730
  584    HZ   PHE 156           HZ       PHE 156 136.069   3.554  -4.238
  585    H    MET 157           H        MET 157 130.375   7.941  -1.511
  586    HA   MET 157           HA       MET 157 130.508   7.415  -4.405
  587   1HB   MET 157          2HB       MET 157 129.064   6.108  -2.396
  588   2HB   MET 157          1HB       MET 157 127.872   7.076  -3.252
  589   1HG   MET 157          2HG       MET 157 128.046   5.863  -5.151
  590   2HG   MET 157          1HG       MET 157 129.757   5.523  -4.911
  591   1HE   MET 157          1HE       MET 157 130.133   2.741  -2.729
  592   2HE   MET 157          2HE       MET 157 130.755   3.939  -3.865
  593   3HE   MET 157          3HE       MET 157 130.098   2.416  -4.462
  594    H    LYS 158           H        LYS 158 130.560  10.026  -2.773
  595    HA   LYS 158           HA       LYS 158 128.140  11.326  -3.735
  596   1HB   LYS 158          2HB       LYS 158 128.816  13.222  -2.430
  597   2HB   LYS 158          1HB       LYS 158 129.037  11.779  -1.452
  598   1HG   LYS 158          2HG       LYS 158 131.048  12.638  -1.009
  599   2HG   LYS 158          1HG       LYS 158 131.488  12.030  -2.605
  600   1HD   LYS 158          2HD       LYS 158 131.681  14.094  -3.453
  601   2HD   LYS 158          1HD       LYS 158 130.188  14.641  -2.689
  602   1HE   LYS 158          2HE       LYS 158 131.292  15.618  -1.013
  603   2HE   LYS 158          1HE       LYS 158 132.321  14.209  -0.766
  604   1HZ   LYS 158          1HZ       LYS 158 133.834  15.775  -1.421
  605   2HZ   LYS 158          2HZ       LYS 158 132.766  16.554  -2.477
  606   3HZ   LYS 158          3HZ       LYS 158 133.463  15.076  -2.917
  607    H    GLY 159           H        GLY 159 130.244  10.343  -5.603
  608   1HA   GLY 159          2HA       GLY 159 130.566  11.315  -7.772
  609   2HA   GLY 159          1HA       GLY 159 130.655  12.894  -7.007
  610    H    VAL 160           H        VAL 160 132.330   9.780  -6.568
  611    HA   VAL 160           HA       VAL 160 134.841  11.162  -6.160
  612    HB   VAL 160           HB       VAL 160 135.744   8.782  -5.968
  613   1HG1  VAL 160          1HG1      VAL 160 135.271  10.179  -4.033
  614   2HG1  VAL 160          2HG1      VAL 160 134.839   8.500  -3.709
  615   3HG1  VAL 160          3HG1      VAL 160 133.580   9.681  -4.069
  616   1HG2  VAL 160          1HG2      VAL 160 134.229   6.978  -5.724
  617   2HG2  VAL 160          2HG2      VAL 160 133.788   7.795  -7.223
  618   3HG2  VAL 160          3HG2      VAL 160 132.831   8.053  -5.764
  619    H    GLU 161           H        GLU 161 133.250   9.318  -8.664
  620    HA   GLU 161           HA       GLU 161 135.621   9.680 -10.378
  621   1HB   GLU 161          2HB       GLU 161 133.619   7.445 -10.238
  622   2HB   GLU 161          1HB       GLU 161 134.537   7.739 -11.707
  623   1HG   GLU 161          2HG       GLU 161 136.109   7.587  -9.225
  624   2HG   GLU 161          1HG       GLU 161 135.329   6.092  -9.738
  Start of MODEL    4
    1   1H    MET  81          1HT       MET  81  90.192   9.053  -1.069
    2   2H    MET  81          2HT       MET  81  89.110  10.385  -1.136
    3   3H    MET  81          3HT       MET  81  89.543   9.702   0.378
    4    HA   MET  81           HA       MET  81  90.634  11.829  -0.233
    5   1HB   MET  81          2HB       MET  81  91.968   9.280   0.595
    6   2HB   MET  81          1HB       MET  81  92.945  10.729   0.407
    7   1HG   MET  81          2HG       MET  81  90.490  11.044   1.997
    8   2HG   MET  81          1HG       MET  81  91.735  10.010   2.695
    9   1HE   MET  81          1HE       MET  81  92.467  12.880   4.846
   10   2HE   MET  81          2HE       MET  81  91.263  11.638   4.505
   11   3HE   MET  81          3HE       MET  81  90.947  13.316   4.065
   12    H    VAL  82           H        VAL  82  90.878  12.693  -2.229
   13    HA   VAL  82           HA       VAL  82  92.038  11.328  -4.432
   14    HB   VAL  82           HB       VAL  82  91.767  14.317  -4.111
   15   1HG1  VAL  82          1HG1      VAL  82  93.064  13.048  -6.056
   16   2HG1  VAL  82          2HG1      VAL  82  92.113  14.504  -6.350
   17   3HG1  VAL  82          3HG1      VAL  82  91.429  12.916  -6.702
   18   1HG2  VAL  82          1HG2      VAL  82  89.585  13.774  -3.786
   19   2HG2  VAL  82          2HG2      VAL  82  89.738  12.210  -4.589
   20   3HG2  VAL  82          3HG2      VAL  82  89.613  13.686  -5.548
   21    H    ARG  83           H        ARG  83  93.294  13.520  -1.988
   22    HA   ARG  83           HA       ARG  83  96.006  12.955  -2.971
   23   1HB   ARG  83          2HB       ARG  83  96.663  15.264  -2.342
   24   2HB   ARG  83          1HB       ARG  83  95.499  15.213  -3.659
   25   1HG   ARG  83          2HG       ARG  83  93.811  15.446  -1.594
   26   2HG   ARG  83          1HG       ARG  83  95.220  16.266  -0.919
   27   1HD   ARG  83          2HD       ARG  83  95.273  17.825  -2.718
   28   2HD   ARG  83          1HD       ARG  83  94.074  16.906  -3.629
   29    HE   ARG  83           HE       ARG  83  92.435  17.961  -2.445
   30   1HH1  ARG  83          1HH1      ARG  83  95.439  18.284  -0.698
   31   2HH1  ARG  83          2HH1      ARG  83  94.778  19.353   0.492
   32   1HH2  ARG  83          1HH2      ARG  83  91.563  19.368  -0.880
   33   2HH2  ARG  83          2HH2      ARG  83  92.577  19.968   0.390
   34    H    CYS  84           H        CYS  84  97.061  11.855  -1.469
   35    HA   CYS  84           HA       CYS  84  97.140  12.779   1.258
   36   1HB   CYS  84          2HB       CYS  84  95.099  11.116   0.834
   37   2HB   CYS  84          1HB       CYS  84  96.367   9.911   1.035
   38    HG   CYS  84           HG       CYS  84  96.058  10.193   3.437
   39    H    MET  85           H        MET  85  98.748  11.642   2.543
   40    HA   MET  85           HA       MET  85 100.806  10.732   2.866
   41   1HB   MET  85          2HB       MET  85 100.149   9.079   0.420
   42   2HB   MET  85          1HB       MET  85 101.414   8.737   1.593
   43   1HG   MET  85          2HG       MET  85  99.978   7.884   3.100
   44   2HG   MET  85          1HG       MET  85  98.697   9.021   2.687
   45   1HE   MET  85          1HE       MET  85  97.837   5.253   2.646
   46   2HE   MET  85          2HE       MET  85  96.560   6.426   2.325
   47   3HE   MET  85          3HE       MET  85  97.793   6.774   3.537
   48    H    LYS  86           H        LYS  86 102.931  11.103   2.277
   49    HA   LYS  86           HA       LYS  86 103.302  13.035   0.173
   50   1HB   LYS  86          2HB       LYS  86 104.929  11.956   2.412
   51   2HB   LYS  86          1HB       LYS  86 105.805  12.607   1.034
   52   1HG   LYS  86          2HG       LYS  86 105.638  14.514   2.222
   53   2HG   LYS  86          1HG       LYS  86 104.073  14.604   1.411
   54   1HD   LYS  86          2HD       LYS  86 103.439  13.097   3.571
   55   2HD   LYS  86          1HD       LYS  86 104.717  14.114   4.242
   56   1HE   LYS  86          2HE       LYS  86 103.456  16.080   3.222
   57   2HE   LYS  86          1HE       LYS  86 102.116  14.958   2.991
   58   1HZ   LYS  86          1HZ       LYS  86 103.370  15.736   5.567
   59   2HZ   LYS  86          2HZ       LYS  86 102.220  14.504   5.411
   60   3HZ   LYS  86          3HZ       LYS  86 101.803  16.101   5.041
   61    H    ASP  87           H        ASP  87 103.807  12.578  -1.857
   62    HA   ASP  87           HA       ASP  87 104.537   9.887  -2.612
   63   1HB   ASP  87          2HB       ASP  87 104.395  10.756  -4.927
   64   2HB   ASP  87          1HB       ASP  87 102.942  11.100  -3.993
   65    H    ASP  88           H        ASP  88 106.408   9.323  -3.818
   66    HA   ASP  88           HA       ASP  88 108.714  11.049  -3.226
   67   1HB   ASP  88          2HB       ASP  88 108.684   8.742  -2.241
   68   2HB   ASP  88          1HB       ASP  88 108.732   8.096  -3.879
   69    H    SER  89           H        SER  89 109.006  12.331  -4.962
   70    HA   SER  89           HA       SER  89 108.881  11.150  -7.641
   71   1HB   SER  89          2HB       SER  89 107.856  13.492  -6.762
   72   2HB   SER  89          1HB       SER  89 109.429  14.047  -7.335
   73    HG   SER  89           HG       SER  89 108.055  14.130  -9.063
   74    H    LYS  90           H        LYS  90 111.080  10.605  -5.793
   75    HA   LYS  90           HA       LYS  90 113.293  11.806  -7.327
   76   1HB   LYS  90          2HB       LYS  90 113.078  11.070  -4.423
   77   2HB   LYS  90          1HB       LYS  90 114.648  11.155  -5.210
   78   1HG   LYS  90          2HG       LYS  90 113.581  13.522  -5.967
   79   2HG   LYS  90          1HG       LYS  90 112.827  13.303  -4.385
   80   1HD   LYS  90          2HD       LYS  90 115.081  12.900  -3.427
   81   2HD   LYS  90          1HD       LYS  90 115.780  13.268  -5.005
   82   1HE   LYS  90          2HE       LYS  90 114.906  15.511  -4.921
   83   2HE   LYS  90          1HE       LYS  90 114.039  15.158  -3.427
   84   1HZ   LYS  90          1HZ       LYS  90 116.000  15.092  -2.214
   85   2HZ   LYS  90          2HZ       LYS  90 116.258  16.385  -3.273
   86   3HZ   LYS  90          3HZ       LYS  90 116.974  14.885  -3.583
   87    H    GLY  91           H        GLY  91 115.041  10.466  -7.900
   88   1HA   GLY  91          2HA       GLY  91 114.296   7.769  -8.500
   89   2HA   GLY  91          1HA       GLY  91 115.841   8.525  -8.854
   90    H    LYS  92           H        LYS  92 117.506   8.449  -7.309
   91    HA   LYS  92           HA       LYS  92 117.131   6.340  -5.292
   92   1HB   LYS  92          2HB       LYS  92 119.675   7.313  -6.605
   93   2HB   LYS  92          1HB       LYS  92 119.571   6.023  -5.414
   94   1HG   LYS  92          2HG       LYS  92 119.655   4.826  -7.363
   95   2HG   LYS  92          1HG       LYS  92 117.912   4.965  -7.129
   96   1HD   LYS  92          2HD       LYS  92 118.534   7.250  -8.535
   97   2HD   LYS  92          1HD       LYS  92 119.611   6.044  -9.241
   98   1HE   LYS  92          2HE       LYS  92 116.611   6.015  -9.084
   99   2HE   LYS  92          1HE       LYS  92 117.634   5.950 -10.518
  100   1HZ   LYS  92          1HZ       LYS  92 116.855   3.821  -8.698
  101   2HZ   LYS  92          2HZ       LYS  92 118.448   3.766  -9.261
  102   3HZ   LYS  92          3HZ       LYS  92 117.164   3.766 -10.360
  103    H    THR  93           H        THR  93 116.975   7.011  -3.267
  104    HA   THR  93           HA       THR  93 117.908   9.660  -2.524
  105    HB   THR  93           HB       THR  93 115.688   8.941  -1.789
  106    HG1  THR  93           HG1      THR  93 115.912   9.822   0.134
  107   1HG2  THR  93          1HG2      THR  93 115.405   7.243  -0.071
  108   2HG2  THR  93          2HG2      THR  93 117.115   6.830  -0.190
  109   3HG2  THR  93          3HG2      THR  93 116.042   6.549  -1.561
  110    H    GLU  94           H        GLU  94 118.700   9.585  -0.022
  111    HA   GLU  94           HA       GLU  94 121.332   8.568  -0.139
  112   1HB   GLU  94          2HB       GLU  94 120.602  10.556   1.193
  113   2HB   GLU  94          1HB       GLU  94 119.816   9.459   2.319
  114   1HG   GLU  94          2HG       GLU  94 122.093   8.376   2.613
  115   2HG   GLU  94          1HG       GLU  94 122.746   9.780   1.769
  116    H    GLU  95           H        GLU  95 118.361   7.362   1.284
  117    HA   GLU  95           HA       GLU  95 119.427   5.357   2.918
  118   1HB   GLU  95          2HB       GLU  95 116.968   6.248   2.594
  119   2HB   GLU  95          1HB       GLU  95 116.857   4.911   1.459
  120   1HG   GLU  95          2HG       GLU  95 116.054   4.047   3.465
  121   2HG   GLU  95          1HG       GLU  95 117.708   3.445   3.359
  122    H    GLU  96           H        GLU  96 118.886   5.482  -0.527
  123    HA   GLU  96           HA       GLU  96 118.983   2.756  -1.135
  124   1HB   GLU  96          2HB       GLU  96 120.041   5.049  -2.799
  125   2HB   GLU  96          1HB       GLU  96 119.618   3.447  -3.389
  126   1HG   GLU  96          2HG       GLU  96 117.720   5.456  -2.199
  127   2HG   GLU  96          1HG       GLU  96 117.884   5.060  -3.909
  128    H    LEU  97           H        LEU  97 121.543   5.068  -0.487
  129    HA   LEU  97           HA       LEU  97 123.695   3.437  -1.363
  130   1HB   LEU  97          2HB       LEU  97 123.598   5.750   0.571
  131   2HB   LEU  97          1HB       LEU  97 125.086   4.988   0.037
  132    HG   LEU  97           HG       LEU  97 123.174   6.101  -1.983
  133   1HD1  LEU  97          1HD1      LEU  97 124.914   7.613  -0.110
  134   2HD1  LEU  97          2HD1      LEU  97 123.364   8.056  -0.827
  135   3HD1  LEU  97          3HD1      LEU  97 124.838   8.141  -1.790
  136   1HD2  LEU  97          1HD2      LEU  97 125.989   5.207  -1.868
  137   2HD2  LEU  97          2HD2      LEU  97 125.641   6.602  -2.890
  138   3HD2  LEU  97          3HD2      LEU  97 124.805   5.073  -3.169
  139    H    SER  98           H        SER  98 121.915   3.701   1.631
  140    HA   SER  98           HA       SER  98 123.758   2.307   3.274
  141   1HB   SER  98          2HB       SER  98 122.090   3.657   4.341
  142   2HB   SER  98          1HB       SER  98 120.785   2.793   3.527
  143    HG   SER  98           HG       SER  98 120.831   1.817   5.440
  144    H    ASP  99           H        ASP  99 121.017   1.292   1.296
  145    HA   ASP  99           HA       ASP  99 120.865  -1.372   2.148
  146   1HB   ASP  99          2HB       ASP  99 120.167  -0.074  -0.489
  147   2HB   ASP  99          1HB       ASP  99 119.830  -1.767  -0.135
  148    H    LEU 100           H        LEU 100 122.907   0.190  -0.253
  149    HA   LEU 100           HA       LEU 100 123.974  -2.210  -1.348
  150   1HB   LEU 100          2HB       LEU 100 124.771   0.677  -1.431
  151   2HB   LEU 100          1HB       LEU 100 125.842  -0.551  -2.076
  152    HG   LEU 100           HG       LEU 100 123.053  -0.677  -3.037
  153   1HD1  LEU 100          1HD1      LEU 100 123.943   1.142  -4.784
  154   2HD1  LEU 100          2HD1      LEU 100 124.726   1.741  -3.322
  155   3HD1  LEU 100          3HD1      LEU 100 122.973   1.557  -3.373
  156   1HD2  LEU 100          1HD2      LEU 100 125.365  -0.542  -4.860
  157   2HD2  LEU 100          2HD2      LEU 100 124.003  -1.663  -4.829
  158   3HD2  LEU 100          3HD2      LEU 100 125.357  -1.891  -3.723
  159    H    PHE 101           H        PHE 101 124.804  -0.181   1.370
  160    HA   PHE 101           HA       PHE 101 127.418  -1.211   1.795
  161   1HB   PHE 101          2HB       PHE 101 126.692   0.937   2.735
  162   2HB   PHE 101          1HB       PHE 101 125.512   0.106   3.744
  163    HD1  PHE 101           HD1      PHE 101 129.087   0.737   3.199
  164    HD2  PHE 101           HD2      PHE 101 126.166  -1.024   5.743
  165    HE1  PHE 101           HE1      PHE 101 130.781   0.491   4.965
  166    HE2  PHE 101           HE2      PHE 101 127.854  -1.272   7.515
  167    HZ   PHE 101           HZ       PHE 101 130.165  -0.514   7.128
  168    H    ARG 102           H        ARG 102 124.214  -2.201   2.802
  169    HA   ARG 102           HA       ARG 102 125.052  -4.050   4.794
  170   1HB   ARG 102          2HB       ARG 102 122.525  -3.370   3.415
  171   2HB   ARG 102          1HB       ARG 102 122.633  -5.007   4.048
  172   1HG   ARG 102          2HG       ARG 102 123.238  -2.597   5.730
  173   2HG   ARG 102          1HG       ARG 102 121.609  -3.254   5.560
  174   1HD   ARG 102          2HD       ARG 102 122.123  -5.186   6.695
  175   2HD   ARG 102          1HD       ARG 102 123.836  -5.091   6.296
  176    HE   ARG 102           HE       ARG 102 124.164  -3.904   8.215
  177   1HH1  ARG 102          1HH1      ARG 102 120.778  -3.741   7.388
  178   2HH1  ARG 102          2HH1      ARG 102 120.332  -2.920   8.846
  179   1HH2  ARG 102          1HH2      ARG 102 123.580  -2.827  10.134
  180   2HH2  ARG 102          2HH2      ARG 102 121.923  -2.401  10.405
  181    H    MET 103           H        MET 103 124.572  -4.237   1.333
  182    HA   MET 103           HA       MET 103 124.670  -7.091   1.188
  183   1HB   MET 103          2HB       MET 103 124.688  -4.843  -0.767
  184   2HB   MET 103          1HB       MET 103 125.280  -6.407  -1.312
  185   1HG   MET 103          2HG       MET 103 122.893  -6.952   0.023
  186   2HG   MET 103          1HG       MET 103 122.580  -5.498  -0.921
  187   1HE   MET 103          1HE       MET 103 123.120  -5.197  -3.275
  188   2HE   MET 103          2HE       MET 103 122.962  -6.450  -4.507
  189   3HE   MET 103          3HE       MET 103 124.520  -6.169  -3.730
  190    H    PHE 104           H        PHE 104 127.023  -4.513   1.110
  191    HA   PHE 104           HA       PHE 104 129.169  -6.181   0.165
  192   1HB   PHE 104          2HB       PHE 104 129.103  -3.395   1.328
  193   2HB   PHE 104          1HB       PHE 104 130.587  -4.188   0.811
  194    HD1  PHE 104           HD1      PHE 104 128.802  -1.654  -0.166
  195    HD2  PHE 104           HD2      PHE 104 129.718  -5.537  -1.646
  196    HE1  PHE 104           HE1      PHE 104 128.416  -0.865  -2.464
  197    HE2  PHE 104           HE2      PHE 104 129.335  -4.756  -3.947
  198    HZ   PHE 104           HZ       PHE 104 128.683  -2.417  -4.359
  199    H    ASP 105           H        ASP 105 128.119  -4.877   3.280
  200    HA   ASP 105           HA       ASP 105 130.303  -5.798   4.799
  201   1HB   ASP 105          2HB       ASP 105 128.334  -4.153   5.393
  202   2HB   ASP 105          1HB       ASP 105 127.562  -5.618   5.991
  203    H    LYS 106           H        LYS 106 130.878  -7.785   5.363
  204    HA   LYS 106           HA       LYS 106 129.223 -10.037   4.707
  205   1HB   LYS 106          2HB       LYS 106 131.994  -9.562   5.302
  206   2HB   LYS 106          1HB       LYS 106 131.403 -10.883   6.298
  207   1HG   LYS 106          2HG       LYS 106 131.195 -10.718   3.299
  208   2HG   LYS 106          1HG       LYS 106 132.362 -11.684   4.206
  209   1HD   LYS 106          2HD       LYS 106 129.484 -12.061   4.828
  210   2HD   LYS 106          1HD       LYS 106 130.079 -12.701   3.294
  211   1HE   LYS 106          2HE       LYS 106 131.560 -14.162   4.337
  212   2HE   LYS 106          1HE       LYS 106 131.530 -13.261   5.853
  213   1HZ   LYS 106          1HZ       LYS 106 129.687 -15.275   4.856
  214   2HZ   LYS 106          2HZ       LYS 106 128.988 -13.977   5.684
  215   3HZ   LYS 106          3HZ       LYS 106 130.160 -14.932   6.442
  216    H    ASN 107           H        ASN 107 130.596  -8.780   7.747
  217    HA   ASN 107           HA       ASN 107 129.045 -10.572   9.360
  218   1HB   ASN 107          2HB       ASN 107 130.812  -8.212   9.985
  219   2HB   ASN 107          1HB       ASN 107 129.903  -9.052  11.238
  220   1HD2  ASN 107          1HD2      ASN 107 130.203 -11.481  11.209
  221   2HD2  ASN 107          2HD2      ASN 107 131.818 -12.051  10.980
  222    H    ALA 108           H        ALA 108 128.608  -7.384   8.070
  223    HA   ALA 108           HA       ALA 108 126.839  -5.953   8.090
  224   1HB   ALA 108          1HB       ALA 108 125.690  -8.391   8.039
  225   2HB   ALA 108          2HB       ALA 108 124.783  -6.878   8.029
  226   3HB   ALA 108          3HB       ALA 108 125.017  -7.756   9.541
  227    H    ASP 109           H        ASP 109 128.700  -5.800  10.178
  228    HA   ASP 109           HA       ASP 109 127.156  -5.330  12.607
  229   1HB   ASP 109          2HB       ASP 109 129.363  -4.906  13.651
  230   2HB   ASP 109          1HB       ASP 109 129.274  -6.486  12.877
  231    H    GLY 110           H        GLY 110 128.494  -3.599   9.949
  232   1HA   GLY 110          2HA       GLY 110 127.444  -1.332   9.731
  233   2HA   GLY 110          1HA       GLY 110 128.011  -1.052  11.369
  234    H    TYR 111           H        TYR 111 130.342  -2.866   9.905
  235    HA   TYR 111           HA       TYR 111 131.686  -0.632   8.598
  236   1HB   TYR 111          2HB       TYR 111 133.035  -2.189  10.810
  237   2HB   TYR 111          1HB       TYR 111 133.686  -0.814   9.926
  238    HD1  TYR 111           HD1      TYR 111 133.004   1.445  10.458
  239    HD2  TYR 111           HD2      TYR 111 131.330  -1.873  12.530
  240    HE1  TYR 111           HE1      TYR 111 132.103   2.971  12.162
  241    HE2  TYR 111           HE2      TYR 111 130.422  -0.356  14.240
  242    HH   TYR 111           HH       TYR 111 130.064   2.844  13.854
  243    H    ILE 112           H        ILE 112 133.577  -1.294   7.370
  244    HA   ILE 112           HA       ILE 112 133.639  -4.176   6.770
  245    HB   ILE 112           HB       ILE 112 133.862  -2.021   4.671
  246   1HG1  ILE 112          2HG1      ILE 112 131.494  -3.835   5.146
  247   2HG1  ILE 112          1HG1      ILE 112 131.581  -2.190   5.769
  248   1HG2  ILE 112          1HG2      ILE 112 135.011  -4.092   4.129
  249   2HG2  ILE 112          2HG2      ILE 112 133.585  -3.893   3.111
  250   3HG2  ILE 112          3HG2      ILE 112 133.547  -5.013   4.472
  251   1HD1  ILE 112          1HD1      ILE 112 131.541  -3.063   2.896
  252   2HD1  ILE 112          2HD1      ILE 112 131.888  -1.413   3.413
  253   3HD1  ILE 112          3HD1      ILE 112 130.318  -2.136   3.766
  254    H    ASP 113           H        ASP 113 135.626  -5.025   6.150
  255    HA   ASP 113           HA       ASP 113 137.929  -3.203   6.255
  256   1HB   ASP 113          2HB       ASP 113 139.146  -5.041   7.527
  257   2HB   ASP 113          1HB       ASP 113 137.922  -4.153   8.431
  258    H    LEU 114           H        LEU 114 139.995  -4.593   5.661
  259    HA   LEU 114           HA       LEU 114 139.743  -5.312   2.974
  260   1HB   LEU 114          2HB       LEU 114 141.868  -5.598   5.040
  261   2HB   LEU 114          1HB       LEU 114 142.042  -6.508   3.553
  262    HG   LEU 114           HG       LEU 114 141.494  -3.574   3.405
  263   1HD1  LEU 114          1HD1      LEU 114 144.323  -4.405   3.408
  264   2HD1  LEU 114          2HD1      LEU 114 143.520  -4.371   4.976
  265   3HD1  LEU 114          3HD1      LEU 114 143.573  -2.916   3.981
  266   1HD2  LEU 114          1HD2      LEU 114 142.179  -3.768   1.263
  267   2HD2  LEU 114          2HD2      LEU 114 141.732  -5.456   1.504
  268   3HD2  LEU 114          3HD2      LEU 114 143.418  -4.961   1.651
  269    H    GLU 115           H        GLU 115 139.456  -7.208   5.884
  270    HA   GLU 115           HA       GLU 115 139.687  -9.759   4.623
  271   1HB   GLU 115          2HB       GLU 115 139.449  -8.767   7.273
  272   2HB   GLU 115          1HB       GLU 115 138.143  -9.917   7.028
  273   1HG   GLU 115          2HG       GLU 115 139.990 -11.452   6.080
  274   2HG   GLU 115          1HG       GLU 115 141.094 -10.361   6.917
  275    H    GLU 116           H        GLU 116 136.912  -7.890   5.845
  276    HA   GLU 116           HA       GLU 116 134.979  -9.728   4.847
  277   1HB   GLU 116          2HB       GLU 116 134.943  -7.068   6.151
  278   2HB   GLU 116          1HB       GLU 116 133.536  -7.479   5.179
  279   1HG   GLU 116          2HG       GLU 116 132.733  -8.612   6.894
  280   2HG   GLU 116          1HG       GLU 116 134.081  -9.738   6.746
  281    H    LEU 117           H        LEU 117 136.697  -7.059   3.475
  282    HA   LEU 117           HA       LEU 117 134.839  -6.602   1.329
  283   1HB   LEU 117          2HB       LEU 117 136.500  -4.931   2.350
  284   2HB   LEU 117          1HB       LEU 117 137.715  -5.734   1.374
  285    HG   LEU 117           HG       LEU 117 136.264  -5.210  -0.643
  286   1HD1  LEU 117          1HD1      LEU 117 134.166  -4.673   0.109
  287   2HD1  LEU 117          2HD1      LEU 117 134.859  -3.066  -0.110
  288   3HD1  LEU 117          3HD1      LEU 117 134.771  -3.778   1.502
  289   1HD2  LEU 117          1HD2      LEU 117 136.910  -2.690  -0.474
  290   2HD2  LEU 117          2HD2      LEU 117 138.171  -3.923  -0.523
  291   3HD2  LEU 117          3HD2      LEU 117 137.710  -3.192   1.015
  292    H    LYS 118           H        LYS 118 137.741  -8.505   1.826
  293    HA   LYS 118           HA       LYS 118 138.168  -9.106  -0.928
  294   1HB   LYS 118          2HB       LYS 118 139.749 -10.783  -0.118
  295   2HB   LYS 118          1HB       LYS 118 139.978  -9.253   0.716
  296   1HG   LYS 118          2HG       LYS 118 139.213 -10.066   2.714
  297   2HG   LYS 118          1HG       LYS 118 138.224 -11.314   1.952
  298   1HD   LYS 118          2HD       LYS 118 141.110 -11.572   1.477
  299   2HD   LYS 118          1HD       LYS 118 140.622 -11.755   3.163
  300   1HE   LYS 118          2HE       LYS 118 138.754 -13.277   1.995
  301   2HE   LYS 118          1HE       LYS 118 140.055 -13.468   0.821
  302   1HZ   LYS 118          1HZ       LYS 118 139.869 -15.058   2.855
  303   2HZ   LYS 118          2HZ       LYS 118 140.654 -13.805   3.675
  304   3HZ   LYS 118          3HZ       LYS 118 141.387 -14.524   2.330
  305    H    ILE 119           H        ILE 119 136.216 -10.487   1.605
  306    HA   ILE 119           HA       ILE 119 135.758 -13.000   0.338
  307    HB   ILE 119           HB       ILE 119 134.017 -11.626   2.387
  308   1HG1  ILE 119          2HG1      ILE 119 136.012 -13.737   3.088
  309   2HG1  ILE 119          1HG1      ILE 119 136.584 -12.089   2.848
  310   1HG2  ILE 119          1HG2      ILE 119 132.957 -13.509   1.230
  311   2HG2  ILE 119          2HG2      ILE 119 133.258 -13.871   2.929
  312   3HG2  ILE 119          3HG2      ILE 119 134.311 -14.543   1.685
  313   1HD1  ILE 119          1HD1      ILE 119 134.418 -11.751   4.497
  314   2HD1  ILE 119          2HD1      ILE 119 136.109 -11.789   4.996
  315   3HD1  ILE 119          3HD1      ILE 119 135.134 -13.257   5.073
  316    H    MET 120           H        MET 120 133.852 -10.005   0.583
  317    HA   MET 120           HA       MET 120 131.663 -10.896  -0.939
  318   1HB   MET 120          2HB       MET 120 131.092  -8.518  -1.171
  319   2HB   MET 120          1HB       MET 120 131.533  -8.919   0.483
  320   1HG   MET 120          2HG       MET 120 133.310  -7.562   0.476
  321   2HG   MET 120          1HG       MET 120 133.762  -7.992  -1.171
  322   1HE   MET 120          1HE       MET 120 132.536  -5.228  -3.308
  323   2HE   MET 120          2HE       MET 120 132.427  -6.988  -3.335
  324   3HE   MET 120          3HE       MET 120 133.927  -6.205  -2.836
  325    H    LEU 121           H        LEU 121 134.780  -9.631  -1.849
  326    HA   LEU 121           HA       LEU 121 134.112  -9.009  -4.548
  327   1HB   LEU 121          2HB       LEU 121 136.206  -8.406  -2.969
  328   2HB   LEU 121          1HB       LEU 121 136.901  -9.739  -3.870
  329    HG   LEU 121           HG       LEU 121 136.311  -8.535  -5.983
  330   1HD1  LEU 121          1HD1      LEU 121 134.618  -7.075  -4.550
  331   2HD1  LEU 121          2HD1      LEU 121 135.367  -6.471  -6.028
  332   3HD1  LEU 121          3HD1      LEU 121 136.023  -6.013  -4.457
  333   1HD2  LEU 121          1HD2      LEU 121 138.267  -7.325  -5.984
  334   2HD2  LEU 121          2HD2      LEU 121 138.531  -8.398  -4.610
  335   3HD2  LEU 121          3HD2      LEU 121 138.025  -6.729  -4.343
  336    H    GLN 122           H        GLN 122 135.044 -11.905  -2.871
  337    HA   GLN 122           HA       GLN 122 136.059 -13.449  -4.946
  338   1HB   GLN 122          2HB       GLN 122 134.366 -14.303  -2.593
  339   2HB   GLN 122          1HB       GLN 122 135.260 -15.404  -3.630
  340   1HG   GLN 122          2HG       GLN 122 137.037 -13.383  -2.714
  341   2HG   GLN 122          1HG       GLN 122 136.155 -14.030  -1.332
  342   1HE2  GLN 122          1HE2      GLN 122 136.296 -16.269  -0.889
  343   2HE2  GLN 122          2HE2      GLN 122 137.636 -17.204  -1.452
  344    H    ALA 123           H        ALA 123 132.781 -12.500  -4.256
  345    HA   ALA 123           HA       ALA 123 131.367 -14.425  -5.696
  346   1HB   ALA 123          1HB       ALA 123 130.343 -11.664  -5.846
  347   2HB   ALA 123          2HB       ALA 123 130.655 -12.287  -4.225
  348   3HB   ALA 123          3HB       ALA 123 129.551 -13.143  -5.302
  349    H    THR 124           H        THR 124 133.228 -11.689  -6.784
  350    HA   THR 124           HA       THR 124 132.175 -11.350  -9.348
  351    HB   THR 124           HB       THR 124 134.250 -10.251  -9.905
  352    HG1  THR 124           HG1      THR 124 135.825 -11.569  -9.197
  353   1HG2  THR 124          1HG2      THR 124 133.700  -8.558  -8.604
  354   2HG2  THR 124          2HG2      THR 124 134.550  -9.322  -7.260
  355   3HG2  THR 124          3HG2      THR 124 132.836  -9.646  -7.519
  356    H    GLY 125           H        GLY 125 133.364 -11.892 -11.410
  357   1HA   GLY 125          2HA       GLY 125 133.763 -14.766 -11.480
  358   2HA   GLY 125          1HA       GLY 125 133.644 -13.695 -12.866
  359    H    GLU 126           H        GLU 126 135.696 -11.874 -11.722
  360    HA   GLU 126           HA       GLU 126 138.000 -13.323 -12.727
  361   1HB   GLU 126          2HB       GLU 126 139.128 -11.072 -12.468
  362   2HB   GLU 126          1HB       GLU 126 137.786 -11.131 -13.602
  363   1HG   GLU 126          2HG       GLU 126 136.343 -10.024 -12.098
  364   2HG   GLU 126          1HG       GLU 126 137.475 -10.219 -10.760
  365    H    THR 127           H        THR 127 140.042 -13.358 -11.606
  366    HA   THR 127           HA       THR 127 139.686 -13.866  -8.770
  367    HB   THR 127           HB       THR 127 142.074 -14.667  -8.930
  368    HG1  THR 127           HG1      THR 127 143.116 -14.107 -10.643
  369   1HG2  THR 127          1HG2      THR 127 140.719 -16.123 -11.097
  370   2HG2  THR 127          2HG2      THR 127 139.849 -16.014  -9.567
  371   3HG2  THR 127          3HG2      THR 127 141.465 -16.716  -9.614
  372    H    ILE 128           H        ILE 128 140.183 -12.469  -7.220
  373    HA   ILE 128           HA       ILE 128 141.895 -10.171  -7.905
  374    HB   ILE 128           HB       ILE 128 139.870 -10.290  -5.673
  375   1HG1  ILE 128          2HG1      ILE 128 138.764 -10.519  -7.870
  376   2HG1  ILE 128          1HG1      ILE 128 138.392  -8.976  -7.107
  377   1HG2  ILE 128          1HG2      ILE 128 140.442  -8.174  -5.165
  378   2HG2  ILE 128          2HG2      ILE 128 140.711  -7.728  -6.851
  379   3HG2  ILE 128          3HG2      ILE 128 141.959  -8.602  -5.959
  380   1HD1  ILE 128          1HD1      ILE 128 139.741  -9.549  -9.619
  381   2HD1  ILE 128          2HD1      ILE 128 140.590  -8.372  -8.616
  382   3HD1  ILE 128          3HD1      ILE 128 138.912  -8.090  -9.079
  383    H    THR 129           H        THR 129 143.630  -9.683  -6.649
  384    HA   THR 129           HA       THR 129 144.388 -11.672  -4.646
  385    HB   THR 129           HB       THR 129 146.642 -10.655  -4.827
  386    HG1  THR 129           HG1      THR 129 146.661  -8.693  -5.546
  387   1HG2  THR 129          1HG2      THR 129 146.810 -12.277  -6.344
  388   2HG2  THR 129          2HG2      THR 129 146.682 -10.972  -7.524
  389   3HG2  THR 129          3HG2      THR 129 145.249 -11.893  -7.071
  390    H    GLU 130           H        GLU 130 145.404 -10.963  -2.638
  391    HA   GLU 130           HA       GLU 130 143.809  -9.177  -1.195
  392   1HB   GLU 130          2HB       GLU 130 146.590 -10.191  -0.578
  393   2HB   GLU 130          1HB       GLU 130 145.547  -9.366   0.573
  394   1HG   GLU 130          2HG       GLU 130 143.890 -11.322  -0.197
  395   2HG   GLU 130          1HG       GLU 130 145.437 -12.129  -0.448
  396    H    ASP 131           H        ASP 131 146.752  -8.689  -3.005
  397    HA   ASP 131           HA       ASP 131 147.373  -6.124  -1.930
  398   1HB   ASP 131          2HB       ASP 131 148.857  -7.828  -3.281
  399   2HB   ASP 131          1HB       ASP 131 148.234  -6.949  -4.674
  400    H    ASP 132           H        ASP 132 145.400  -7.280  -4.577
  401    HA   ASP 132           HA       ASP 132 145.062  -4.743  -5.835
  402   1HB   ASP 132          2HB       ASP 132 144.078  -7.471  -6.207
  403   2HB   ASP 132          1HB       ASP 132 142.868  -6.248  -6.578
  404    H    ILE 133           H        ILE 133 143.446  -6.449  -3.256
  405    HA   ILE 133           HA       ILE 133 141.102  -4.806  -3.239
  406    HB   ILE 133           HB       ILE 133 142.168  -6.484  -0.969
  407   1HG1  ILE 133          2HG1      ILE 133 140.121  -7.400  -2.974
  408   2HG1  ILE 133          1HG1      ILE 133 141.841  -7.634  -3.270
  409   1HG2  ILE 133          1HG2      ILE 133 139.301  -6.355  -1.260
  410   2HG2  ILE 133          2HG2      ILE 133 139.996  -4.741  -1.114
  411   3HG2  ILE 133          3HG2      ILE 133 140.310  -5.951   0.129
  412   1HD1  ILE 133          1HD1      ILE 133 141.421  -8.567  -0.682
  413   2HD1  ILE 133          2HD1      ILE 133 141.684  -9.526  -2.139
  414   3HD1  ILE 133          3HD1      ILE 133 140.042  -9.145  -1.619
  415    H    GLU 134           H        GLU 134 144.290  -4.522  -1.941
  416    HA   GLU 134           HA       GLU 134 143.905  -2.904   0.275
  417   1HB   GLU 134          2HB       GLU 134 146.107  -3.273  -1.692
  418   2HB   GLU 134          1HB       GLU 134 146.186  -1.862  -0.647
  419   1HG   GLU 134          2HG       GLU 134 145.625  -4.463   0.643
  420   2HG   GLU 134          1HG       GLU 134 147.249  -4.207   0.008
  421    H    GLU 135           H        GLU 135 144.069  -2.002  -3.144
  422    HA   GLU 135           HA       GLU 135 143.917   0.799  -2.697
  423   1HB   GLU 135          2HB       GLU 135 143.352   0.907  -5.123
  424   2HB   GLU 135          1HB       GLU 135 144.810  -0.013  -4.777
  425   1HG   GLU 135          2HG       GLU 135 143.905  -1.974  -5.450
  426   2HG   GLU 135          1HG       GLU 135 142.280  -1.531  -4.929
  427    H    LEU 136           H        LEU 136 141.553  -1.742  -2.964
  428    HA   LEU 136           HA       LEU 136 139.278  -0.245  -3.590
  429   1HB   LEU 136          2HB       LEU 136 139.875  -2.900  -2.766
  430   2HB   LEU 136          1HB       LEU 136 138.578  -2.309  -1.747
  431    HG   LEU 136           HG       LEU 136 138.443  -2.104  -4.744
  432   1HD1  LEU 136          1HD1      LEU 136 138.768  -4.432  -4.327
  433   2HD1  LEU 136          2HD1      LEU 136 137.052  -4.171  -4.641
  434   3HD1  LEU 136          3HD1      LEU 136 137.619  -4.407  -2.989
  435   1HD2  LEU 136          1HD2      LEU 136 136.907  -0.942  -2.874
  436   2HD2  LEU 136          2HD2      LEU 136 136.066  -2.482  -3.041
  437   3HD2  LEU 136          3HD2      LEU 136 136.302  -1.450  -4.451
  438    H    MET 137           H        MET 137 140.822  -0.903  -0.482
  439    HA   MET 137           HA       MET 137 138.791   0.530   0.992
  440   1HB   MET 137          2HB       MET 137 141.396  -0.763   1.780
  441   2HB   MET 137          1HB       MET 137 140.418   0.153   2.918
  442   1HG   MET 137          2HG       MET 137 138.603  -1.579   1.802
  443   2HG   MET 137          1HG       MET 137 140.072  -2.548   1.902
  444   1HE   MET 137          1HE       MET 137 137.105  -1.471   3.173
  445   2HE   MET 137          2HE       MET 137 137.367  -0.668   4.720
  446   3HE   MET 137          3HE       MET 137 137.006  -2.394   4.672
  447    H    LYS 138           H        LYS 138 141.941   1.162  -0.361
  448    HA   LYS 138           HA       LYS 138 142.659   3.435   1.094
  449   1HB   LYS 138          2HB       LYS 138 144.057   2.124  -0.587
  450   2HB   LYS 138          1HB       LYS 138 143.235   3.045  -1.839
  451   1HG   LYS 138          2HG       LYS 138 144.154   5.089  -1.063
  452   2HG   LYS 138          1HG       LYS 138 144.753   4.330   0.413
  453   1HD   LYS 138          2HD       LYS 138 145.939   2.806  -1.512
  454   2HD   LYS 138          1HD       LYS 138 145.906   4.392  -2.284
  455   1HE   LYS 138          2HE       LYS 138 147.976   4.126  -1.070
  456   2HE   LYS 138          1HE       LYS 138 146.982   5.354  -0.286
  457   1HZ   LYS 138          1HZ       LYS 138 147.024   2.529   0.603
  458   2HZ   LYS 138          2HZ       LYS 138 146.413   3.869   1.433
  459   3HZ   LYS 138          3HZ       LYS 138 148.082   3.695   1.223
  460    H    ASP 139           H        ASP 139 140.956   3.231  -2.032
  461    HA   ASP 139           HA       ASP 139 140.394   6.039  -2.069
  462   1HB   ASP 139          2HB       ASP 139 139.260   5.631  -4.127
  463   2HB   ASP 139          1HB       ASP 139 140.676   4.584  -4.112
  464    H    GLY 140           H        GLY 140 138.827   3.239  -0.785
  465   1HA   GLY 140          2HA       GLY 140 136.206   4.434  -0.637
  466   2HA   GLY 140          1HA       GLY 140 136.707   2.916   0.094
  467    H    ASP 141           H        ASP 141 139.016   4.256   1.414
  468    HA   ASP 141           HA       ASP 141 137.536   5.222   3.730
  469   1HB   ASP 141          2HB       ASP 141 139.321   3.489   3.970
  470   2HB   ASP 141          1HB       ASP 141 140.502   4.691   3.459
  471    H    LYS 142           H        LYS 142 137.169   7.315   3.964
  472    HA   LYS 142           HA       LYS 142 139.074   9.230   2.791
  473   1HB   LYS 142          2HB       LYS 142 136.167   9.627   3.520
  474   2HB   LYS 142          1HB       LYS 142 137.219  10.846   2.812
  475   1HG   LYS 142          2HG       LYS 142 136.368   8.262   1.524
  476   2HG   LYS 142          1HG       LYS 142 135.782   9.877   1.125
  477   1HD   LYS 142          2HD       LYS 142 138.604   9.963   0.991
  478   2HD   LYS 142          1HD       LYS 142 138.091   8.503   0.143
  479   1HE   LYS 142          2HE       LYS 142 136.375  10.032  -1.013
  480   2HE   LYS 142          1HE       LYS 142 137.367  11.362  -0.416
  481   1HZ   LYS 142          1HZ       LYS 142 139.155  10.714  -1.719
  482   2HZ   LYS 142          2HZ       LYS 142 137.836  10.439  -2.742
  483   3HZ   LYS 142          3HZ       LYS 142 138.572   9.142  -1.945
  484    H    ASN 143           H        ASN 143 137.582   8.159   5.724
  485    HA   ASN 143           HA       ASN 143 138.332  10.503   7.240
  486   1HB   ASN 143          2HB       ASN 143 137.341   7.831   8.250
  487   2HB   ASN 143          1HB       ASN 143 137.392   9.343   9.150
  488   1HD2  ASN 143          1HD2      ASN 143 135.268   9.607   9.541
  489   2HD2  ASN 143          2HD2      ASN 143 134.070   9.815   8.313
  490    H    ASN 144           H        ASN 144 139.755   7.501   6.351
  491    HA   ASN 144           HA       ASN 144 141.809   6.613   6.735
  492   1HB   ASN 144          2HB       ASN 144 142.445   9.110   6.583
  493   2HB   ASN 144          1HB       ASN 144 142.549   9.052   8.338
  494   1HD2  ASN 144          1HD2      ASN 144 144.555   9.394   6.120
  495   2HD2  ASN 144          2HD2      ASN 144 145.791   8.243   6.481
  496    H    ASP 145           H        ASP 145 139.918   5.631   8.298
  497    HA   ASP 145           HA       ASP 145 141.000   5.635  11.034
  498   1HB   ASP 145          2HB       ASP 145 138.821   4.739  11.732
  499   2HB   ASP 145          1HB       ASP 145 138.637   6.268  10.877
  500    H    GLY 146           H        GLY 146 140.474   3.694   8.223
  501   1HA   GLY 146          2HA       GLY 146 142.001   1.736   8.109
  502   2HA   GLY 146          1HA       GLY 146 141.424   1.328   9.717
  503    H    ARG 147           H        ARG 147 138.652   2.151   8.950
  504    HA   ARG 147           HA       ARG 147 137.981  -0.044   7.115
  505   1HB   ARG 147          2HB       ARG 147 136.548   0.544   9.711
  506   2HB   ARG 147          1HB       ARG 147 136.117  -0.705   8.551
  507   1HG   ARG 147          2HG       ARG 147 138.477  -1.622   8.963
  508   2HG   ARG 147          1HG       ARG 147 138.477  -0.582  10.389
  509   1HD   ARG 147          2HD       ARG 147 136.094  -1.772  10.701
  510   2HD   ARG 147          1HD       ARG 147 136.941  -3.046   9.825
  511    HE   ARG 147           HE       ARG 147 138.229  -3.427  11.682
  512   1HH1  ARG 147          1HH1      ARG 147 136.570  -0.378  12.052
  513   2HH1  ARG 147          2HH1      ARG 147 137.037  -0.183  13.709
  514   1HH2  ARG 147          1HH2      ARG 147 138.842  -3.172  13.862
  515   2HH2  ARG 147          2HH2      ARG 147 138.325  -1.769  14.736
  516    H    ILE 148           H        ILE 148 135.499   0.098   6.619
  517    HA   ILE 148           HA       ILE 148 134.871   2.929   6.080
  518    HB   ILE 148           HB       ILE 148 134.071   0.564   4.379
  519   1HG1  ILE 148          2HG1      ILE 148 136.035   2.645   3.498
  520   2HG1  ILE 148          1HG1      ILE 148 136.593   1.327   4.524
  521   1HG2  ILE 148          1HG2      ILE 148 133.562   3.494   4.263
  522   2HG2  ILE 148          2HG2      ILE 148 132.489   2.143   3.891
  523   3HG2  ILE 148          3HG2      ILE 148 133.750   2.606   2.750
  524   1HD1  ILE 148          1HD1      ILE 148 136.988   0.407   2.495
  525   2HD1  ILE 148          2HD1      ILE 148 135.677   1.290   1.713
  526   3HD1  ILE 148          3HD1      ILE 148 135.319  -0.119   2.711
  527    H    ASP 149           H        ASP 149 132.804   3.645   6.430
  528    HA   ASP 149           HA       ASP 149 130.834   1.702   7.415
  529   1HB   ASP 149          2HB       ASP 149 130.199   3.262   9.222
  530   2HB   ASP 149          1HB       ASP 149 131.860   2.705   9.388
  531    H    TYR 150           H        TYR 150 128.682   3.112   7.859
  532    HA   TYR 150           HA       TYR 150 127.684   3.791   5.351
  533   1HB   TYR 150          2HB       TYR 150 126.260   3.144   7.245
  534   2HB   TYR 150          1HB       TYR 150 126.654   4.654   8.062
  535    HD1  TYR 150           HD1      TYR 150 124.673   5.859   8.174
  536    HD2  TYR 150           HD2      TYR 150 125.756   4.011   4.499
  537    HE1  TYR 150           HE1      TYR 150 122.771   6.959   7.068
  538    HE2  TYR 150           HE2      TYR 150 123.858   5.106   3.382
  539    HH   TYR 150           HH       TYR 150 121.691   6.083   3.966
  540    H    ASP 151           H        ASP 151 128.941   5.869   7.927
  541    HA   ASP 151           HA       ASP 151 128.307   8.333   6.726
  542   1HB   ASP 151          2HB       ASP 151 129.897   7.402   8.988
  543   2HB   ASP 151          1HB       ASP 151 130.610   8.807   8.204
  544    H    GLU 152           H        GLU 152 131.207   6.305   6.550
  545    HA   GLU 152           HA       GLU 152 132.637   8.136   4.880
  546   1HB   GLU 152          2HB       GLU 152 133.197   5.193   5.244
  547   2HB   GLU 152          1HB       GLU 152 134.329   6.445   4.749
  548   1HG   GLU 152          2HG       GLU 152 134.279   7.435   6.932
  549   2HG   GLU 152          1HG       GLU 152 132.998   6.338   7.445
  550    H    PHE 153           H        PHE 153 130.656   5.274   4.346
  551    HA   PHE 153           HA       PHE 153 131.253   4.836   1.649
  552   1HB   PHE 153          2HB       PHE 153 129.708   3.558   3.445
  553   2HB   PHE 153          1HB       PHE 153 128.454   4.380   2.522
  554    HD1  PHE 153           HD1      PHE 153 127.596   3.334   0.664
  555    HD2  PHE 153           HD2      PHE 153 131.508   2.308   1.989
  556    HE1  PHE 153           HE1      PHE 153 127.715   1.580  -1.057
  557    HE2  PHE 153           HE2      PHE 153 131.635   0.553   0.268
  558    HZ   PHE 153           HZ       PHE 153 129.736   0.188  -1.257
  559    H    LEU 154           H        LEU 154 129.046   7.085   3.195
  560    HA   LEU 154           HA       LEU 154 127.604   7.859   0.902
  561   1HB   LEU 154          2HB       LEU 154 127.786   8.643   3.648
  562   2HB   LEU 154          1HB       LEU 154 127.833  10.084   2.648
  563    HG   LEU 154           HG       LEU 154 125.552   9.563   3.339
  564   1HD1  LEU 154          1HD1      LEU 154 124.564   9.327   0.985
  565   2HD1  LEU 154          2HD1      LEU 154 126.239   9.315   0.431
  566   3HD1  LEU 154          3HD1      LEU 154 125.611  10.709   1.310
  567   1HD2  LEU 154          1HD2      LEU 154 124.625   7.449   2.010
  568   2HD2  LEU 154          2HD2      LEU 154 125.263   7.332   3.651
  569   3HD2  LEU 154          3HD2      LEU 154 126.277   6.894   2.276
  570    H    GLU 155           H        GLU 155 130.659   8.946   2.260
  571    HA   GLU 155           HA       GLU 155 130.941  11.194   0.522
  572   1HB   GLU 155          2HB       GLU 155 132.847   9.704   2.316
  573   2HB   GLU 155          1HB       GLU 155 133.384  11.031   1.292
  574   1HG   GLU 155          2HG       GLU 155 131.298  12.208   2.494
  575   2HG   GLU 155          1HG       GLU 155 131.762  11.064   3.752
  576    H    PHE 156           H        PHE 156 132.362   7.935   0.576
  577    HA   PHE 156           HA       PHE 156 133.945   8.189  -1.714
  578   1HB   PHE 156          2HB       PHE 156 134.125   6.329  -0.088
  579   2HB   PHE 156          1HB       PHE 156 132.593   5.690  -0.674
  580    HD1  PHE 156           HD1      PHE 156 132.968   3.737  -1.815
  581    HD2  PHE 156           HD2      PHE 156 135.611   7.018  -2.421
  582    HE1  PHE 156           HE1      PHE 156 134.163   2.451  -3.538
  583    HE2  PHE 156           HE2      PHE 156 136.810   5.737  -4.147
  584    HZ   PHE 156           HZ       PHE 156 136.084   3.451  -4.707
  585    H    MET 157           H        MET 157 130.548   7.381  -1.333
  586    HA   MET 157           HA       MET 157 130.222   6.785  -4.146
  587   1HB   MET 157          2HB       MET 157 128.738   6.313  -1.748
  588   2HB   MET 157          1HB       MET 157 127.702   7.160  -2.887
  589   1HG   MET 157          2HG       MET 157 127.505   4.730  -3.070
  590   2HG   MET 157          1HG       MET 157 128.087   5.468  -4.560
  591   1HE   MET 157          1HE       MET 157 130.688   3.254  -1.509
  592   2HE   MET 157          2HE       MET 157 129.297   4.293  -1.186
  593   3HE   MET 157          3HE       MET 157 130.859   5.009  -1.584
  594    H    LYS 158           H        LYS 158 130.292   9.579  -2.242
  595    HA   LYS 158           HA       LYS 158 128.432  11.098  -3.862
  596   1HB   LYS 158          2HB       LYS 158 128.615  11.574  -1.467
  597   2HB   LYS 158          1HB       LYS 158 130.317  11.969  -1.662
  598   1HG   LYS 158          2HG       LYS 158 129.885  14.002  -2.578
  599   2HG   LYS 158          1HG       LYS 158 128.370  13.473  -3.314
  600   1HD   LYS 158          2HD       LYS 158 127.933  15.057  -1.525
  601   2HD   LYS 158          1HD       LYS 158 127.314  13.461  -1.094
  602   1HE   LYS 158          2HE       LYS 158 129.756  13.264  -0.032
  603   2HE   LYS 158          1HE       LYS 158 129.557  15.013   0.065
  604   1HZ   LYS 158          1HZ       LYS 158 128.699  13.341   1.936
  605   2HZ   LYS 158          2HZ       LYS 158 127.305  13.421   0.979
  606   3HZ   LYS 158          3HZ       LYS 158 127.966  14.835   1.629
  607    H    GLY 159           H        GLY 159 130.114  10.158  -5.640
  608   1HA   GLY 159          2HA       GLY 159 131.080  11.346  -7.487
  609   2HA   GLY 159          1HA       GLY 159 131.758  12.495  -6.344
  610    H    VAL 160           H        VAL 160 132.134   9.414  -7.893
  611    HA   VAL 160           HA       VAL 160 134.687   8.964  -6.522
  612    HB   VAL 160           HB       VAL 160 133.463   7.061  -8.500
  613   1HG1  VAL 160          1HG1      VAL 160 134.619   5.558  -6.596
  614   2HG1  VAL 160          2HG1      VAL 160 135.608   7.013  -6.474
  615   3HG1  VAL 160          3HG1      VAL 160 135.478   6.161  -8.013
  616   1HG2  VAL 160          1HG2      VAL 160 132.798   6.123  -5.959
  617   2HG2  VAL 160          2HG2      VAL 160 131.694   6.756  -7.181
  618   3HG2  VAL 160          3HG2      VAL 160 132.351   7.829  -5.945
  619    H    GLU 161           H        GLU 161 134.289  11.051  -8.553
  620    HA   GLU 161           HA       GLU 161 136.077  10.045 -10.667
  621   1HB   GLU 161          2HB       GLU 161 135.271  12.007 -11.993
  622   2HB   GLU 161          1HB       GLU 161 134.019  10.834 -11.615
  623   1HG   GLU 161          2HG       GLU 161 134.092  12.783  -9.544
  624   2HG   GLU 161          1HG       GLU 161 134.043  13.608 -11.102
  Start of MODEL    5
    1   1H    MET  81          1HT       MET  81  90.335   7.896  -0.505
    2   2H    MET  81          2HT       MET  81  90.354   8.334  -2.164
    3   3H    MET  81          3HT       MET  81  89.229   9.065  -1.093
    4    HA   MET  81           HA       MET  81  91.192  10.417  -1.734
    5   1HB   MET  81          2HB       MET  81  89.636  10.339   0.475
    6   2HB   MET  81          1HB       MET  81  91.212  10.094   1.213
    7   1HG   MET  81          2HG       MET  81  91.998  12.149   0.040
    8   2HG   MET  81          1HG       MET  81  90.335  12.417  -0.480
    9   1HE   MET  81          1HE       MET  81  88.399  13.708   1.758
   10   2HE   MET  81          2HE       MET  81  88.500  12.320   2.841
   11   3HE   MET  81          3HE       MET  81  88.476  12.077   1.093
   12    H    VAL  82           H        VAL  82  93.178   9.913  -2.421
   13    HA   VAL  82           HA       VAL  82  95.163   9.065  -0.530
   14    HB   VAL  82           HB       VAL  82  94.235   6.879  -1.157
   15   1HG1  VAL  82          1HG1      VAL  82  93.568   7.735  -3.490
   16   2HG1  VAL  82          2HG1      VAL  82  94.124   6.067  -3.336
   17   3HG1  VAL  82          3HG1      VAL  82  95.215   7.307  -3.957
   18   1HG2  VAL  82          1HG2      VAL  82  96.661   7.180  -0.660
   19   2HG2  VAL  82          2HG2      VAL  82  96.955   7.274  -2.395
   20   3HG2  VAL  82          3HG2      VAL  82  96.304   5.794  -1.691
   21    H    ARG  83           H        ARG  83  94.381   9.506  -3.963
   22    HA   ARG  83           HA       ARG  83  97.036  10.109  -4.766
   23   1HB   ARG  83          2HB       ARG  83  94.654   9.607  -6.062
   24   2HB   ARG  83          1HB       ARG  83  94.921  11.313  -6.394
   25   1HG   ARG  83          2HG       ARG  83  95.906  10.138  -8.177
   26   2HG   ARG  83          1HG       ARG  83  97.242  10.676  -7.156
   27   1HD   ARG  83          2HD       ARG  83  96.612   8.221  -6.094
   28   2HD   ARG  83          1HD       ARG  83  96.353   7.975  -7.821
   29    HE   ARG  83           HE       ARG  83  98.788   9.254  -7.581
   30   1HH1  ARG  83          1HH1      ARG  83  97.379   6.246  -6.511
   31   2HH1  ARG  83          2HH1      ARG  83  98.887   5.394  -6.513
   32   1HH2  ARG  83          1HH2      ARG  83 100.771   8.135  -7.586
   33   2HH2  ARG  83          2HH2      ARG  83 100.812   6.467  -7.123
   34    H    CYS  84           H        CYS  84  97.076  12.390  -6.149
   35    HA   CYS  84           HA       CYS  84  97.438  14.628  -5.982
   36   1HB   CYS  84          2HB       CYS  84  94.806  14.209  -5.152
   37   2HB   CYS  84          1HB       CYS  84  95.492  15.261  -3.918
   38    HG   CYS  84           HG       CYS  84  94.535  16.209  -6.515
   39    H    MET  85           H        MET  85  97.431  16.449  -3.991
   40    HA   MET  85           HA       MET  85  98.592  17.207  -2.188
   41   1HB   MET  85          2HB       MET  85  97.734  14.506  -1.391
   42   2HB   MET  85          1HB       MET  85  99.127  15.117  -0.507
   43   1HG   MET  85          2HG       MET  85  96.926  17.029  -0.783
   44   2HG   MET  85          1HG       MET  85  96.535  15.581   0.143
   45   1HE   MET  85          1HE       MET  85  98.964  14.802   2.020
   46   2HE   MET  85          2HE       MET  85  97.233  15.003   2.299
   47   3HE   MET  85          3HE       MET  85  98.396  15.824   3.341
   48    H    LYS  86           H        LYS  86  99.947  13.928  -2.207
   49    HA   LYS  86           HA       LYS  86 102.614  14.859  -2.070
   50   1HB   LYS  86          2HB       LYS  86 101.245  12.272  -2.199
   51   2HB   LYS  86          1HB       LYS  86 102.817  12.268  -2.988
   52   1HG   LYS  86          2HG       LYS  86 103.703  13.323  -0.839
   53   2HG   LYS  86          1HG       LYS  86 102.165  12.843  -0.119
   54   1HD   LYS  86          2HD       LYS  86 103.685  10.796  -1.646
   55   2HD   LYS  86          1HD       LYS  86 104.300  11.266  -0.060
   56   1HE   LYS  86          2HE       LYS  86 102.079  10.773   0.906
   57   2HE   LYS  86          1HE       LYS  86 101.538  10.222  -0.679
   58   1HZ   LYS  86          1HZ       LYS  86 103.421   8.588  -0.577
   59   2HZ   LYS  86          2HZ       LYS  86 102.166   8.314   0.524
   60   3HZ   LYS  86          3HZ       LYS  86 103.615   9.010   1.050
   61    H    ASP  87           H        ASP  87 103.561  15.940  -3.668
   62    HA   ASP  87           HA       ASP  87 102.897  15.369  -6.440
   63   1HB   ASP  87          2HB       ASP  87 104.554  17.500  -5.098
   64   2HB   ASP  87          1HB       ASP  87 104.532  17.302  -6.847
   65    H    ASP  88           H        ASP  88 105.977  15.834  -4.697
   66    HA   ASP  88           HA       ASP  88 107.406  14.291  -6.662
   67   1HB   ASP  88          2HB       ASP  88 108.119  16.283  -4.910
   68   2HB   ASP  88          1HB       ASP  88 108.794  14.851  -4.136
   69    H    SER  89           H        SER  89 107.045  12.157  -6.685
   70    HA   SER  89           HA       SER  89 106.330  10.609  -4.437
   71   1HB   SER  89          2HB       SER  89 106.090  10.134  -7.014
   72   2HB   SER  89          1HB       SER  89 107.667   9.370  -6.814
   73    HG   SER  89           HG       SER  89 105.248   8.728  -5.483
   74    H    LYS  90           H        LYS  90 107.523   9.043  -3.287
   75    HA   LYS  90           HA       LYS  90 110.271   9.811  -2.820
   76   1HB   LYS  90          2HB       LYS  90 108.332   8.977  -1.147
   77   2HB   LYS  90          1HB       LYS  90 109.134   7.441  -1.451
   78   1HG   LYS  90          2HG       LYS  90 111.242   8.354  -0.683
   79   2HG   LYS  90          1HG       LYS  90 110.494   9.936  -0.451
   80   1HD   LYS  90          2HD       LYS  90 108.893   8.790   1.147
   81   2HD   LYS  90          1HD       LYS  90 109.962   7.388   1.062
   82   1HE   LYS  90          2HE       LYS  90 111.759   8.574   2.023
   83   2HE   LYS  90          1HE       LYS  90 110.964  10.129   1.780
   84   1HZ   LYS  90          1HZ       LYS  90 109.615   8.152   3.465
   85   2HZ   LYS  90          2HZ       LYS  90 109.638   9.840   3.587
   86   3HZ   LYS  90          3HZ       LYS  90 110.970   8.938   4.105
   87    H    GLY  91           H        GLY  91 111.270   9.156  -4.770
   88   1HA   GLY  91          2HA       GLY  91 111.160   6.382  -5.576
   89   2HA   GLY  91          1HA       GLY  91 112.125   7.649  -6.319
   90    H    LYS  92           H        LYS  92 114.250   7.615  -5.985
   91    HA   LYS  92           HA       LYS  92 115.271   5.861  -3.852
   92   1HB   LYS  92          2HB       LYS  92 116.305   6.544  -6.585
   93   2HB   LYS  92          1HB       LYS  92 117.410   5.987  -5.337
   94   1HG   LYS  92          2HG       LYS  92 115.505   4.097  -5.149
   95   2HG   LYS  92          1HG       LYS  92 115.368   4.511  -6.858
   96   1HD   LYS  92          2HD       LYS  92 117.697   4.037  -7.217
   97   2HD   LYS  92          1HD       LYS  92 117.960   3.806  -5.488
   98   1HE   LYS  92          2HE       LYS  92 116.049   2.123  -7.088
   99   2HE   LYS  92          1HE       LYS  92 117.748   1.704  -6.883
  100   1HZ   LYS  92          1HZ       LYS  92 116.016   2.233  -4.551
  101   2HZ   LYS  92          2HZ       LYS  92 117.471   1.374  -4.614
  102   3HZ   LYS  92          3HZ       LYS  92 116.066   0.702  -5.271
  103    H    THR  93           H        THR  93 115.625   7.160  -2.141
  104    HA   THR  93           HA       THR  93 116.956   9.733  -2.547
  105    HB   THR  93           HB       THR  93 116.194   8.872   0.181
  106    HG1  THR  93           HG1      THR  93 114.405   8.108  -0.860
  107   1HG2  THR  93          1HG2      THR  93 116.277  11.045   0.542
  108   2HG2  THR  93          2HG2      THR  93 114.997  11.308  -0.642
  109   3HG2  THR  93          3HG2      THR  93 116.685  11.308  -1.153
  110    H    GLU  94           H        GLU  94 118.362  10.167  -0.336
  111    HA   GLU  94           HA       GLU  94 120.769   8.825  -0.743
  112   1HB   GLU  94          2HB       GLU  94 119.817  10.928   0.902
  113   2HB   GLU  94          1HB       GLU  94 120.656   9.794   1.951
  114   1HG   GLU  94          2HG       GLU  94 122.497  10.892   1.360
  115   2HG   GLU  94          1HG       GLU  94 122.380   9.995  -0.153
  116    H    GLU  95           H        GLU  95 118.013   7.915   1.115
  117    HA   GLU  95           HA       GLU  95 119.221   6.221   3.004
  118   1HB   GLU  95          2HB       GLU  95 116.612   6.976   2.312
  119   2HB   GLU  95          1HB       GLU  95 116.646   5.228   2.130
  120   1HG   GLU  95          2HG       GLU  95 116.755   4.880   4.333
  121   2HG   GLU  95          1HG       GLU  95 117.909   6.189   4.583
  122    H    GLU  96           H        GLU  96 118.578   5.814  -0.381
  123    HA   GLU  96           HA       GLU  96 118.599   2.992  -0.484
  124   1HB   GLU  96          2HB       GLU  96 118.907   3.232  -2.858
  125   2HB   GLU  96          1HB       GLU  96 117.787   4.473  -2.313
  126   1HG   GLU  96          2HG       GLU  96 119.050   5.897  -3.457
  127   2HG   GLU  96          1HG       GLU  96 120.215   5.737  -2.143
  128    H    LEU  97           H        LEU  97 121.143   5.375  -0.348
  129    HA   LEU  97           HA       LEU  97 123.297   3.894  -1.302
  130   1HB   LEU  97          2HB       LEU  97 122.974   6.179   0.565
  131   2HB   LEU  97          1HB       LEU  97 124.512   5.337   0.597
  132    HG   LEU  97           HG       LEU  97 123.489   6.145  -2.068
  133   1HD1  LEU  97          1HD1      LEU  97 124.951   8.231  -0.560
  134   2HD1  LEU  97          2HD1      LEU  97 123.233   8.039  -0.214
  135   3HD1  LEU  97          3HD1      LEU  97 123.768   8.385  -1.857
  136   1HD2  LEU  97          1HD2      LEU  97 126.060   6.872  -1.978
  137   2HD2  LEU  97          2HD2      LEU  97 125.541   5.225  -2.334
  138   3HD2  LEU  97          3HD2      LEU  97 126.066   5.650  -0.705
  139    H    SER  98           H        SER  98 121.632   3.745   1.762
  140    HA   SER  98           HA       SER  98 123.551   2.361   3.264
  141   1HB   SER  98          2HB       SER  98 121.713   1.727   4.729
  142   2HB   SER  98          1HB       SER  98 121.505   3.401   4.215
  143    HG   SER  98           HG       SER  98 119.723   2.864   3.239
  144    H    ASP  99           H        ASP  99 121.060   1.213   1.043
  145    HA   ASP  99           HA       ASP  99 121.281  -1.528   1.566
  146   1HB   ASP  99          2HB       ASP  99 119.714  -0.010  -0.062
  147   2HB   ASP  99          1HB       ASP  99 120.770  -0.781  -1.243
  148    H    LEU 100           H        LEU 100 123.111   0.579  -0.588
  149    HA   LEU 100           HA       LEU 100 124.546  -1.429  -1.941
  150   1HB   LEU 100          2HB       LEU 100 125.078   1.476  -1.402
  151   2HB   LEU 100          1HB       LEU 100 126.246   0.486  -2.255
  152    HG   LEU 100           HG       LEU 100 123.471   0.422  -3.288
  153   1HD1  LEU 100          1HD1      LEU 100 124.339   2.554  -4.649
  154   2HD1  LEU 100          2HD1      LEU 100 125.082   2.889  -3.085
  155   3HD1  LEU 100          3HD1      LEU 100 123.335   2.676  -3.204
  156   1HD2  LEU 100          1HD2      LEU 100 124.908  -0.829  -4.578
  157   2HD2  LEU 100          2HD2      LEU 100 126.259   0.280  -4.341
  158   3HD2  LEU 100          3HD2      LEU 100 124.940   0.718  -5.426
  159    H    PHE 101           H        PHE 101 125.120   0.254   1.094
  160    HA   PHE 101           HA       PHE 101 127.751  -0.765   1.490
  161   1HB   PHE 101          2HB       PHE 101 126.993   1.281   2.599
  162   2HB   PHE 101          1HB       PHE 101 125.772   0.366   3.481
  163    HD1  PHE 101           HD1      PHE 101 126.419  -1.157   5.278
  164    HD2  PHE 101           HD2      PHE 101 129.291   1.246   3.257
  165    HE1  PHE 101           HE1      PHE 101 128.033  -1.571   7.088
  166    HE2  PHE 101           HE2      PHE 101 130.912   0.836   5.064
  167    HZ   PHE 101           HZ       PHE 101 130.283  -0.575   6.981
  168    H    ARG 102           H        ARG 102 124.531  -1.875   2.292
  169    HA   ARG 102           HA       ARG 102 125.191  -3.812   4.209
  170   1HB   ARG 102          2HB       ARG 102 122.913  -3.664   2.234
  171   2HB   ARG 102          1HB       ARG 102 123.025  -4.894   3.485
  172   1HG   ARG 102          2HG       ARG 102 122.941  -1.927   3.992
  173   2HG   ARG 102          1HG       ARG 102 121.557  -3.016   4.099
  174   1HD   ARG 102          2HD       ARG 102 124.079  -3.202   5.744
  175   2HD   ARG 102          1HD       ARG 102 122.535  -2.560   6.301
  176    HE   ARG 102           HE       ARG 102 122.220  -5.195   5.311
  177   1HH1  ARG 102          1HH1      ARG 102 123.460  -3.424   8.051
  178   2HH1  ARG 102          2HH1      ARG 102 123.208  -4.726   9.165
  179   1HH2  ARG 102          1HH2      ARG 102 121.886  -6.908   6.776
  180   2HH2  ARG 102          2HH2      ARG 102 122.315  -6.702   8.441
  181    H    MET 103           H        MET 103 124.686  -4.173   0.698
  182    HA   MET 103           HA       MET 103 125.251  -6.888   0.507
  183   1HB   MET 103          2HB       MET 103 125.886  -6.367  -1.874
  184   2HB   MET 103          1HB       MET 103 124.304  -5.783  -1.376
  185   1HG   MET 103          2HG       MET 103 125.194  -3.545  -1.097
  186   2HG   MET 103          1HG       MET 103 126.803  -4.116  -1.528
  187   1HE   MET 103          1HE       MET 103 123.817  -5.753  -3.486
  188   2HE   MET 103          2HE       MET 103 123.314  -4.413  -4.515
  189   3HE   MET 103          3HE       MET 103 123.124  -4.300  -2.766
  190    H    PHE 104           H        PHE 104 127.449  -4.118   0.324
  191    HA   PHE 104           HA       PHE 104 129.792  -5.492  -0.309
  192   1HB   PHE 104          2HB       PHE 104 129.101  -2.858   0.796
  193   2HB   PHE 104          1HB       PHE 104 130.690  -3.442   1.279
  194    HD1  PHE 104           HD1      PHE 104 132.434  -2.764  -0.030
  195    HD2  PHE 104           HD2      PHE 104 128.620  -3.331  -1.830
  196    HE1  PHE 104           HE1      PHE 104 133.355  -2.050  -2.197
  197    HE2  PHE 104           HE2      PHE 104 129.534  -2.619  -4.002
  198    HZ   PHE 104           HZ       PHE 104 131.904  -1.977  -4.186
  199    H    ASP 105           H        ASP 105 128.234  -4.927   2.800
  200    HA   ASP 105           HA       ASP 105 130.368  -5.955   4.380
  201   1HB   ASP 105          2HB       ASP 105 128.109  -4.542   4.937
  202   2HB   ASP 105          1HB       ASP 105 127.635  -6.148   5.480
  203    H    LYS 106           H        LYS 106 130.349  -7.933   5.612
  204    HA   LYS 106           HA       LYS 106 129.198 -10.144   4.073
  205   1HB   LYS 106          2HB       LYS 106 131.692  -9.984   4.639
  206   2HB   LYS 106          1HB       LYS 106 131.225 -10.385   6.287
  207   1HG   LYS 106          2HG       LYS 106 131.856 -12.417   5.319
  208   2HG   LYS 106          1HG       LYS 106 130.092 -12.435   5.304
  209   1HD   LYS 106          2HD       LYS 106 130.712 -11.257   2.898
  210   2HD   LYS 106          1HD       LYS 106 131.988 -12.460   3.084
  211   1HE   LYS 106          2HE       LYS 106 130.525 -14.222   3.018
  212   2HE   LYS 106          1HE       LYS 106 129.181 -13.270   3.648
  213   1HZ   LYS 106          1HZ       LYS 106 128.669 -12.457   1.594
  214   2HZ   LYS 106          2HZ       LYS 106 129.266 -13.975   1.149
  215   3HZ   LYS 106          3HZ       LYS 106 130.246 -12.605   0.999
  216    H    ASN 107           H        ASN 107 129.720  -9.270   7.493
  217    HA   ASN 107           HA       ASN 107 127.498 -11.021   8.240
  218   1HB   ASN 107          2HB       ASN 107 128.301 -10.529  10.590
  219   2HB   ASN 107          1HB       ASN 107 129.438 -11.400   9.565
  220   1HD2  ASN 107          1HD2      ASN 107 130.980 -10.625  11.174
  221   2HD2  ASN 107          2HD2      ASN 107 131.667  -9.052  10.976
  222    H    ALA 108           H        ALA 108 127.970  -7.814   7.460
  223    HA   ALA 108           HA       ALA 108 126.687  -5.948   7.660
  224   1HB   ALA 108          1HB       ALA 108 124.706  -6.863   7.056
  225   2HB   ALA 108          2HB       ALA 108 124.302  -6.511   8.736
  226   3HB   ALA 108          3HB       ALA 108 124.799  -8.138   8.272
  227    H    ASP 109           H        ASP 109 128.502  -5.847   9.460
  228    HA   ASP 109           HA       ASP 109 127.298  -5.603  12.115
  229   1HB   ASP 109          2HB       ASP 109 129.705  -5.218  12.826
  230   2HB   ASP 109          1HB       ASP 109 129.343  -6.813  12.173
  231    H    GLY 110           H        GLY 110 128.459  -3.689   9.477
  232   1HA   GLY 110          2HA       GLY 110 127.475  -1.382   9.533
  233   2HA   GLY 110          1HA       GLY 110 128.177  -1.263  11.140
  234    H    TYR 111           H        TYR 111 130.549  -2.861  10.003
  235    HA   TYR 111           HA       TYR 111 131.793  -0.669   8.486
  236   1HB   TYR 111          2HB       TYR 111 133.118  -2.231  10.712
  237   2HB   TYR 111          1HB       TYR 111 133.856  -0.949   9.759
  238    HD1  TYR 111           HD1      TYR 111 132.570  -1.610  12.856
  239    HD2  TYR 111           HD2      TYR 111 132.208   1.267   9.744
  240    HE1  TYR 111           HE1      TYR 111 131.781   0.049  14.490
  241    HE2  TYR 111           HE2      TYR 111 131.419   2.936  11.369
  242    HH   TYR 111           HH       TYR 111 131.501   3.378  13.741
  243    H    ILE 112           H        ILE 112 133.595  -1.295   7.158
  244    HA   ILE 112           HA       ILE 112 133.709  -4.177   6.561
  245    HB   ILE 112           HB       ILE 112 133.742  -2.010   4.460
  246   1HG1  ILE 112          2HG1      ILE 112 131.496  -3.963   4.784
  247   2HG1  ILE 112          1HG1      ILE 112 131.524  -2.515   5.784
  248   1HG2  ILE 112          1HG2      ILE 112 134.960  -3.929   3.745
  249   2HG2  ILE 112          2HG2      ILE 112 133.393  -3.963   2.936
  250   3HG2  ILE 112          3HG2      ILE 112 133.696  -5.017   4.318
  251   1HD1  ILE 112          1HD1      ILE 112 131.476  -1.111   3.843
  252   2HD1  ILE 112          2HD1      ILE 112 130.168  -2.288   3.734
  253   3HD1  ILE 112          3HD1      ILE 112 131.635  -2.509   2.779
  254    H    ASP 113           H        ASP 113 135.696  -4.995   6.037
  255    HA   ASP 113           HA       ASP 113 137.944  -3.109   5.868
  256   1HB   ASP 113          2HB       ASP 113 139.284  -4.555   7.333
  257   2HB   ASP 113          1HB       ASP 113 137.855  -3.955   8.169
  258    H    LEU 114           H        LEU 114 140.032  -4.626   5.434
  259    HA   LEU 114           HA       LEU 114 139.782  -5.511   2.801
  260   1HB   LEU 114          2HB       LEU 114 141.863  -5.741   4.913
  261   2HB   LEU 114          1HB       LEU 114 142.016  -6.779   3.507
  262    HG   LEU 114           HG       LEU 114 141.645  -3.820   3.177
  263   1HD1  LEU 114          1HD1      LEU 114 144.290  -5.220   3.539
  264   2HD1  LEU 114          2HD1      LEU 114 143.527  -4.168   4.733
  265   3HD1  LEU 114          3HD1      LEU 114 144.036  -3.512   3.177
  266   1HD2  LEU 114          1HD2      LEU 114 143.150  -5.809   1.491
  267   2HD2  LEU 114          2HD2      LEU 114 142.644  -4.177   1.055
  268   3HD2  LEU 114          3HD2      LEU 114 141.439  -5.446   1.265
  269    H    GLU 115           H        GLU 115 139.823  -7.344   5.830
  270    HA   GLU 115           HA       GLU 115 139.779  -9.912   4.689
  271   1HB   GLU 115          2HB       GLU 115 139.960  -8.930   7.228
  272   2HB   GLU 115          1HB       GLU 115 138.333  -9.598   7.233
  273   1HG   GLU 115          2HG       GLU 115 139.175 -11.763   6.593
  274   2HG   GLU 115          1HG       GLU 115 140.807 -11.115   6.434
  275    H    GLU 116           H        GLU 116 137.102  -7.959   6.004
  276    HA   GLU 116           HA       GLU 116 135.045  -9.724   5.300
  277   1HB   GLU 116          2HB       GLU 116 135.276  -7.013   6.306
  278   2HB   GLU 116          1HB       GLU 116 133.944  -7.156   5.168
  279   1HG   GLU 116          2HG       GLU 116 132.692  -8.066   6.740
  280   2HG   GLU 116          1HG       GLU 116 133.839  -9.394   6.899
  281    H    LEU 117           H        LEU 117 136.690  -7.227   3.472
  282    HA   LEU 117           HA       LEU 117 134.834  -7.307   1.273
  283   1HB   LEU 117          2HB       LEU 117 136.500  -5.412   2.089
  284   2HB   LEU 117          1HB       LEU 117 137.589  -6.214   0.975
  285    HG   LEU 117           HG       LEU 117 135.909  -5.891  -0.833
  286   1HD1  LEU 117          1HD1      LEU 117 134.111  -4.238  -0.430
  287   2HD1  LEU 117          2HD1      LEU 117 134.488  -4.296   1.291
  288   3HD1  LEU 117          3HD1      LEU 117 133.893  -5.739   0.469
  289   1HD2  LEU 117          1HD2      LEU 117 137.357  -3.752   0.576
  290   2HD2  LEU 117          2HD2      LEU 117 136.124  -3.212  -0.564
  291   3HD2  LEU 117          3HD2      LEU 117 137.435  -4.259  -1.111
  292    H    LYS 118           H        LYS 118 137.806  -8.897   2.150
  293    HA   LYS 118           HA       LYS 118 138.520  -9.843  -0.420
  294   1HB   LYS 118          2HB       LYS 118 140.002  -9.758   1.627
  295   2HB   LYS 118          1HB       LYS 118 139.148 -11.179   2.212
  296   1HG   LYS 118          2HG       LYS 118 140.083 -12.563   0.646
  297   2HG   LYS 118          1HG       LYS 118 140.354 -11.254  -0.506
  298   1HD   LYS 118          2HD       LYS 118 142.493 -11.396   0.167
  299   2HD   LYS 118          1HD       LYS 118 141.934 -10.480   1.569
  300   1HE   LYS 118          2HE       LYS 118 141.323 -12.984   2.354
  301   2HE   LYS 118          1HE       LYS 118 142.727 -13.312   1.340
  302   1HZ   LYS 118          1HZ       LYS 118 143.030 -12.770   3.844
  303   2HZ   LYS 118          2HZ       LYS 118 142.865 -11.163   3.341
  304   3HZ   LYS 118          3HZ       LYS 118 144.107 -12.123   2.712
  305    H    ILE 119           H        ILE 119 136.258 -10.948   1.986
  306    HA   ILE 119           HA       ILE 119 135.955 -13.596   0.973
  307    HB   ILE 119           HB       ILE 119 133.969 -12.021   2.614
  308   1HG1  ILE 119          2HG1      ILE 119 135.936 -13.963   3.774
  309   2HG1  ILE 119          1HG1      ILE 119 136.437 -12.304   3.464
  310   1HG2  ILE 119          1HG2      ILE 119 134.373 -14.983   2.221
  311   2HG2  ILE 119          2HG2      ILE 119 133.015 -14.016   1.644
  312   3HG2  ILE 119          3HG2      ILE 119 133.253 -14.257   3.376
  313   1HD1  ILE 119          1HD1      ILE 119 135.759 -12.396   5.714
  314   2HD1  ILE 119          2HD1      ILE 119 134.281 -13.271   5.312
  315   3HD1  ILE 119          3HD1      ILE 119 134.461 -11.579   4.845
  316    H    MET 120           H        MET 120 133.911 -10.680   0.731
  317    HA   MET 120           HA       MET 120 131.973 -11.766  -0.962
  318   1HB   MET 120          2HB       MET 120 131.415  -9.433  -1.531
  319   2HB   MET 120          1HB       MET 120 131.628  -9.658   0.199
  320   1HG   MET 120          2HG       MET 120 133.430  -8.315   0.293
  321   2HG   MET 120          1HG       MET 120 134.028  -8.825  -1.285
  322   1HE   MET 120          1HE       MET 120 132.307  -6.650  -3.808
  323   2HE   MET 120          2HE       MET 120 132.881  -8.276  -3.434
  324   3HE   MET 120          3HE       MET 120 133.987  -6.905  -3.334
  325    H    LEU 121           H        LEU 121 135.151 -10.504  -1.643
  326    HA   LEU 121           HA       LEU 121 134.762 -10.276  -4.473
  327   1HB   LEU 121          2HB       LEU 121 136.987  -9.934  -2.570
  328   2HB   LEU 121          1HB       LEU 121 137.458 -10.439  -4.180
  329    HG   LEU 121           HG       LEU 121 135.721  -8.375  -4.708
  330   1HD1  LEU 121          1HD1      LEU 121 137.307  -7.687  -2.239
  331   2HD1  LEU 121          2HD1      LEU 121 135.550  -7.732  -2.391
  332   3HD1  LEU 121          3HD1      LEU 121 136.479  -6.518  -3.270
  333   1HD2  LEU 121          1HD2      LEU 121 138.064  -7.091  -4.791
  334   2HD2  LEU 121          2HD2      LEU 121 137.594  -8.306  -5.979
  335   3HD2  LEU 121          3HD2      LEU 121 138.654  -8.746  -4.641
  336    H    GLN 122           H        GLN 122 135.890 -12.755  -2.277
  337    HA   GLN 122           HA       GLN 122 137.100 -14.467  -4.153
  338   1HB   GLN 122          2HB       GLN 122 135.918 -14.845  -1.426
  339   2HB   GLN 122          1HB       GLN 122 136.399 -16.251  -2.368
  340   1HG   GLN 122          2HG       GLN 122 138.429 -14.156  -2.264
  341   2HG   GLN 122          1HG       GLN 122 138.014 -14.828  -0.689
  342   1HE2  GLN 122          1HE2      GLN 122 139.810 -15.234  -3.495
  343   2HE2  GLN 122          2HE2      GLN 122 140.336 -16.858  -3.232
  344    H    ALA 123           H        ALA 123 133.767 -13.936  -3.269
  345    HA   ALA 123           HA       ALA 123 132.615 -16.279  -4.262
  346   1HB   ALA 123          1HB       ALA 123 131.083 -13.789  -4.649
  347   2HB   ALA 123          2HB       ALA 123 131.651 -14.102  -3.009
  348   3HB   ALA 123          3HB       ALA 123 130.635 -15.286  -3.832
  349    H    THR 124           H        THR 124 133.723 -13.387  -5.895
  350    HA   THR 124           HA       THR 124 132.432 -13.727  -8.356
  351    HB   THR 124           HB       THR 124 134.087 -12.229  -9.269
  352    HG1  THR 124           HG1      THR 124 136.034 -12.782  -8.632
  353   1HG2  THR 124          1HG2      THR 124 133.169 -10.566  -8.149
  354   2HG2  THR 124          2HG2      THR 124 134.314 -10.839  -6.837
  355   3HG2  THR 124          3HG2      THR 124 132.748 -11.650  -6.824
  356    H    GLY 125           H        GLY 125 133.924 -14.046 -10.427
  357   1HA   GLY 125          2HA       GLY 125 134.811 -16.808 -10.258
  358   2HA   GLY 125          1HA       GLY 125 134.598 -15.867 -11.727
  359    H    GLU 126           H        GLU 126 136.216 -13.635 -10.721
  360    HA   GLU 126           HA       GLU 126 138.802 -14.720 -11.446
  361   1HB   GLU 126          2HB       GLU 126 138.012 -11.870 -10.823
  362   2HB   GLU 126          1HB       GLU 126 139.527 -12.389 -11.549
  363   1HG   GLU 126          2HG       GLU 126 137.290 -13.389 -13.053
  364   2HG   GLU 126          1HG       GLU 126 137.179 -11.640 -12.854
  365    H    THR 127           H        THR 127 140.458 -15.098 -10.105
  366    HA   THR 127           HA       THR 127 140.030 -14.896  -7.268
  367    HB   THR 127           HB       THR 127 142.230 -15.989  -7.085
  368    HG1  THR 127           HG1      THR 127 142.287 -15.884  -9.916
  369   1HG2  THR 127          1HG2      THR 127 141.275 -17.651  -9.238
  370   2HG2  THR 127          2HG2      THR 127 139.960 -17.132  -8.183
  371   3HG2  THR 127          3HG2      THR 127 141.355 -17.976  -7.506
  372    H    ILE 128           H        ILE 128 139.967 -12.710  -6.776
  373    HA   ILE 128           HA       ILE 128 142.125 -10.956  -7.551
  374    HB   ILE 128           HB       ILE 128 139.954 -10.401  -5.532
  375   1HG1  ILE 128          2HG1      ILE 128 138.937 -11.104  -7.645
  376   2HG1  ILE 128          1HG1      ILE 128 138.700  -9.378  -7.387
  377   1HG2  ILE 128          1HG2      ILE 128 140.373  -8.045  -6.250
  378   2HG2  ILE 128          2HG2      ILE 128 141.763  -8.630  -7.163
  379   3HG2  ILE 128          3HG2      ILE 128 141.724  -8.804  -5.409
  380   1HD1  ILE 128          1HD1      ILE 128 139.993 -10.755  -9.557
  381   2HD1  ILE 128          2HD1      ILE 128 141.068  -9.561  -8.828
  382   3HD1  ILE 128          3HD1      ILE 128 139.485  -9.071  -9.432
  383    H    THR 129           H        THR 129 143.485  -9.824  -6.043
  384    HA   THR 129           HA       THR 129 144.171 -11.485  -3.718
  385    HB   THR 129           HB       THR 129 146.372 -10.239  -3.838
  386    HG1  THR 129           HG1      THR 129 146.042  -8.496  -5.047
  387   1HG2  THR 129          1HG2      THR 129 146.821 -12.232  -4.756
  388   2HG2  THR 129          2HG2      THR 129 146.860 -11.312  -6.260
  389   3HG2  THR 129          3HG2      THR 129 145.400 -12.192  -5.800
  390    H    GLU 130           H        GLU 130 145.293 -10.128  -1.929
  391    HA   GLU 130           HA       GLU 130 143.349  -8.395  -0.840
  392   1HB   GLU 130          2HB       GLU 130 145.497  -9.791   0.150
  393   2HB   GLU 130          1HB       GLU 130 146.053  -8.127   0.272
  394   1HG   GLU 130          2HG       GLU 130 143.704  -7.743   1.356
  395   2HG   GLU 130          1HG       GLU 130 143.789  -9.479   1.650
  396    H    ASP 131           H        ASP 131 146.235  -7.837  -2.722
  397    HA   ASP 131           HA       ASP 131 146.538  -5.083  -2.171
  398   1HB   ASP 131          2HB       ASP 131 147.701  -7.041  -3.974
  399   2HB   ASP 131          1HB       ASP 131 147.493  -5.482  -4.764
  400    H    ASP 132           H        ASP 132 144.900  -6.808  -4.811
  401    HA   ASP 132           HA       ASP 132 144.034  -4.537  -6.214
  402   1HB   ASP 132          2HB       ASP 132 143.272  -7.411  -6.147
  403   2HB   ASP 132          1HB       ASP 132 142.126  -6.293  -6.878
  404    H    ILE 133           H        ILE 133 142.641  -6.291  -3.504
  405    HA   ILE 133           HA       ILE 133 140.133  -4.920  -3.555
  406    HB   ILE 133           HB       ILE 133 141.384  -6.368  -1.218
  407   1HG1  ILE 133          2HG1      ILE 133 139.392  -7.620  -3.074
  408   2HG1  ILE 133          1HG1      ILE 133 141.093  -7.603  -3.524
  409   1HG2  ILE 133          1HG2      ILE 133 139.077  -6.672  -0.483
  410   2HG2  ILE 133          2HG2      ILE 133 138.504  -5.768  -1.886
  411   3HG2  ILE 133          3HG2      ILE 133 139.471  -4.961  -0.650
  412   1HD1  ILE 133          1HD1      ILE 133 141.696  -8.994  -1.781
  413   2HD1  ILE 133          2HD1      ILE 133 140.136  -9.643  -2.282
  414   3HD1  ILE 133          3HD1      ILE 133 140.247  -8.623  -0.849
  415    H    GLU 134           H        GLU 134 143.245  -4.349  -2.084
  416    HA   GLU 134           HA       GLU 134 142.523  -2.544  -0.080
  417   1HB   GLU 134          2HB       GLU 134 144.998  -3.085  -1.642
  418   2HB   GLU 134          1HB       GLU 134 144.922  -1.582  -0.731
  419   1HG   GLU 134          2HG       GLU 134 144.351  -2.941   1.290
  420   2HG   GLU 134          1HG       GLU 134 144.691  -4.383   0.335
  421    H    GLU 135           H        GLU 135 142.680  -2.155  -3.523
  422    HA   GLU 135           HA       GLU 135 142.989   0.605  -3.745
  423   1HB   GLU 135          2HB       GLU 135 141.778  -1.524  -5.431
  424   2HB   GLU 135          1HB       GLU 135 141.376   0.140  -5.830
  425   1HG   GLU 135          2HG       GLU 135 143.810   0.635  -5.940
  426   2HG   GLU 135          1HG       GLU 135 144.121  -1.086  -5.713
  427    H    LEU 136           H        LEU 136 140.012  -1.305  -3.395
  428    HA   LEU 136           HA       LEU 136 138.239   0.889  -3.462
  429   1HB   LEU 136          2HB       LEU 136 138.097  -1.967  -2.740
  430   2HB   LEU 136          1HB       LEU 136 136.897  -0.943  -1.972
  431    HG   LEU 136           HG       LEU 136 137.226  -0.632  -4.903
  432   1HD1  LEU 136          1HD1      LEU 136 137.181  -3.179  -4.069
  433   2HD1  LEU 136          2HD1      LEU 136 136.398  -2.629  -5.550
  434   3HD1  LEU 136          3HD1      LEU 136 135.450  -2.838  -4.077
  435   1HD2  LEU 136          1HD2      LEU 136 135.113   0.159  -4.799
  436   2HD2  LEU 136          2HD2      LEU 136 135.528   0.402  -3.101
  437   3HD2  LEU 136          3HD2      LEU 136 134.612  -1.025  -3.590
  438    H    MET 137           H        MET 137 140.118  -0.568  -0.903
  439    HA   MET 137           HA       MET 137 138.743   0.824   1.212
  440   1HB   MET 137          2HB       MET 137 141.196  -0.906   1.073
  441   2HB   MET 137          1HB       MET 137 140.811  -0.007   2.534
  442   1HG   MET 137          2HG       MET 137 138.583  -1.559   1.439
  443   2HG   MET 137          1HG       MET 137 139.960  -2.521   1.976
  444   1HE   MET 137          1HE       MET 137 136.742  -2.380   3.888
  445   2HE   MET 137          2HE       MET 137 136.883  -1.249   2.544
  446   3HE   MET 137          3HE       MET 137 136.682  -0.644   4.188
  447    H    LYS 138           H        LYS 138 141.565   1.340  -0.780
  448    HA   LYS 138           HA       LYS 138 142.836   3.311   0.767
  449   1HB   LYS 138          2HB       LYS 138 143.521   2.016  -1.468
  450   2HB   LYS 138          1HB       LYS 138 142.950   3.509  -2.199
  451   1HG   LYS 138          2HG       LYS 138 144.790   3.823   0.079
  452   2HG   LYS 138          1HG       LYS 138 145.478   3.106  -1.380
  453   1HD   LYS 138          2HD       LYS 138 144.574   5.024  -2.680
  454   2HD   LYS 138          1HD       LYS 138 144.053   5.756  -1.161
  455   1HE   LYS 138          2HE       LYS 138 146.242   6.101  -0.437
  456   2HE   LYS 138          1HE       LYS 138 146.903   4.928  -1.575
  457   1HZ   LYS 138          1HZ       LYS 138 146.955   6.432  -3.232
  458   2HZ   LYS 138          2HZ       LYS 138 146.997   7.550  -1.963
  459   3HZ   LYS 138          3HZ       LYS 138 145.534   7.210  -2.743
  460    H    ASP 139           H        ASP 139 140.740   3.726  -2.092
  461    HA   ASP 139           HA       ASP 139 140.445   6.540  -1.567
  462   1HB   ASP 139          2HB       ASP 139 139.190   6.635  -3.592
  463   2HB   ASP 139          1HB       ASP 139 140.520   5.517  -3.871
  464    H    GLY 140           H        GLY 140 138.822   3.690  -0.599
  465   1HA   GLY 140          2HA       GLY 140 136.229   4.859  -0.221
  466   2HA   GLY 140          1HA       GLY 140 136.776   3.311   0.404
  467    H    ASP 141           H        ASP 141 139.133   4.622   1.686
  468    HA   ASP 141           HA       ASP 141 137.719   5.521   4.084
  469   1HB   ASP 141          2HB       ASP 141 139.532   3.659   4.026
  470   2HB   ASP 141          1HB       ASP 141 140.675   4.997   3.938
  471    H    LYS 142           H        LYS 142 137.809   7.549   4.830
  472    HA   LYS 142           HA       LYS 142 139.593   9.436   3.436
  473   1HB   LYS 142          2HB       LYS 142 137.012  10.123   4.843
  474   2HB   LYS 142          1HB       LYS 142 137.960  11.154   3.779
  475   1HG   LYS 142          2HG       LYS 142 136.678   8.603   2.847
  476   2HG   LYS 142          1HG       LYS 142 135.856  10.164   2.804
  477   1HD   LYS 142          2HD       LYS 142 138.571   9.893   1.589
  478   2HD   LYS 142          1HD       LYS 142 137.161   9.300   0.709
  479   1HE   LYS 142          2HE       LYS 142 136.279  11.736   1.479
  480   2HE   LYS 142          1HE       LYS 142 138.005  12.058   1.305
  481   1HZ   LYS 142          1HZ       LYS 142 137.922  11.793  -0.915
  482   2HZ   LYS 142          2HZ       LYS 142 136.289  12.184  -0.711
  483   3HZ   LYS 142          3HZ       LYS 142 136.759  10.566  -0.855
  484    H    ASN 143           H        ASN 143 138.478   8.273   6.526
  485    HA   ASN 143           HA       ASN 143 139.939  10.325   7.979
  486   1HB   ASN 143          2HB       ASN 143 138.235   8.008   8.902
  487   2HB   ASN 143          1HB       ASN 143 139.063   9.108  10.000
  488   1HD2  ASN 143          1HD2      ASN 143 138.668  11.519   9.215
  489   2HD2  ASN 143          2HD2      ASN 143 136.998  11.912   9.015
  490    H    ASN 144           H        ASN 144 140.753   7.495   6.488
  491    HA   ASN 144           HA       ASN 144 142.543   6.101   6.592
  492   1HB   ASN 144          2HB       ASN 144 143.547   8.366   8.313
  493   2HB   ASN 144          1HB       ASN 144 144.538   6.961   7.937
  494   1HD2  ASN 144          1HD2      ASN 144 142.629   9.520   6.424
  495   2HD2  ASN 144          2HD2      ASN 144 143.617   9.666   5.015
  496    H    ASP 145           H        ASP 145 140.334   5.760   8.452
  497    HA   ASP 145           HA       ASP 145 141.430   4.929  10.973
  498   1HB   ASP 145          2HB       ASP 145 139.164   4.095  11.435
  499   2HB   ASP 145          1HB       ASP 145 139.125   5.745  10.820
  500    H    GLY 146           H        GLY 146 140.736   3.430   7.905
  501   1HA   GLY 146          2HA       GLY 146 142.104   1.431   7.421
  502   2HA   GLY 146          1HA       GLY 146 141.664   0.855   9.022
  503    H    ARG 147           H        ARG 147 138.876   1.873   8.635
  504    HA   ARG 147           HA       ARG 147 137.933  -0.125   6.689
  505   1HB   ARG 147          2HB       ARG 147 136.678   0.424   9.385
  506   2HB   ARG 147          1HB       ARG 147 136.143  -0.763   8.204
  507   1HG   ARG 147          2HG       ARG 147 138.203  -2.015   8.496
  508   2HG   ARG 147          1HG       ARG 147 138.786  -0.809   9.645
  509   1HD   ARG 147          2HD       ARG 147 136.477  -1.374  10.824
  510   2HD   ARG 147          1HD       ARG 147 136.699  -2.899   9.968
  511    HE   ARG 147           HE       ARG 147 139.083  -2.243  11.297
  512   1HH1  ARG 147          1HH1      ARG 147 135.816  -3.250  12.000
  513   2HH1  ARG 147          2HH1      ARG 147 136.246  -4.049  13.476
  514   1HH2  ARG 147          1HH2      ARG 147 139.651  -3.292  13.237
  515   2HH2  ARG 147          2HH2      ARG 147 138.424  -4.072  14.179
  516    H    ILE 148           H        ILE 148 135.391   0.225   6.470
  517    HA   ILE 148           HA       ILE 148 134.959   3.114   6.077
  518    HB   ILE 148           HB       ILE 148 133.846   0.919   4.332
  519   1HG1  ILE 148          2HG1      ILE 148 135.996   2.848   3.503
  520   2HG1  ILE 148          1HG1      ILE 148 136.408   1.333   4.298
  521   1HG2  ILE 148          1HG2      ILE 148 133.897   3.915   3.995
  522   2HG2  ILE 148          2HG2      ILE 148 132.487   2.938   4.404
  523   3HG2  ILE 148          3HG2      ILE 148 133.257   2.758   2.827
  524   1HD1  ILE 148          1HD1      ILE 148 134.848   0.340   2.416
  525   2HD1  ILE 148          2HD1      ILE 148 136.552   0.686   2.129
  526   3HD1  ILE 148          3HD1      ILE 148 135.318   1.823   1.589
  527    H    ASP 149           H        ASP 149 132.855   3.911   6.374
  528    HA   ASP 149           HA       ASP 149 130.923   2.069   7.597
  529   1HB   ASP 149          2HB       ASP 149 130.427   3.692   9.359
  530   2HB   ASP 149          1HB       ASP 149 132.124   3.227   9.413
  531    H    TYR 150           H        TYR 150 128.871   3.710   8.139
  532    HA   TYR 150           HA       TYR 150 127.741   4.200   5.607
  533   1HB   TYR 150          2HB       TYR 150 126.538   3.683   7.802
  534   2HB   TYR 150          1HB       TYR 150 126.736   5.390   8.187
  535    HD1  TYR 150           HD1      TYR 150 125.908   3.775   4.932
  536    HD2  TYR 150           HD2      TYR 150 124.589   6.284   8.105
  537    HE1  TYR 150           HE1      TYR 150 123.865   4.293   3.665
  538    HE2  TYR 150           HE2      TYR 150 122.541   6.807   6.847
  539    HH   TYR 150           HH       TYR 150 121.818   6.824   4.430
  540    H    ASP 151           H        ASP 151 128.982   6.420   8.088
  541    HA   ASP 151           HA       ASP 151 128.351   8.816   6.802
  542   1HB   ASP 151          2HB       ASP 151 130.752   8.300   8.570
  543   2HB   ASP 151          1HB       ASP 151 129.997   9.858   8.250
  544    H    GLU 152           H        GLU 152 131.329   6.879   6.656
  545    HA   GLU 152           HA       GLU 152 132.675   8.607   4.856
  546   1HB   GLU 152          2HB       GLU 152 133.090   5.705   5.570
  547   2HB   GLU 152          1HB       GLU 152 134.148   6.583   4.474
  548   1HG   GLU 152          2HG       GLU 152 133.742   8.014   6.956
  549   2HG   GLU 152          1HG       GLU 152 134.386   6.395   7.223
  550    H    PHE 153           H        PHE 153 130.819   5.617   4.388
  551    HA   PHE 153           HA       PHE 153 131.220   5.346   1.635
  552   1HB   PHE 153          2HB       PHE 153 130.106   3.728   3.329
  553   2HB   PHE 153          1HB       PHE 153 128.622   4.599   2.952
  554    HD1  PHE 153           HD1      PHE 153 127.841   4.665   0.557
  555    HD2  PHE 153           HD2      PHE 153 130.927   2.064   1.905
  556    HE1  PHE 153           HE1      PHE 153 127.521   3.258  -1.438
  557    HE2  PHE 153           HE2      PHE 153 130.615   0.653  -0.085
  558    HZ   PHE 153           HZ       PHE 153 128.910   1.249  -1.760
  559    H    LEU 154           H        LEU 154 128.949   7.311   3.451
  560    HA   LEU 154           HA       LEU 154 127.276   8.036   1.295
  561   1HB   LEU 154          2HB       LEU 154 127.478   8.615   4.059
  562   2HB   LEU 154          1HB       LEU 154 127.454  10.153   3.218
  563    HG   LEU 154           HG       LEU 154 125.207   9.457   3.892
  564   1HD1  LEU 154          1HD1      LEU 154 124.112   9.685   1.701
  565   2HD1  LEU 154          2HD1      LEU 154 125.666   9.410   0.912
  566   3HD1  LEU 154          3HD1      LEU 154 125.427  10.839   1.918
  567   1HD2  LEU 154          1HD2      LEU 154 124.976   7.206   3.918
  568   2HD2  LEU 154          2HD2      LEU 154 126.025   6.969   2.521
  569   3HD2  LEU 154          3HD2      LEU 154 124.354   7.488   2.292
  570    H    GLU 155           H        GLU 155 130.340   9.252   2.449
  571    HA   GLU 155           HA       GLU 155 130.243  11.576   0.713
  572   1HB   GLU 155          2HB       GLU 155 132.214  10.532   2.725
  573   2HB   GLU 155          1HB       GLU 155 132.672  11.803   1.598
  574   1HG   GLU 155          2HG       GLU 155 130.181  12.511   2.759
  575   2HG   GLU 155          1HG       GLU 155 131.276  12.025   4.052
  576    H    PHE 156           H        PHE 156 131.820   8.439   0.876
  577    HA   PHE 156           HA       PHE 156 133.658   8.825  -1.223
  578   1HB   PHE 156          2HB       PHE 156 133.840   6.974   0.380
  579   2HB   PHE 156          1HB       PHE 156 132.364   6.264  -0.263
  580    HD1  PHE 156           HD1      PHE 156 132.726   4.414  -1.555
  581    HD2  PHE 156           HD2      PHE 156 135.545   7.598  -1.702
  582    HE1  PHE 156           HE1      PHE 156 134.049   3.162  -3.207
  583    HE2  PHE 156           HE2      PHE 156 136.872   6.352  -3.357
  584    HZ   PHE 156           HZ       PHE 156 136.123   4.129  -4.111
  585    H    MET 157           H        MET 157 130.267   8.014  -1.180
  586    HA   MET 157           HA       MET 157 130.235   7.294  -3.988
  587   1HB   MET 157          2HB       MET 157 128.295   7.242  -1.745
  588   2HB   MET 157          1HB       MET 157 127.624   7.461  -3.355
  589   1HG   MET 157          2HG       MET 157 129.605   5.308  -3.100
  590   2HG   MET 157          1HG       MET 157 128.102   5.068  -2.212
  591   1HE   MET 157          1HE       MET 157 127.798   2.780  -5.198
  592   2HE   MET 157          2HE       MET 157 128.988   3.141  -3.948
  593   3HE   MET 157          3HE       MET 157 129.297   3.608  -5.619
  594    H    LYS 158           H        LYS 158 128.965   9.895  -1.930
  595    HA   LYS 158           HA       LYS 158 128.065  11.405  -4.228
  596   1HB   LYS 158          2HB       LYS 158 127.122  11.283  -1.727
  597   2HB   LYS 158          1HB       LYS 158 128.206  12.653  -1.534
  598   1HG   LYS 158          2HG       LYS 158 126.979  13.456  -3.741
  599   2HG   LYS 158          1HG       LYS 158 125.706  12.412  -3.105
  600   1HD   LYS 158          2HD       LYS 158 125.297  13.765  -1.326
  601   2HD   LYS 158          1HD       LYS 158 126.980  14.276  -1.192
  602   1HE   LYS 158          2HE       LYS 158 126.736  15.796  -3.020
  603   2HE   LYS 158          1HE       LYS 158 125.135  15.165  -3.399
  604   1HZ   LYS 158          1HZ       LYS 158 125.540  17.348  -1.945
  605   2HZ   LYS 158          2HZ       LYS 158 125.492  16.197  -0.706
  606   3HZ   LYS 158          3HZ       LYS 158 124.180  16.355  -1.763
  607    H    GLY 159           H        GLY 159 130.277  11.444  -5.161
  608   1HA   GLY 159          2HA       GLY 159 131.736  13.223  -5.839
  609   2HA   GLY 159          1HA       GLY 159 131.697  13.831  -4.190
  610    H    VAL 160           H        VAL 160 132.899  11.224  -6.240
  611    HA   VAL 160           HA       VAL 160 134.705  10.267  -4.195
  612    HB   VAL 160           HB       VAL 160 134.854   9.466  -7.086
  613   1HG1  VAL 160          1HG1      VAL 160 136.580   8.492  -5.859
  614   2HG1  VAL 160          2HG1      VAL 160 135.342   7.237  -5.903
  615   3HG1  VAL 160          3HG1      VAL 160 135.552   8.218  -4.453
  616   1HG2  VAL 160          1HG2      VAL 160 132.575   9.142  -5.327
  617   2HG2  VAL 160          2HG2      VAL 160 133.226   7.587  -5.848
  618   3HG2  VAL 160          3HG2      VAL 160 132.730   8.783  -7.046
  619    H    GLU 161           H        GLU 161 135.437  12.733  -4.281
  620    HA   GLU 161           HA       GLU 161 137.460  13.219  -6.305
  621   1HB   GLU 161          2HB       GLU 161 136.076  14.811  -4.240
  622   2HB   GLU 161          1HB       GLU 161 137.749  15.263  -4.537
  623   1HG   GLU 161          2HG       GLU 161 136.895  15.113  -7.063
  624   2HG   GLU 161          1HG       GLU 161 135.374  15.521  -6.270
  Start of MODEL    6
    1   1H    MET  81          1HT       MET  81  92.548   9.065   2.976
    2   2H    MET  81          2HT       MET  81  93.660  10.303   3.394
    3   3H    MET  81          3HT       MET  81  91.997  10.673   3.193
    4    HA   MET  81           HA       MET  81  92.277  10.619   5.442
    5   1HB   MET  81          2HB       MET  81  91.286   7.976   4.375
    6   2HB   MET  81          1HB       MET  81  91.161   8.409   6.073
    7   1HG   MET  81          2HG       MET  81  90.126  10.408   4.185
    8   2HG   MET  81          1HG       MET  81  89.249   8.879   4.234
    9   1HE   MET  81          1HE       MET  81  90.971  10.721   7.556
   10   2HE   MET  81          2HE       MET  81  89.736  11.980   7.539
   11   3HE   MET  81          3HE       MET  81  90.762  11.730   6.125
   12    H    VAL  82           H        VAL  82  94.077   8.079   3.841
   13    HA   VAL  82           HA       VAL  82  95.488   7.455   6.337
   14    HB   VAL  82           HB       VAL  82  94.612   5.544   5.055
   15   1HG1  VAL  82          1HG1      VAL  82  95.353   6.929   2.831
   16   2HG1  VAL  82          2HG1      VAL  82  94.939   5.216   2.861
   17   3HG1  VAL  82          3HG1      VAL  82  96.627   5.715   2.937
   18   1HG2  VAL  82          1HG2      VAL  82  96.314   4.649   6.211
   19   2HG2  VAL  82          2HG2      VAL  82  97.434   5.929   5.744
   20   3HG2  VAL  82          3HG2      VAL  82  97.128   4.583   4.647
   21    H    ARG  83           H        ARG  83  97.515   8.112   6.692
   22    HA   ARG  83           HA       ARG  83  99.001   9.287   4.435
   23   1HB   ARG  83          2HB       ARG  83 100.077  10.774   6.104
   24   2HB   ARG  83          1HB       ARG  83  98.340  11.023   5.980
   25   1HG   ARG  83          2HG       ARG  83  98.193  10.771   8.171
   26   2HG   ARG  83          1HG       ARG  83  98.707   9.095   7.984
   27   1HD   ARG  83          2HD       ARG  83 101.076  10.458   7.816
   28   2HD   ARG  83          1HD       ARG  83 100.175  11.416   8.990
   29    HE   ARG  83           HE       ARG  83 100.111   8.589   9.510
   30   1HH1  ARG  83          1HH1      ARG  83 101.889  11.552  10.005
   31   2HH1  ARG  83          2HH1      ARG  83 102.683  10.983  11.435
   32   1HH2  ARG  83          1HH2      ARG  83 101.154   7.841  11.391
   33   2HH2  ARG  83          2HH2      ARG  83 102.266   8.878  12.222
   34    H    CYS  84           H        CYS  84  99.174   6.564   5.003
   35    HA   CYS  84           HA       CYS  84 101.831   6.331   6.253
   36   1HB   CYS  84          2HB       CYS  84  99.597   4.318   5.989
   37   2HB   CYS  84          1HB       CYS  84 101.228   3.883   6.487
   38    HG   CYS  84           HG       CYS  84 100.626   4.533   8.758
   39    H    MET  85           H        MET  85 103.266   6.503   4.629
   40    HA   MET  85           HA       MET  85 102.923   4.691   2.331
   41   1HB   MET  85          2HB       MET  85 102.800   7.347   2.062
   42   2HB   MET  85          1HB       MET  85 104.547   7.162   2.008
   43   1HG   MET  85          2HG       MET  85 104.307   6.780  -0.162
   44   2HG   MET  85          1HG       MET  85 103.656   5.205   0.291
   45   1HE   MET  85          1HE       MET  85 102.807   8.595  -1.540
   46   2HE   MET  85          2HE       MET  85 102.656   8.912   0.189
   47   3HE   MET  85          3HE       MET  85 101.224   8.935  -0.840
   48    H    LYS  86           H        LYS  86 104.966   4.037   1.300
   49    HA   LYS  86           HA       LYS  86 107.365   4.272   2.922
   50   1HB   LYS  86          2HB       LYS  86 105.842   1.715   2.549
   51   2HB   LYS  86          1HB       LYS  86 107.592   1.679   2.721
   52   1HG   LYS  86          2HG       LYS  86 107.072   3.173   4.829
   53   2HG   LYS  86          1HG       LYS  86 105.501   2.377   4.709
   54   1HD   LYS  86          2HD       LYS  86 106.421   0.254   5.038
   55   2HD   LYS  86          1HD       LYS  86 108.051   0.797   4.635
   56   1HE   LYS  86          2HE       LYS  86 107.548   2.366   6.762
   57   2HE   LYS  86          1HE       LYS  86 106.562   0.965   7.179
   58   1HZ   LYS  86          1HZ       LYS  86 109.260   0.401   6.255
   59   2HZ   LYS  86          2HZ       LYS  86 108.367  -0.320   7.498
   60   3HZ   LYS  86          3HZ       LYS  86 109.141   1.162   7.763
   61    H    ASP  87           H        ASP  87 109.249   3.950   1.778
   62    HA   ASP  87           HA       ASP  87 109.101   4.244  -1.038
   63   1HB   ASP  87          2HB       ASP  87 111.231   4.116   1.003
   64   2HB   ASP  87          1HB       ASP  87 111.708   3.592  -0.611
   65    H    ASP  88           H        ASP  88 109.071   2.775  -2.611
   66    HA   ASP  88           HA       ASP  88 108.902  -0.007  -1.979
   67   1HB   ASP  88          2HB       ASP  88 108.090   1.629  -4.100
   68   2HB   ASP  88          1HB       ASP  88 109.272   0.531  -4.805
   69    H    SER  89           H        SER  89 110.172  -1.285  -4.053
   70    HA   SER  89           HA       SER  89 112.946  -1.117  -3.180
   71   1HB   SER  89          2HB       SER  89 111.356  -3.268  -3.606
   72   2HB   SER  89          1HB       SER  89 112.164  -3.165  -5.169
   73    HG   SER  89           HG       SER  89 113.312  -4.456  -3.644
   74    H    LYS  90           H        LYS  90 112.423   1.078  -4.611
   75    HA   LYS  90           HA       LYS  90 113.419   0.554  -7.326
   76   1HB   LYS  90          2HB       LYS  90 112.240   3.125  -6.268
   77   2HB   LYS  90          1HB       LYS  90 112.564   2.716  -7.947
   78   1HG   LYS  90          2HG       LYS  90 110.891   0.821  -7.637
   79   2HG   LYS  90          1HG       LYS  90 110.427   1.638  -6.142
   80   1HD   LYS  90          2HD       LYS  90 110.581   3.377  -8.505
   81   2HD   LYS  90          1HD       LYS  90 109.332   2.133  -8.580
   82   1HE   LYS  90          2HE       LYS  90 108.891   2.995  -6.101
   83   2HE   LYS  90          1HE       LYS  90 109.594   4.468  -6.769
   84   1HZ   LYS  90          1HZ       LYS  90 107.813   4.825  -8.078
   85   2HZ   LYS  90          2HZ       LYS  90 107.013   3.870  -6.935
   86   3HZ   LYS  90          3HZ       LYS  90 107.548   3.183  -8.385
   87    H    GLY  91           H        GLY  91 114.705   2.658  -8.116
   88   1HA   GLY  91          2HA       GLY  91 117.117   2.647  -6.556
   89   2HA   GLY  91          1HA       GLY  91 116.851   3.514  -8.060
   90    H    LYS  92           H        LYS  92 117.509   3.906  -4.874
   91    HA   LYS  92           HA       LYS  92 116.080   6.459  -4.646
   92   1HB   LYS  92          2HB       LYS  92 117.476   4.731  -2.604
   93   2HB   LYS  92          1HB       LYS  92 116.903   6.354  -2.248
   94   1HG   LYS  92          2HG       LYS  92 115.120   4.162  -3.272
   95   2HG   LYS  92          1HG       LYS  92 115.376   4.496  -1.558
   96   1HD   LYS  92          2HD       LYS  92 114.563   6.721  -3.372
   97   2HD   LYS  92          1HD       LYS  92 113.349   5.557  -2.837
   98   1HE   LYS  92          2HE       LYS  92 113.706   6.091  -0.559
   99   2HE   LYS  92          1HE       LYS  92 115.176   6.991  -0.928
  100   1HZ   LYS  92          1HZ       LYS  92 113.407   8.335  -2.382
  101   2HZ   LYS  92          2HZ       LYS  92 113.779   8.731  -0.781
  102   3HZ   LYS  92          3HZ       LYS  92 112.399   7.817  -1.126
  103    H    THR  93           H        THR  93 117.575   7.986  -3.105
  104    HA   THR  93           HA       THR  93 119.964   8.456  -4.734
  105    HB   THR  93           HB       THR  93 118.891  10.463  -4.796
  106    HG1  THR  93           HG1      THR  93 120.832  10.916  -3.742
  107   1HG2  THR  93          1HG2      THR  93 117.751  11.407  -2.646
  108   2HG2  THR  93          2HG2      THR  93 117.671   9.706  -2.192
  109   3HG2  THR  93          3HG2      THR  93 116.908  10.256  -3.682
  110    H    GLU  94           H        GLU  94 119.431   9.562  -1.415
  111    HA   GLU  94           HA       GLU  94 122.084   8.690  -0.696
  112   1HB   GLU  94          2HB       GLU  94 119.952  10.339   0.585
  113   2HB   GLU  94          1HB       GLU  94 121.184   9.625   1.616
  114   1HG   GLU  94          2HG       GLU  94 122.518  11.315   1.134
  115   2HG   GLU  94          1HG       GLU  94 122.548  10.782  -0.546
  116    H    GLU  95           H        GLU  95 118.785   7.687  -0.116
  117    HA   GLU  95           HA       GLU  95 119.385   5.896   2.026
  118   1HB   GLU  95          2HB       GLU  95 116.995   6.018   0.181
  119   2HB   GLU  95          1HB       GLU  95 117.096   5.036   1.634
  120   1HG   GLU  95          2HG       GLU  95 116.391   6.733   2.858
  121   2HG   GLU  95          1HG       GLU  95 117.755   7.713   2.321
  122    H    GLU  96           H        GLU  96 119.393   5.661  -1.449
  123    HA   GLU  96           HA       GLU  96 119.188   2.902  -1.781
  124   1HB   GLU  96          2HB       GLU  96 120.167   3.213  -3.941
  125   2HB   GLU  96          1HB       GLU  96 119.173   4.622  -3.603
  126   1HG   GLU  96          2HG       GLU  96 120.922   5.860  -4.157
  127   2HG   GLU  96          1HG       GLU  96 121.678   5.325  -2.658
  128    H    LEU  97           H        LEU  97 121.870   4.862  -0.715
  129    HA   LEU  97           HA       LEU  97 123.875   2.858  -1.052
  130   1HB   LEU  97          2HB       LEU  97 123.724   5.470   0.409
  131   2HB   LEU  97          1HB       LEU  97 125.085   4.397   0.667
  132    HG   LEU  97           HG       LEU  97 124.277   5.394  -2.059
  133   1HD1  LEU  97          1HD1      LEU  97 126.615   6.488  -0.572
  134   2HD1  LEU  97          2HD1      LEU  97 125.007   7.136  -0.245
  135   3HD1  LEU  97          3HD1      LEU  97 125.671   7.205  -1.876
  136   1HD2  LEU  97          1HD2      LEU  97 125.735   3.285  -1.656
  137   2HD2  LEU  97          2HD2      LEU  97 126.989   4.450  -1.230
  138   3HD2  LEU  97          3HD2      LEU  97 126.258   4.489  -2.834
  139    H    SER  98           H        SER  98 121.623   3.704   1.475
  140    HA   SER  98           HA       SER  98 122.823   2.403   3.642
  141   1HB   SER  98          2HB       SER  98 120.747   3.948   3.586
  142   2HB   SER  98          1HB       SER  98 119.839   2.474   3.250
  143    HG   SER  98           HG       SER  98 120.544   3.356   5.589
  144    H    ASP  99           H        ASP  99 120.710   1.184   1.092
  145    HA   ASP  99           HA       ASP  99 120.592  -1.462   2.240
  146   1HB   ASP  99          2HB       ASP  99 118.767  -0.339   0.833
  147   2HB   ASP  99          1HB       ASP  99 119.774  -0.710  -0.562
  148    H    LEU 100           H        LEU 100 122.418   0.208  -0.236
  149    HA   LEU 100           HA       LEU 100 123.561  -2.140  -1.393
  150   1HB   LEU 100          2HB       LEU 100 123.925   0.785  -1.647
  151   2HB   LEU 100          1HB       LEU 100 125.310  -0.203  -2.070
  152    HG   LEU 100           HG       LEU 100 122.574  -0.609  -3.268
  153   1HD1  LEU 100          1HD1      LEU 100 124.738   0.628  -4.853
  154   2HD1  LEU 100          2HD1      LEU 100 123.949   1.651  -3.651
  155   3HD1  LEU 100          3HD1      LEU 100 122.994   0.878  -4.917
  156   1HD2  LEU 100          1HD2      LEU 100 125.320  -1.557  -4.079
  157   2HD2  LEU 100          2HD2      LEU 100 123.829  -1.841  -4.975
  158   3HD2  LEU 100          3HD2      LEU 100 124.042  -2.546  -3.373
  159    H    PHE 101           H        PHE 101 124.393  -0.034   1.263
  160    HA   PHE 101           HA       PHE 101 127.094  -0.760   1.561
  161   1HB   PHE 101          2HB       PHE 101 126.126   1.186   2.690
  162   2HB   PHE 101          1HB       PHE 101 125.106   0.131   3.662
  163    HD1  PHE 101           HD1      PHE 101 125.873  -0.723   5.688
  164    HD2  PHE 101           HD2      PHE 101 128.647   0.968   2.939
  165    HE1  PHE 101           HE1      PHE 101 127.641  -0.863   7.393
  166    HE2  PHE 101           HE2      PHE 101 130.421   0.831   4.640
  167    HZ   PHE 101           HZ       PHE 101 129.919  -0.086   6.870
  168    H    ARG 102           H        ARG 102 124.118  -2.289   2.586
  169    HA   ARG 102           HA       ARG 102 125.186  -4.079   4.471
  170   1HB   ARG 102          2HB       ARG 102 122.698  -3.488   3.766
  171   2HB   ARG 102          1HB       ARG 102 122.894  -4.915   2.755
  172   1HG   ARG 102          2HG       ARG 102 123.847  -5.539   5.355
  173   2HG   ARG 102          1HG       ARG 102 122.266  -4.770   5.512
  174   1HD   ARG 102          2HD       ARG 102 121.204  -6.412   4.264
  175   2HD   ARG 102          1HD       ARG 102 122.701  -6.935   3.492
  176    HE   ARG 102           HE       ARG 102 123.088  -8.336   5.263
  177   1HH1  ARG 102          1HH1      ARG 102 120.583  -6.068   6.137
  178   2HH1  ARG 102          2HH1      ARG 102 120.195  -6.876   7.617
  179   1HH2  ARG 102          1HH2      ARG 102 122.576  -9.402   7.209
  180   2HH2  ARG 102          2HH2      ARG 102 121.326  -8.769   8.227
  181    H    MET 103           H        MET 103 124.984  -4.193   0.974
  182    HA   MET 103           HA       MET 103 125.525  -6.909   0.577
  183   1HB   MET 103          2HB       MET 103 125.809  -4.435  -1.051
  184   2HB   MET 103          1HB       MET 103 126.667  -5.868  -1.600
  185   1HG   MET 103          2HG       MET 103 124.653  -7.099  -1.813
  186   2HG   MET 103          1HG       MET 103 123.729  -5.853  -0.977
  187   1HE   MET 103          1HE       MET 103 122.052  -5.275  -2.187
  188   2HE   MET 103          2HE       MET 103 121.953  -4.730  -3.862
  189   3HE   MET 103          3HE       MET 103 122.550  -3.637  -2.612
  190    H    PHE 104           H        PHE 104 127.698  -4.158   1.025
  191    HA   PHE 104           HA       PHE 104 130.107  -5.528   0.514
  192   1HB   PHE 104          2HB       PHE 104 129.365  -2.983   1.883
  193   2HB   PHE 104          1HB       PHE 104 130.987  -3.619   2.135
  194    HD1  PHE 104           HD1      PHE 104 128.729  -3.407  -0.831
  195    HD2  PHE 104           HD2      PHE 104 132.515  -2.477   0.872
  196    HE1  PHE 104           HE1      PHE 104 129.442  -2.418  -2.968
  197    HE2  PHE 104           HE2      PHE 104 133.236  -1.485  -1.262
  198    HZ   PHE 104           HZ       PHE 104 131.698  -1.455  -3.185
  199    H    ASP 105           H        ASP 105 128.229  -5.044   3.462
  200    HA   ASP 105           HA       ASP 105 130.183  -6.391   5.108
  201   1HB   ASP 105          2HB       ASP 105 127.774  -4.813   5.532
  202   2HB   ASP 105          1HB       ASP 105 127.818  -6.236   6.567
  203    H    LYS 106           H        LYS 106 130.179  -8.473   5.743
  204    HA   LYS 106           HA       LYS 106 128.301 -10.268   4.438
  205   1HB   LYS 106          2HB       LYS 106 130.781 -10.790   6.084
  206   2HB   LYS 106          1HB       LYS 106 129.797 -12.053   5.357
  207   1HG   LYS 106          2HG       LYS 106 131.070  -9.857   3.750
  208   2HG   LYS 106          1HG       LYS 106 131.875 -11.389   4.097
  209   1HD   LYS 106          2HD       LYS 106 129.127 -11.518   2.994
  210   2HD   LYS 106          1HD       LYS 106 130.411 -10.995   1.902
  211   1HE   LYS 106          2HE       LYS 106 131.361 -13.038   1.833
  212   2HE   LYS 106          1HE       LYS 106 131.039 -13.358   3.536
  213   1HZ   LYS 106          1HZ       LYS 106 128.718 -13.296   1.788
  214   2HZ   LYS 106          2HZ       LYS 106 129.079 -14.335   3.072
  215   3HZ   LYS 106          3HZ       LYS 106 129.781 -14.593   1.555
  216    H    ASN 107           H        ASN 107 129.575  -9.888   7.750
  217    HA   ASN 107           HA       ASN 107 127.318 -11.349   8.830
  218   1HB   ASN 107          2HB       ASN 107 128.462 -10.945  11.022
  219   2HB   ASN 107          1HB       ASN 107 129.457 -11.783   9.836
  220   1HD2  ASN 107          1HD2      ASN 107 131.125 -10.996  11.382
  221   2HD2  ASN 107          2HD2      ASN 107 131.808  -9.437  11.092
  222    H    ALA 108           H        ALA 108 128.061  -8.106   8.122
  223    HA   ALA 108           HA       ALA 108 126.909  -6.169   8.436
  224   1HB   ALA 108          1HB       ALA 108 124.707  -7.438   9.955
  225   2HB   ALA 108          2HB       ALA 108 124.953  -7.978   8.295
  226   3HB   ALA 108          3HB       ALA 108 124.651  -6.273   8.632
  227    H    ASP 109           H        ASP 109 128.720  -5.768   9.934
  228    HA   ASP 109           HA       ASP 109 127.897  -5.761  12.756
  229   1HB   ASP 109          2HB       ASP 109 130.362  -5.327  13.176
  230   2HB   ASP 109          1HB       ASP 109 129.966  -6.909  12.511
  231    H    GLY 110           H        GLY 110 128.583  -3.736  10.053
  232   1HA   GLY 110          2HA       GLY 110 127.562  -1.465  10.349
  233   2HA   GLY 110          1HA       GLY 110 128.518  -1.367  11.821
  234    H    TYR 111           H        TYR 111 130.777  -2.779  10.430
  235    HA   TYR 111           HA       TYR 111 131.651  -0.600   8.657
  236   1HB   TYR 111          2HB       TYR 111 133.381  -1.938  10.747
  237   2HB   TYR 111          1HB       TYR 111 133.863  -0.637   9.665
  238    HD1  TYR 111           HD1      TYR 111 132.958   1.642   9.991
  239    HD2  TYR 111           HD2      TYR 111 132.142  -1.495  12.745
  240    HE1  TYR 111           HE1      TYR 111 132.244   3.302  11.660
  241    HE2  TYR 111           HE2      TYR 111 131.424   0.155  14.422
  242    HH   TYR 111           HH       TYR 111 132.157   3.242  14.392
  243    H    ILE 112           H        ILE 112 133.653  -1.246   7.397
  244    HA   ILE 112           HA       ILE 112 133.606  -4.117   6.746
  245    HB   ILE 112           HB       ILE 112 133.822  -1.914   4.693
  246   1HG1  ILE 112          2HG1      ILE 112 131.467  -3.739   4.826
  247   2HG1  ILE 112          1HG1      ILE 112 131.539  -2.408   5.976
  248   1HG2  ILE 112          1HG2      ILE 112 134.961  -3.921   4.017
  249   2HG2  ILE 112          2HG2      ILE 112 133.463  -3.776   3.097
  250   3HG2  ILE 112          3HG2      ILE 112 133.564  -4.907   4.448
  251   1HD1  ILE 112          1HD1      ILE 112 131.818  -2.030   3.011
  252   2HD1  ILE 112          2HD1      ILE 112 131.546  -0.799   4.245
  253   3HD1  ILE 112          3HD1      ILE 112 130.275  -1.959   3.861
  254    H    ASP 113           H        ASP 113 135.552  -5.036   6.164
  255    HA   ASP 113           HA       ASP 113 137.915  -3.290   6.167
  256   1HB   ASP 113          2HB       ASP 113 137.318  -4.716   8.359
  257   2HB   ASP 113          1HB       ASP 113 138.184  -5.954   7.455
  258    H    LEU 114           H        LEU 114 139.922  -4.721   5.550
  259    HA   LEU 114           HA       LEU 114 139.547  -5.569   2.906
  260   1HB   LEU 114          2HB       LEU 114 141.689  -4.789   4.110
  261   2HB   LEU 114          1HB       LEU 114 141.853  -6.460   4.614
  262    HG   LEU 114           HG       LEU 114 141.757  -7.075   2.147
  263   1HD1  LEU 114          1HD1      LEU 114 142.462  -4.184   1.731
  264   2HD1  LEU 114          2HD1      LEU 114 140.829  -4.809   1.505
  265   3HD1  LEU 114          3HD1      LEU 114 142.150  -5.423   0.515
  266   1HD2  LEU 114          1HD2      LEU 114 143.955  -5.733   3.600
  267   2HD2  LEU 114          2HD2      LEU 114 144.177  -5.976   1.867
  268   3HD2  LEU 114          3HD2      LEU 114 143.867  -7.357   2.919
  269    H    GLU 115           H        GLU 115 139.706  -7.373   5.929
  270    HA   GLU 115           HA       GLU 115 139.835  -9.955   4.811
  271   1HB   GLU 115          2HB       GLU 115 139.154  -8.808   7.465
  272   2HB   GLU 115          1HB       GLU 115 138.595 -10.444   7.141
  273   1HG   GLU 115          2HG       GLU 115 141.399  -9.935   6.447
  274   2HG   GLU 115          1HG       GLU 115 141.016  -9.817   8.165
  275    H    GLU 116           H        GLU 116 137.036  -8.171   6.122
  276    HA   GLU 116           HA       GLU 116 135.105 -10.064   5.367
  277   1HB   GLU 116          2HB       GLU 116 135.144  -7.540   6.644
  278   2HB   GLU 116          1HB       GLU 116 134.000  -7.413   5.315
  279   1HG   GLU 116          2HG       GLU 116 132.510  -8.320   6.681
  280   2HG   GLU 116          1HG       GLU 116 133.375  -9.839   6.460
  281    H    LEU 117           H        LEU 117 136.351  -7.202   3.702
  282    HA   LEU 117           HA       LEU 117 134.586  -7.340   1.494
  283   1HB   LEU 117          2HB       LEU 117 136.234  -5.453   2.346
  284   2HB   LEU 117          1HB       LEU 117 137.329  -6.209   1.204
  285    HG   LEU 117           HG       LEU 117 135.603  -5.863  -0.578
  286   1HD1  LEU 117          1HD1      LEU 117 133.615  -4.870  -0.208
  287   2HD1  LEU 117          2HD1      LEU 117 134.255  -3.807   1.047
  288   3HD1  LEU 117          3HD1      LEU 117 133.854  -5.481   1.428
  289   1HD2  LEU 117          1HD2      LEU 117 136.620  -3.413   0.856
  290   2HD2  LEU 117          2HD2      LEU 117 136.033  -3.454  -0.807
  291   3HD2  LEU 117          3HD2      LEU 117 137.485  -4.351  -0.361
  292    H    LYS 118           H        LYS 118 137.632  -8.880   2.235
  293    HA   LYS 118           HA       LYS 118 138.300  -9.740  -0.365
  294   1HB   LYS 118          2HB       LYS 118 139.173 -10.313   2.377
  295   2HB   LYS 118          1HB       LYS 118 139.345 -11.678   1.281
  296   1HG   LYS 118          2HG       LYS 118 140.677 -10.324  -0.231
  297   2HG   LYS 118          1HG       LYS 118 140.471  -8.922   0.820
  298   1HD   LYS 118          2HD       LYS 118 142.506  -9.652   1.558
  299   2HD   LYS 118          1HD       LYS 118 141.457 -10.587   2.626
  300   1HE   LYS 118          2HE       LYS 118 142.392 -11.662  -0.017
  301   2HE   LYS 118          1HE       LYS 118 143.366 -11.820   1.445
  302   1HZ   LYS 118          1HZ       LYS 118 140.751 -13.029   0.825
  303   2HZ   LYS 118          2HZ       LYS 118 141.219 -12.802   2.435
  304   3HZ   LYS 118          3HZ       LYS 118 142.157 -13.769   1.410
  305    H    ILE 119           H        ILE 119 136.053 -10.940   2.000
  306    HA   ILE 119           HA       ILE 119 135.761 -13.557   0.911
  307    HB   ILE 119           HB       ILE 119 133.748 -12.033   2.566
  308   1HG1  ILE 119          2HG1      ILE 119 135.772 -13.968   3.662
  309   2HG1  ILE 119          1HG1      ILE 119 136.167 -12.262   3.477
  310   1HG2  ILE 119          1HG2      ILE 119 132.994 -14.119   1.403
  311   2HG2  ILE 119          2HG2      ILE 119 132.864 -14.166   3.161
  312   3HG2  ILE 119          3HG2      ILE 119 134.188 -15.005   2.351
  313   1HD1  ILE 119          1HD1      ILE 119 133.840 -12.047   4.786
  314   2HD1  ILE 119          2HD1      ILE 119 135.405 -12.166   5.588
  315   3HD1  ILE 119          3HD1      ILE 119 134.396 -13.601   5.406
  316    H    MET 120           H        MET 120 133.757 -10.617   0.699
  317    HA   MET 120           HA       MET 120 131.848 -11.681  -1.070
  318   1HB   MET 120          2HB       MET 120 131.207  -9.353  -1.495
  319   2HB   MET 120          1HB       MET 120 131.444  -9.647   0.222
  320   1HG   MET 120          2HG       MET 120 133.204  -8.250   0.361
  321   2HG   MET 120          1HG       MET 120 133.796  -8.658  -1.248
  322   1HE   MET 120          1HE       MET 120 133.201  -7.327  -3.435
  323   2HE   MET 120          2HE       MET 120 134.342  -6.547  -2.340
  324   3HE   MET 120          3HE       MET 120 133.082  -5.595  -3.126
  325    H    LEU 121           H        LEU 121 135.010 -10.317  -1.598
  326    HA   LEU 121           HA       LEU 121 134.752  -9.767  -4.358
  327   1HB   LEU 121          2HB       LEU 121 136.939  -9.972  -2.400
  328   2HB   LEU 121          1HB       LEU 121 137.403 -10.332  -4.050
  329    HG   LEU 121           HG       LEU 121 135.857  -7.956  -4.125
  330   1HD1  LEU 121          1HD1      LEU 121 137.648  -6.634  -2.716
  331   2HD1  LEU 121          2HD1      LEU 121 137.699  -8.142  -1.803
  332   3HD1  LEU 121          3HD1      LEU 121 136.177  -7.267  -1.976
  333   1HD2  LEU 121          1HD2      LEU 121 137.927  -6.997  -4.992
  334   2HD2  LEU 121          2HD2      LEU 121 137.617  -8.583  -5.694
  335   3HD2  LEU 121          3HD2      LEU 121 138.825  -8.404  -4.422
  336    H    GLN 122           H        GLN 122 135.494 -12.670  -2.554
  337    HA   GLN 122           HA       GLN 122 136.567 -14.234  -4.612
  338   1HB   GLN 122          2HB       GLN 122 134.974 -14.992  -2.160
  339   2HB   GLN 122          1HB       GLN 122 135.709 -16.177  -3.232
  340   1HG   GLN 122          2HG       GLN 122 137.531 -14.082  -2.297
  341   2HG   GLN 122          1HG       GLN 122 136.890 -15.128  -1.030
  342   1HE2  GLN 122          1HE2      GLN 122 139.605 -14.887  -2.088
  343   2HE2  GLN 122          2HE2      GLN 122 140.047 -16.467  -2.630
  344    H    ALA 123           H        ALA 123 133.269 -13.391  -3.828
  345    HA   ALA 123           HA       ALA 123 131.939 -15.359  -5.328
  346   1HB   ALA 123          1HB       ALA 123 130.915 -12.561  -4.932
  347   2HB   ALA 123          2HB       ALA 123 130.955 -13.745  -3.626
  348   3HB   ALA 123          3HB       ALA 123 129.995 -14.059  -5.072
  349    H    THR 124           H        THR 124 133.314 -12.248  -6.227
  350    HA   THR 124           HA       THR 124 132.177 -12.009  -8.777
  351    HB   THR 124           HB       THR 124 133.841 -10.363  -9.220
  352    HG1  THR 124           HG1      THR 124 135.345 -11.701  -7.239
  353   1HG2  THR 124          1HG2      THR 124 133.556  -8.891  -7.511
  354   2HG2  THR 124          2HG2      THR 124 133.827 -10.109  -6.265
  355   3HG2  THR 124          3HG2      THR 124 132.287 -10.054  -7.126
  356    H    GLY 125           H        GLY 125 132.831 -12.651 -10.807
  357   1HA   GLY 125          2HA       GLY 125 134.221 -15.127 -10.971
  358   2HA   GLY 125          1HA       GLY 125 133.666 -14.160 -12.330
  359    H    GLU 126           H        GLU 126 135.154 -11.791 -11.565
  360    HA   GLU 126           HA       GLU 126 137.592 -12.374 -12.891
  361   1HB   GLU 126          2HB       GLU 126 136.954  -9.897 -11.287
  362   2HB   GLU 126          1HB       GLU 126 138.128 -10.049 -12.587
  363   1HG   GLU 126          2HG       GLU 126 135.654 -10.851 -13.650
  364   2HG   GLU 126          1HG       GLU 126 135.352  -9.383 -12.720
  365    H    THR 127           H        THR 127 139.677 -12.512 -12.128
  366    HA   THR 127           HA       THR 127 139.939 -13.343  -9.366
  367    HB   THR 127           HB       THR 127 142.117 -14.131  -9.970
  368    HG1  THR 127           HG1      THR 127 141.821 -12.763 -12.433
  369   1HG2  THR 127          1HG2      THR 127 140.469 -14.585 -12.437
  370   2HG2  THR 127          2HG2      THR 127 140.181 -15.416 -10.907
  371   3HG2  THR 127          3HG2      THR 127 141.715 -15.628 -11.752
  372    H    ILE 128           H        ILE 128 140.223 -11.851  -7.848
  373    HA   ILE 128           HA       ILE 128 141.855  -9.482  -8.482
  374    HB   ILE 128           HB       ILE 128 139.891  -9.752  -6.208
  375   1HG1  ILE 128          2HG1      ILE 128 138.721  -9.939  -8.364
  376   2HG1  ILE 128          1HG1      ILE 128 138.344  -8.417  -7.562
  377   1HG2  ILE 128          1HG2      ILE 128 140.656  -7.133  -7.333
  378   2HG2  ILE 128          2HG2      ILE 128 141.906  -7.996  -6.439
  379   3HG2  ILE 128          3HG2      ILE 128 140.371  -7.612  -5.660
  380   1HD1  ILE 128          1HD1      ILE 128 140.432  -8.671  -9.704
  381   2HD1  ILE 128          2HD1      ILE 128 139.726  -7.196  -9.043
  382   3HD1  ILE 128          3HD1      ILE 128 138.744  -8.280 -10.029
  383    H    THR 129           H        THR 129 143.598  -8.973  -7.243
  384    HA   THR 129           HA       THR 129 144.525 -11.028  -5.398
  385    HB   THR 129           HB       THR 129 146.144  -8.603  -6.026
  386    HG1  THR 129           HG1      THR 129 146.771  -9.589  -7.999
  387   1HG2  THR 129          1HG2      THR 129 147.427 -10.019  -4.780
  388   2HG2  THR 129          2HG2      THR 129 147.831 -10.563  -6.409
  389   3HG2  THR 129          3HG2      THR 129 146.667 -11.467  -5.439
  390    H    GLU 130           H        GLU 130 145.853 -10.100  -3.471
  391    HA   GLU 130           HA       GLU 130 144.015  -8.796  -1.754
  392   1HB   GLU 130          2HB       GLU 130 146.866  -9.685  -1.512
  393   2HB   GLU 130          1HB       GLU 130 146.172  -8.652  -0.269
  394   1HG   GLU 130          2HG       GLU 130 144.272 -10.408  -0.217
  395   2HG   GLU 130          1HG       GLU 130 145.445 -11.448  -1.024
  396    H    ASP 131           H        ASP 131 146.705  -7.692  -3.692
  397    HA   ASP 131           HA       ASP 131 146.976  -5.143  -2.456
  398   1HB   ASP 131          2HB       ASP 131 148.156  -6.568  -4.701
  399   2HB   ASP 131          1HB       ASP 131 147.888  -4.868  -5.075
  400    H    ASP 132           H        ASP 132 145.102  -6.382  -5.167
  401    HA   ASP 132           HA       ASP 132 144.216  -3.885  -6.150
  402   1HB   ASP 132          2HB       ASP 132 143.451  -6.727  -6.519
  403   2HB   ASP 132          1HB       ASP 132 142.222  -5.528  -6.917
  404    H    ILE 133           H        ILE 133 143.018  -6.040  -3.652
  405    HA   ILE 133           HA       ILE 133 140.507  -4.763  -3.293
  406    HB   ILE 133           HB       ILE 133 142.042  -6.361  -1.242
  407   1HG1  ILE 133          2HG1      ILE 133 139.906  -7.552  -2.960
  408   2HG1  ILE 133          1HG1      ILE 133 141.519  -7.359  -3.642
  409   1HG2  ILE 133          1HG2      ILE 133 139.110  -6.483  -1.360
  410   2HG2  ILE 133          2HG2      ILE 133 139.778  -4.922  -0.883
  411   3HG2  ILE 133          3HG2      ILE 133 140.190  -6.372   0.030
  412   1HD1  ILE 133          1HD1      ILE 133 141.714  -8.528  -1.041
  413   2HD1  ILE 133          2HD1      ILE 133 142.214  -9.179  -2.601
  414   3HD1  ILE 133          3HD1      ILE 133 140.566  -9.437  -2.025
  415    H    GLU 134           H        GLU 134 143.717  -4.228  -2.003
  416    HA   GLU 134           HA       GLU 134 143.046  -2.581   0.169
  417   1HB   GLU 134          2HB       GLU 134 145.506  -2.837  -1.540
  418   2HB   GLU 134          1HB       GLU 134 145.412  -1.629  -0.265
  419   1HG   GLU 134          2HG       GLU 134 145.066  -3.358   1.391
  420   2HG   GLU 134          1HG       GLU 134 145.062  -4.592   0.131
  421    H    GLU 135           H        GLU 135 143.322  -1.938  -3.252
  422    HA   GLU 135           HA       GLU 135 143.413   0.892  -3.084
  423   1HB   GLU 135          2HB       GLU 135 142.515  -0.938  -5.315
  424   2HB   GLU 135          1HB       GLU 135 142.706   0.803  -5.483
  425   1HG   GLU 135          2HG       GLU 135 145.125   0.208  -4.527
  426   2HG   GLU 135          1HG       GLU 135 144.746  -1.325  -5.310
  427    H    LEU 136           H        LEU 136 140.818  -1.449  -3.091
  428    HA   LEU 136           HA       LEU 136 138.698   0.343  -3.637
  429   1HB   LEU 136          2HB       LEU 136 139.006  -2.424  -3.064
  430   2HB   LEU 136          1HB       LEU 136 137.798  -1.786  -1.965
  431    HG   LEU 136           HG       LEU 136 137.534  -1.084  -4.842
  432   1HD1  LEU 136          1HD1      LEU 136 138.057  -3.656  -4.381
  433   2HD1  LEU 136          2HD1      LEU 136 136.891  -3.123  -5.591
  434   3HD1  LEU 136          3HD1      LEU 136 136.335  -3.656  -4.004
  435   1HD2  LEU 136          1HD2      LEU 136 135.123  -1.465  -4.227
  436   2HD2  LEU 136          2HD2      LEU 136 135.928  -0.152  -3.369
  437   3HD2  LEU 136          3HD2      LEU 136 135.664  -1.699  -2.566
  438    H    MET 137           H        MET 137 140.351  -0.608  -0.694
  439    HA   MET 137           HA       MET 137 138.471   0.834   0.986
  440   1HB   MET 137          2HB       MET 137 139.715  -1.363   1.575
  441   2HB   MET 137          1HB       MET 137 141.084  -0.317   1.920
  442   1HG   MET 137          2HG       MET 137 140.182   0.459   3.824
  443   2HG   MET 137          1HG       MET 137 138.549   0.492   3.163
  444   1HE   MET 137          1HE       MET 137 136.863  -0.759   4.490
  445   2HE   MET 137          2HE       MET 137 136.887  -2.522   4.494
  446   3HE   MET 137          3HE       MET 137 136.996  -1.643   2.970
  447    H    LYS 138           H        LYS 138 141.671   1.235  -0.368
  448    HA   LYS 138           HA       LYS 138 142.572   3.364   1.212
  449   1HB   LYS 138          2HB       LYS 138 143.882   1.988  -0.493
  450   2HB   LYS 138          1HB       LYS 138 143.192   3.041  -1.720
  451   1HG   LYS 138          2HG       LYS 138 144.149   4.947  -0.224
  452   2HG   LYS 138          1HG       LYS 138 145.183   3.663   0.408
  453   1HD   LYS 138          2HD       LYS 138 146.523   4.229  -1.312
  454   2HD   LYS 138          1HD       LYS 138 145.411   3.236  -2.258
  455   1HE   LYS 138          2HE       LYS 138 144.502   5.018  -3.303
  456   2HE   LYS 138          1HE       LYS 138 144.590   6.036  -1.867
  457   1HZ   LYS 138          1HZ       LYS 138 146.529   5.669  -4.004
  458   2HZ   LYS 138          2HZ       LYS 138 147.164   5.822  -2.443
  459   3HZ   LYS 138          3HZ       LYS 138 146.182   7.044  -3.081
  460    H    ASP 139           H        ASP 139 140.687   3.345  -1.789
  461    HA   ASP 139           HA       ASP 139 140.473   6.229  -1.790
  462   1HB   ASP 139          2HB       ASP 139 139.350   6.000  -3.881
  463   2HB   ASP 139          1HB       ASP 139 140.672   4.840  -3.886
  464    H    GLY 140           H        GLY 140 138.728   3.582  -0.493
  465   1HA   GLY 140          2HA       GLY 140 136.164   4.907  -0.434
  466   2HA   GLY 140          1HA       GLY 140 136.577   3.391   0.352
  467    H    ASP 141           H        ASP 141 138.931   4.657   1.668
  468    HA   ASP 141           HA       ASP 141 137.472   5.737   3.941
  469   1HB   ASP 141          2HB       ASP 141 139.343   3.959   4.051
  470   2HB   ASP 141          1HB       ASP 141 140.449   5.310   3.824
  471    H    LYS 142           H        LYS 142 137.645   7.786   4.721
  472    HA   LYS 142           HA       LYS 142 139.157   9.689   3.059
  473   1HB   LYS 142          2HB       LYS 142 136.805  10.319   4.844
  474   2HB   LYS 142          1HB       LYS 142 137.547  11.369   3.644
  475   1HG   LYS 142          2HG       LYS 142 136.145   8.789   2.989
  476   2HG   LYS 142          1HG       LYS 142 135.379  10.378   2.947
  477   1HD   LYS 142          2HD       LYS 142 137.526  10.893   1.433
  478   2HD   LYS 142          1HD       LYS 142 137.358   9.168   1.106
  479   1HE   LYS 142          2HE       LYS 142 135.414   9.433  -0.024
  480   2HE   LYS 142          1HE       LYS 142 134.879  10.769   0.995
  481   1HZ   LYS 142          1HZ       LYS 142 136.921  11.909  -0.257
  482   2HZ   LYS 142          2HZ       LYS 142 135.337  11.947  -0.850
  483   3HZ   LYS 142          3HZ       LYS 142 136.439  10.816  -1.455
  484    H    ASN 143           H        ASN 143 138.280   8.857   6.382
  485    HA   ASN 143           HA       ASN 143 140.138  10.812   7.456
  486   1HB   ASN 143          2HB       ASN 143 139.358   9.899   9.669
  487   2HB   ASN 143          1HB       ASN 143 138.085  10.587   8.664
  488   1HD2  ASN 143          1HD2      ASN 143 138.322   8.397  10.807
  489   2HD2  ASN 143          2HD2      ASN 143 137.417   7.088  10.134
  490    H    ASN 144           H        ASN 144 140.223   7.567   6.455
  491    HA   ASN 144           HA       ASN 144 141.855   5.988   6.496
  492   1HB   ASN 144          2HB       ASN 144 143.264   8.476   7.041
  493   2HB   ASN 144          1HB       ASN 144 144.049   7.100   7.810
  494   1HD2  ASN 144          1HD2      ASN 144 143.874   8.891   5.055
  495   2HD2  ASN 144          2HD2      ASN 144 144.549   7.761   3.936
  496    H    ASP 145           H        ASP 145 140.307   5.089   8.112
  497    HA   ASP 145           HA       ASP 145 141.494   4.977  10.805
  498   1HB   ASP 145          2HB       ASP 145 139.273   4.287  11.603
  499   2HB   ASP 145          1HB       ASP 145 139.202   5.843  10.780
  500    H    GLY 146           H        GLY 146 140.639   3.141   8.003
  501   1HA   GLY 146          2HA       GLY 146 141.953   1.042   7.794
  502   2HA   GLY 146          1HA       GLY 146 141.417   0.668   9.424
  503    H    ARG 147           H        ARG 147 138.709   1.773   8.812
  504    HA   ARG 147           HA       ARG 147 137.731  -0.326   7.000
  505   1HB   ARG 147          2HB       ARG 147 136.476   0.412   9.650
  506   2HB   ARG 147          1HB       ARG 147 135.871  -0.787   8.515
  507   1HG   ARG 147          2HG       ARG 147 137.614  -2.272   8.970
  508   2HG   ARG 147          1HG       ARG 147 138.609  -1.018   9.712
  509   1HD   ARG 147          2HD       ARG 147 136.455  -0.922  11.322
  510   2HD   ARG 147          1HD       ARG 147 136.403  -2.619  10.848
  511    HE   ARG 147           HE       ARG 147 138.999  -1.738  11.712
  512   1HH1  ARG 147          1HH1      ARG 147 135.912  -2.997  12.748
  513   2HH1  ARG 147          2HH1      ARG 147 136.539  -3.672  14.215
  514   1HH2  ARG 147          1HH2      ARG 147 139.824  -2.624  13.642
  515   2HH2  ARG 147          2HH2      ARG 147 138.759  -3.459  14.723
  516    H    ILE 148           H        ILE 148 135.276   0.077   6.576
  517    HA   ILE 148           HA       ILE 148 134.916   2.963   6.079
  518    HB   ILE 148           HB       ILE 148 133.837   0.712   4.380
  519   1HG1  ILE 148          2HG1      ILE 148 135.990   2.588   3.478
  520   2HG1  ILE 148          1HG1      ILE 148 136.425   1.193   4.461
  521   1HG2  ILE 148          1HG2      ILE 148 133.557   2.671   2.756
  522   2HG2  ILE 148          2HG2      ILE 148 133.759   3.703   4.172
  523   3HG2  ILE 148          3HG2      ILE 148 132.424   2.553   4.102
  524   1HD1  ILE 148          1HD1      ILE 148 136.652   0.250   2.426
  525   2HD1  ILE 148          2HD1      ILE 148 135.483   1.331   1.669
  526   3HD1  ILE 148          3HD1      ILE 148 134.925  -0.036   2.635
  527    H    ASP 149           H        ASP 149 132.840   3.830   6.293
  528    HA   ASP 149           HA       ASP 149 130.797   2.081   7.472
  529   1HB   ASP 149          2HB       ASP 149 130.273   3.795   9.157
  530   2HB   ASP 149          1HB       ASP 149 131.928   3.217   9.325
  531    H    TYR 150           H        TYR 150 128.726   3.643   7.821
  532    HA   TYR 150           HA       TYR 150 127.747   4.165   5.257
  533   1HB   TYR 150          2HB       TYR 150 126.341   3.701   7.259
  534   2HB   TYR 150          1HB       TYR 150 126.720   5.312   7.862
  535    HD1  TYR 150           HD1      TYR 150 124.640   3.365   5.650
  536    HD2  TYR 150           HD2      TYR 150 125.935   7.314   6.564
  537    HE1  TYR 150           HE1      TYR 150 122.736   4.276   4.387
  538    HE2  TYR 150           HE2      TYR 150 124.035   8.236   5.305
  539    HH   TYR 150           HH       TYR 150 121.405   6.353   4.303
  540    H    ASP 151           H        ASP 151 128.971   6.394   7.734
  541    HA   ASP 151           HA       ASP 151 128.466   8.784   6.372
  542   1HB   ASP 151          2HB       ASP 151 130.211   7.936   8.609
  543   2HB   ASP 151          1HB       ASP 151 130.679   9.423   7.789
  544    H    GLU 152           H        GLU 152 131.378   6.747   6.411
  545    HA   GLU 152           HA       GLU 152 132.864   8.382   4.635
  546   1HB   GLU 152          2HB       GLU 152 133.216   5.426   5.156
  547   2HB   GLU 152          1HB       GLU 152 134.422   6.532   4.509
  548   1HG   GLU 152          2HG       GLU 152 134.512   7.722   6.607
  549   2HG   GLU 152          1HG       GLU 152 133.222   6.716   7.263
  550    H    PHE 153           H        PHE 153 130.932   5.442   4.155
  551    HA   PHE 153           HA       PHE 153 131.446   5.125   1.417
  552   1HB   PHE 153          2HB       PHE 153 130.156   3.631   3.224
  553   2HB   PHE 153          1HB       PHE 153 128.761   4.377   2.452
  554    HD1  PHE 153           HD1      PHE 153 127.761   2.938   0.979
  555    HD2  PHE 153           HD2      PHE 153 132.012   3.039   1.193
  556    HE1  PHE 153           HE1      PHE 153 127.889   1.290  -0.844
  557    HE2  PHE 153           HE2      PHE 153 132.146   1.392  -0.629
  558    HZ   PHE 153           HZ       PHE 153 130.082   0.515  -1.650
  559    H    LEU 154           H        LEU 154 129.160   7.138   3.145
  560    HA   LEU 154           HA       LEU 154 127.565   7.839   0.903
  561   1HB   LEU 154          2HB       LEU 154 127.781   8.595   3.708
  562   2HB   LEU 154          1HB       LEU 154 127.393   9.962   2.682
  563    HG   LEU 154           HG       LEU 154 125.401   8.830   3.639
  564   1HD1  LEU 154          1HD1      LEU 154 124.729  10.005   1.820
  565   2HD1  LEU 154          2HD1      LEU 154 124.390   8.381   1.217
  566   3HD1  LEU 154          3HD1      LEU 154 125.874   9.208   0.742
  567   1HD2  LEU 154          1HD2      LEU 154 126.203   6.547   3.645
  568   2HD2  LEU 154          2HD2      LEU 154 126.294   6.547   1.883
  569   3HD2  LEU 154          3HD2      LEU 154 124.728   6.663   2.686
  570    H    GLU 155           H        GLU 155 130.271   9.455   2.543
  571    HA   GLU 155           HA       GLU 155 130.326  11.693   0.799
  572   1HB   GLU 155          2HB       GLU 155 132.112  10.576   2.902
  573   2HB   GLU 155          1HB       GLU 155 132.811  11.721   1.766
  574   1HG   GLU 155          2HG       GLU 155 130.396  12.864   2.572
  575   2HG   GLU 155          1HG       GLU 155 131.113  12.193   4.036
  576    H    PHE 156           H        PHE 156 131.965   8.579   0.821
  577    HA   PHE 156           HA       PHE 156 133.826   9.125  -1.225
  578   1HB   PHE 156          2HB       PHE 156 134.075   7.205   0.262
  579   2HB   PHE 156          1HB       PHE 156 132.595   6.494  -0.376
  580    HD1  PHE 156           HD1      PHE 156 133.168   4.566  -1.495
  581    HD2  PHE 156           HD2      PHE 156 135.507   8.072  -2.083
  582    HE1  PHE 156           HE1      PHE 156 134.471   3.400  -3.226
  583    HE2  PHE 156           HE2      PHE 156 136.814   6.913  -3.817
  584    HZ   PHE 156           HZ       PHE 156 136.296   4.575  -4.391
  585    H    MET 157           H        MET 157 130.576   7.699  -1.303
  586    HA   MET 157           HA       MET 157 130.585   7.334  -4.138
  587   1HB   MET 157          2HB       MET 157 128.914   6.606  -1.952
  588   2HB   MET 157          1HB       MET 157 127.917   7.451  -3.127
  589   1HG   MET 157          2HG       MET 157 127.718   5.389  -3.996
  590   2HG   MET 157          1HG       MET 157 129.234   5.822  -4.782
  591   1HE   MET 157          1HE       MET 157 129.358   3.194  -5.183
  592   2HE   MET 157          2HE       MET 157 130.555   2.379  -4.177
  593   3HE   MET 157          3HE       MET 157 130.953   3.910  -4.954
  594    H    LYS 158           H        LYS 158 129.588   9.873  -1.954
  595    HA   LYS 158           HA       LYS 158 128.120  11.338  -3.944
  596   1HB   LYS 158          2HB       LYS 158 127.709  11.422  -1.442
  597   2HB   LYS 158          1HB       LYS 158 129.172  12.392  -1.320
  598   1HG   LYS 158          2HG       LYS 158 127.817  13.735  -3.246
  599   2HG   LYS 158          1HG       LYS 158 126.492  13.124  -2.254
  600   1HD   LYS 158          2HD       LYS 158 127.817  14.027  -0.258
  601   2HD   LYS 158          1HD       LYS 158 128.766  14.915  -1.453
  602   1HE   LYS 158          2HE       LYS 158 127.207  16.508  -1.192
  603   2HE   LYS 158          1HE       LYS 158 126.229  15.488  -2.245
  604   1HZ   LYS 158          1HZ       LYS 158 125.714  14.390   0.119
  605   2HZ   LYS 158          2HZ       LYS 158 124.787  15.640  -0.544
  606   3HZ   LYS 158          3HZ       LYS 158 125.979  15.989   0.603
  607    H    GLY 159           H        GLY 159 130.202  11.004  -5.351
  608   1HA   GLY 159          2HA       GLY 159 131.418  12.603  -6.663
  609   2HA   GLY 159          1HA       GLY 159 131.676  13.548  -5.204
  610    H    VAL 160           H        VAL 160 132.476  10.418  -6.683
  611    HA   VAL 160           HA       VAL 160 134.589   9.762  -4.958
  612    HB   VAL 160           HB       VAL 160 134.420   8.980  -7.866
  613   1HG1  VAL 160          1HG1      VAL 160 136.384   8.055  -7.239
  614   2HG1  VAL 160          2HG1      VAL 160 135.330   6.813  -6.563
  615   3HG1  VAL 160          3HG1      VAL 160 135.975   8.084  -5.524
  616   1HG2  VAL 160          1HG2      VAL 160 133.195   6.953  -6.935
  617   2HG2  VAL 160          2HG2      VAL 160 132.284   8.459  -7.032
  618   3HG2  VAL 160          3HG2      VAL 160 132.929   7.917  -5.484
  619    H    GLU 161           H        GLU 161 134.460  11.743  -7.850
  620    HA   GLU 161           HA       GLU 161 137.316  12.004  -8.070
  621   1HB   GLU 161          2HB       GLU 161 135.203  13.736  -9.356
  622   2HB   GLU 161          1HB       GLU 161 136.869  13.526  -9.875
  623   1HG   GLU 161          2HG       GLU 161 136.006  10.974  -9.964
  624   2HG   GLU 161          1HG       GLU 161 134.513  11.834 -10.336
  Start of MODEL    7
    1   1H    MET  81          1HT       MET  81  94.495  21.677  -9.885
    2   2H    MET  81          2HT       MET  81  95.386  22.619 -11.009
    3   3H    MET  81          3HT       MET  81  94.825  23.326  -9.549
    4    HA   MET  81           HA       MET  81  97.027  22.956  -9.164
    5   1HB   MET  81          2HB       MET  81  95.407  20.615  -8.144
    6   2HB   MET  81          1HB       MET  81  97.000  21.044  -7.538
    7   1HG   MET  81          2HG       MET  81  96.128  23.235  -6.850
    8   2HG   MET  81          1HG       MET  81  94.528  22.754  -7.411
    9   1HE   MET  81          1HE       MET  81  96.837  23.236  -4.937
   10   2HE   MET  81          2HE       MET  81  96.779  21.970  -3.710
   11   3HE   MET  81          3HE       MET  81  95.576  23.259  -3.704
   12    H    VAL  82           H        VAL  82  95.552  20.354 -10.966
   13    HA   VAL  82           HA       VAL  82  96.408  18.572 -12.124
   14    HB   VAL  82           HB       VAL  82  98.173  19.171 -13.728
   15   1HG1  VAL  82          1HG1      VAL  82  95.808  19.804 -14.107
   16   2HG1  VAL  82          2HG1      VAL  82  96.955  20.886 -14.897
   17   3HG1  VAL  82          3HG1      VAL  82  96.153  21.386 -13.407
   18   1HG2  VAL  82          1HG2      VAL  82  99.288  21.263 -13.705
   19   2HG2  VAL  82          2HG2      VAL  82  99.456  20.589 -12.084
   20   3HG2  VAL  82          3HG2      VAL  82  98.278  21.866 -12.392
   21    H    ARG  83           H        ARG  83  97.292  18.618  -9.405
   22    HA   ARG  83           HA       ARG  83  99.542  16.838  -9.649
   23   1HB   ARG  83          2HB       ARG  83 100.235  19.438  -9.326
   24   2HB   ARG  83          1HB       ARG  83 100.072  18.946  -7.645
   25   1HG   ARG  83          2HG       ARG  83 101.748  17.304  -7.858
   26   2HG   ARG  83          1HG       ARG  83 101.735  17.411  -9.619
   27   1HD   ARG  83          2HD       ARG  83 102.322  19.916  -8.178
   28   2HD   ARG  83          1HD       ARG  83 103.543  18.652  -8.049
   29    HE   ARG  83           HE       ARG  83 102.679  19.104 -10.743
   30   1HH1  ARG  83          1HH1      ARG  83 104.839  20.209  -8.233
   31   2HH1  ARG  83          2HH1      ARG  83 105.972  20.905  -9.343
   32   1HH2  ARG  83          1HH2      ARG  83 104.169  20.020 -12.203
   33   2HH2  ARG  83          2HH2      ARG  83 105.593  20.798 -11.596
   34    H    CYS  84           H        CYS  84  98.928  15.175  -8.446
   35    HA   CYS  84           HA       CYS  84  98.081  15.613  -5.702
   36   1HB   CYS  84          2HB       CYS  84  96.092  15.413  -7.508
   37   2HB   CYS  84          1HB       CYS  84  96.364  13.704  -7.185
   38    HG   CYS  84           HG       CYS  84  94.558  14.927  -5.561
   39    H    MET  85           H        MET  85  98.546  13.184  -8.258
   40    HA   MET  85           HA       MET  85  99.075  11.017  -6.548
   41   1HB   MET  85          2HB       MET  85  98.768  11.327  -9.246
   42   2HB   MET  85          1HB       MET  85 100.491  10.997  -9.127
   43   1HG   MET  85          2HG       MET  85  99.618   8.892  -9.384
   44   2HG   MET  85          1HG       MET  85  99.749   9.016  -7.631
   45   1HE   MET  85          1HE       MET  85  98.145   7.958  -6.343
   46   2HE   MET  85          2HE       MET  85  97.877   6.809  -7.652
   47   3HE   MET  85          3HE       MET  85  96.502   7.521  -6.810
   48    H    LYS  86           H        LYS  86 101.359  13.039  -8.399
   49    HA   LYS  86           HA       LYS  86 103.493  12.168  -6.576
   50   1HB   LYS  86          2HB       LYS  86 103.718  11.866  -9.097
   51   2HB   LYS  86          1HB       LYS  86 103.861  13.617  -9.193
   52   1HG   LYS  86          2HG       LYS  86 105.713  13.069  -7.302
   53   2HG   LYS  86          1HG       LYS  86 105.799  11.607  -8.288
   54   1HD   LYS  86          2HD       LYS  86 105.808  14.297  -9.595
   55   2HD   LYS  86          1HD       LYS  86 107.291  13.659  -8.881
   56   1HE   LYS  86          2HE       LYS  86 106.647  11.518 -10.262
   57   2HE   LYS  86          1HE       LYS  86 105.727  12.674 -11.221
   58   1HZ   LYS  86          1HZ       LYS  86 108.062  13.933 -11.038
   59   2HZ   LYS  86          2HZ       LYS  86 107.674  12.876 -12.299
   60   3HZ   LYS  86          3HZ       LYS  86 108.599  12.329 -10.993
   61    H    ASP  87           H        ASP  87 102.684  13.647  -4.935
   62    HA   ASP  87           HA       ASP  87 103.021  16.491  -5.491
   63   1HB   ASP  87          2HB       ASP  87 101.586  14.889  -3.496
   64   2HB   ASP  87          1HB       ASP  87 102.394  16.299  -2.818
   65    H    ASP  88           H        ASP  88 104.023  14.355  -2.812
   66    HA   ASP  88           HA       ASP  88 106.507  15.921  -2.621
   67   1HB   ASP  88          2HB       ASP  88 104.686  15.429  -0.654
   68   2HB   ASP  88          1HB       ASP  88 105.822  14.106  -0.399
   69    H    SER  89           H        SER  89 106.072  13.756  -4.510
   70    HA   SER  89           HA       SER  89 107.646  11.543  -3.460
   71   1HB   SER  89          2HB       SER  89 105.577  11.560  -5.198
   72   2HB   SER  89          1HB       SER  89 106.925  11.607  -6.334
   73    HG   SER  89           HG       SER  89 106.053   9.472  -5.450
   74    H    LYS  90           H        LYS  90 109.784  11.667  -3.486
   75    HA   LYS  90           HA       LYS  90 111.097  13.329  -5.513
   76   1HB   LYS  90          2HB       LYS  90 113.094  13.145  -4.032
   77   2HB   LYS  90          1HB       LYS  90 111.710  13.910  -3.261
   78   1HG   LYS  90          2HG       LYS  90 111.234  11.966  -1.988
   79   2HG   LYS  90          1HG       LYS  90 112.381  10.999  -2.918
   80   1HD   LYS  90          2HD       LYS  90 113.519  11.478  -0.933
   81   2HD   LYS  90          1HD       LYS  90 114.155  12.655  -2.084
   82   1HE   LYS  90          2HE       LYS  90 112.012  13.987  -1.051
   83   2HE   LYS  90          1HE       LYS  90 112.560  13.055   0.343
   84   1HZ   LYS  90          1HZ       LYS  90 114.460  14.231   0.494
   85   2HZ   LYS  90          2HZ       LYS  90 113.563  15.418  -0.311
   86   3HZ   LYS  90          3HZ       LYS  90 114.625  14.426  -1.179
   87    H    GLY  91           H        GLY  91 113.468  12.402  -5.934
   88   1HA   GLY  91          2HA       GLY  91 113.020   9.889  -7.296
   89   2HA   GLY  91          1HA       GLY  91 114.461  10.889  -7.396
   90    H    LYS  92           H        LYS  92 116.233  10.133  -6.449
   91    HA   LYS  92           HA       LYS  92 115.928   7.966  -4.483
   92   1HB   LYS  92          2HB       LYS  92 117.932   8.530  -6.615
   93   2HB   LYS  92          1HB       LYS  92 118.482   7.701  -5.166
   94   1HG   LYS  92          2HG       LYS  92 116.817   5.956  -5.522
   95   2HG   LYS  92          1HG       LYS  92 116.247   6.793  -6.968
   96   1HD   LYS  92          2HD       LYS  92 118.498   6.546  -7.956
   97   2HD   LYS  92          1HD       LYS  92 118.999   5.633  -6.531
   98   1HE   LYS  92          2HE       LYS  92 117.148   4.019  -7.028
   99   2HE   LYS  92          1HE       LYS  92 116.891   4.877  -8.546
  100   1HZ   LYS  92          1HZ       LYS  92 118.502   2.789  -8.314
  101   2HZ   LYS  92          2HZ       LYS  92 119.616   4.022  -7.998
  102   3HZ   LYS  92          3HZ       LYS  92 118.750   4.017  -9.453
  103    H    THR  93           H        THR  93 116.386   8.432  -2.444
  104    HA   THR  93           HA       THR  93 117.991  10.814  -1.859
  105    HB   THR  93           HB       THR  93 115.822  10.803  -0.804
  106    HG1  THR  93           HG1      THR  93 116.479  11.035   1.326
  107   1HG2  THR  93          1HG2      THR  93 115.593   8.989   1.100
  108   2HG2  THR  93          2HG2      THR  93 116.533   8.032  -0.047
  109   3HG2  THR  93          3HG2      THR  93 114.981   8.719  -0.533
  110    H    GLU  94           H        GLU  94 119.158  10.524   0.405
  111    HA   GLU  94           HA       GLU  94 121.325   8.812  -0.021
  112   1HB   GLU  94          2HB       GLU  94 120.353  10.455   2.267
  113   2HB   GLU  94          1HB       GLU  94 121.598   9.255   2.587
  114   1HG   GLU  94          2HG       GLU  94 123.009  10.275   0.860
  115   2HG   GLU  94          1HG       GLU  94 121.767  11.497   0.588
  116    H    GLU  95           H        GLU  95 118.243   8.204   1.393
  117    HA   GLU  95           HA       GLU  95 118.829   6.090   3.116
  118   1HB   GLU  95          2HB       GLU  95 116.452   7.119   1.734
  119   2HB   GLU  95          1HB       GLU  95 116.384   5.397   2.080
  120   1HG   GLU  95          2HG       GLU  95 116.978   5.969   4.459
  121   2HG   GLU  95          1HG       GLU  95 116.716   7.659   4.028
  122    H    GLU  96           H        GLU  96 118.456   6.164  -0.376
  123    HA   GLU  96           HA       GLU  96 118.345   3.356  -0.755
  124   1HB   GLU  96          2HB       GLU  96 118.708   3.820  -3.094
  125   2HB   GLU  96          1HB       GLU  96 117.602   5.020  -2.441
  126   1HG   GLU  96          2HG       GLU  96 118.902   6.580  -3.312
  127   2HG   GLU  96          1HG       GLU  96 120.131   6.137  -2.126
  128    H    LEU  97           H        LEU  97 120.962   5.638  -0.386
  129    HA   LEU  97           HA       LEU  97 123.050   4.041  -1.403
  130   1HB   LEU  97          2HB       LEU  97 122.856   6.419   0.365
  131   2HB   LEU  97          1HB       LEU  97 124.360   5.519   0.394
  132    HG   LEU  97           HG       LEU  97 123.231   6.359  -2.242
  133   1HD1  LEU  97          1HD1      LEU  97 125.049   8.193  -0.742
  134   2HD1  LEU  97          2HD1      LEU  97 123.305   8.293  -0.501
  135   3HD1  LEU  97          3HD1      LEU  97 123.989   8.532  -2.109
  136   1HD2  LEU  97          1HD2      LEU  97 125.352   4.884  -1.677
  137   2HD2  LEU  97          2HD2      LEU  97 126.101   6.469  -1.478
  138   3HD2  LEU  97          3HD2      LEU  97 125.353   6.033  -3.015
  139    H    SER  98           H        SER  98 121.361   4.039   1.635
  140    HA   SER  98           HA       SER  98 123.212   2.745   3.268
  141   1HB   SER  98          2HB       SER  98 120.320   2.032   3.502
  142   2HB   SER  98          1HB       SER  98 121.478   2.452   4.763
  143    HG   SER  98           HG       SER  98 121.401   4.632   3.776
  144    H    ASP  99           H        ASP  99 121.142   1.498   0.749
  145    HA   ASP  99           HA       ASP  99 121.431  -1.254   1.447
  146   1HB   ASP  99          2HB       ASP  99 120.082   0.296  -0.598
  147   2HB   ASP  99          1HB       ASP  99 120.850  -1.131  -1.288
  148    H    LEU 100           H        LEU 100 123.111   0.953  -0.727
  149    HA   LEU 100           HA       LEU 100 124.677  -0.900  -2.108
  150   1HB   LEU 100          2HB       LEU 100 125.101   1.984  -1.374
  151   2HB   LEU 100          1HB       LEU 100 126.298   1.089  -2.289
  152    HG   LEU 100           HG       LEU 100 124.669   2.526  -3.610
  153   1HD1  LEU 100          1HD1      LEU 100 124.230   0.446  -5.208
  154   2HD1  LEU 100          2HD1      LEU 100 125.400  -0.298  -4.118
  155   3HD1  LEU 100          3HD1      LEU 100 125.828   1.165  -5.005
  156   1HD2  LEU 100          1HD2      LEU 100 122.806   0.257  -2.925
  157   2HD2  LEU 100          2HD2      LEU 100 122.498   1.521  -4.116
  158   3HD2  LEU 100          3HD2      LEU 100 122.637   1.933  -2.406
  159    H    PHE 101           H        PHE 101 125.145   0.632   1.028
  160    HA   PHE 101           HA       PHE 101 127.803  -0.275   1.428
  161   1HB   PHE 101          2HB       PHE 101 126.854   1.613   2.682
  162   2HB   PHE 101          1HB       PHE 101 125.712   0.526   3.465
  163    HD1  PHE 101           HD1      PHE 101 126.261  -0.456   5.485
  164    HD2  PHE 101           HD2      PHE 101 129.361   1.093   3.015
  165    HE1  PHE 101           HE1      PHE 101 127.893  -0.880   7.276
  166    HE2  PHE 101           HE2      PHE 101 130.999   0.669   4.802
  167    HZ   PHE 101           HZ       PHE 101 130.266  -0.318   6.935
  168    H    ARG 102           H        ARG 102 124.634  -1.546   2.354
  169    HA   ARG 102           HA       ARG 102 125.501  -3.670   3.951
  170   1HB   ARG 102          2HB       ARG 102 123.067  -2.696   3.156
  171   2HB   ARG 102          1HB       ARG 102 123.132  -4.233   2.305
  172   1HG   ARG 102          2HG       ARG 102 123.530  -5.394   4.411
  173   2HG   ARG 102          1HG       ARG 102 123.489  -3.853   5.271
  174   1HD   ARG 102          2HD       ARG 102 121.154  -3.580   4.205
  175   2HD   ARG 102          1HD       ARG 102 121.255  -5.315   3.908
  176    HE   ARG 102           HE       ARG 102 121.854  -5.069   6.548
  177   1HH1  ARG 102          1HH1      ARG 102 119.190  -4.010   4.556
  178   2HH1  ARG 102          2HH1      ARG 102 118.033  -4.094   5.841
  179   1HH2  ARG 102          1HH2      ARG 102 120.333  -5.178   8.240
  180   2HH2  ARG 102          2HH2      ARG 102 118.681  -4.755   7.933
  181    H    MET 103           H        MET 103 125.352  -3.314   0.485
  182    HA   MET 103           HA       MET 103 125.521  -6.022  -0.250
  183   1HB   MET 103          2HB       MET 103 126.191  -3.431  -1.582
  184   2HB   MET 103          1HB       MET 103 126.729  -4.931  -2.325
  185   1HG   MET 103          2HG       MET 103 123.931  -4.993  -1.526
  186   2HG   MET 103          1HG       MET 103 124.295  -3.724  -2.693
  187   1HE   MET 103          1HE       MET 103 122.602  -6.764  -2.697
  188   2HE   MET 103          2HE       MET 103 124.026  -7.520  -1.985
  189   3HE   MET 103          3HE       MET 103 123.491  -7.991  -3.597
  190    H    PHE 104           H        PHE 104 127.999  -3.643   0.554
  191    HA   PHE 104           HA       PHE 104 130.184  -5.390  -0.086
  192   1HB   PHE 104          2HB       PHE 104 129.925  -2.693   1.195
  193   2HB   PHE 104          1HB       PHE 104 131.445  -3.571   1.319
  194    HD1  PHE 104           HD1      PHE 104 132.672  -4.194  -0.759
  195    HD2  PHE 104           HD2      PHE 104 129.298  -1.600  -0.795
  196    HE1  PHE 104           HE1      PHE 104 133.324  -3.383  -2.990
  197    HE2  PHE 104           HE2      PHE 104 129.944  -0.785  -3.024
  198    HZ   PHE 104           HZ       PHE 104 131.958  -1.677  -4.125
  199    H    ASP 105           H        ASP 105 128.584  -4.330   2.892
  200    HA   ASP 105           HA       ASP 105 130.286  -5.589   4.719
  201   1HB   ASP 105          2HB       ASP 105 127.657  -4.342   4.768
  202   2HB   ASP 105          1HB       ASP 105 127.756  -5.705   5.878
  203    H    LYS 106           H        LYS 106 130.776  -7.669   4.849
  204    HA   LYS 106           HA       LYS 106 129.110  -9.701   3.691
  205   1HB   LYS 106          2HB       LYS 106 131.599  -9.786   3.662
  206   2HB   LYS 106          1HB       LYS 106 131.579 -10.018   5.405
  207   1HG   LYS 106          2HG       LYS 106 131.842 -12.162   4.544
  208   2HG   LYS 106          1HG       LYS 106 130.124 -12.066   4.935
  209   1HD   LYS 106          2HD       LYS 106 130.817 -11.196   2.217
  210   2HD   LYS 106          1HD       LYS 106 131.129 -12.901   2.548
  211   1HE   LYS 106          2HE       LYS 106 128.834 -13.209   3.272
  212   2HE   LYS 106          1HE       LYS 106 128.509 -11.491   3.045
  213   1HZ   LYS 106          1HZ       LYS 106 128.681 -11.698   0.736
  214   2HZ   LYS 106          2HZ       LYS 106 127.784 -13.051   1.210
  215   3HZ   LYS 106          3HZ       LYS 106 129.423 -13.216   0.822
  216    H    ASN 107           H        ASN 107 130.475  -9.466   6.977
  217    HA   ASN 107           HA       ASN 107 128.427 -11.165   8.047
  218   1HB   ASN 107          2HB       ASN 107 129.521 -10.555  10.258
  219   2HB   ASN 107          1HB       ASN 107 130.562 -11.340   9.074
  220   1HD2  ASN 107          1HD2      ASN 107 129.584  -8.145  10.232
  221   2HD2  ASN 107          2HD2      ASN 107 131.123  -7.397   9.996
  222    H    ALA 108           H        ALA 108 128.782  -7.780   7.563
  223    HA   ALA 108           HA       ALA 108 127.377  -6.030   7.942
  224   1HB   ALA 108          1HB       ALA 108 125.339  -7.893   9.107
  225   2HB   ALA 108          2HB       ALA 108 125.654  -7.855   7.373
  226   3HB   ALA 108          3HB       ALA 108 125.093  -6.401   8.199
  227    H    ASP 109           H        ASP 109 129.075  -5.624   9.611
  228    HA   ASP 109           HA       ASP 109 127.977  -5.816  12.337
  229   1HB   ASP 109          2HB       ASP 109 130.263  -5.622  13.155
  230   2HB   ASP 109          1HB       ASP 109 130.140  -6.959  12.015
  231    H    GLY 110           H        GLY 110 128.778  -3.662   9.811
  232   1HA   GLY 110          2HA       GLY 110 127.738  -1.413  10.186
  233   2HA   GLY 110          1HA       GLY 110 128.656  -1.382  11.685
  234    H    TYR 111           H        TYR 111 130.939  -2.741  10.249
  235    HA   TYR 111           HA       TYR 111 131.861  -0.463   8.633
  236   1HB   TYR 111          2HB       TYR 111 133.525  -1.946  10.680
  237   2HB   TYR 111          1HB       TYR 111 134.067  -0.610   9.668
  238    HD1  TYR 111           HD1      TYR 111 133.803   1.607  10.383
  239    HD2  TYR 111           HD2      TYR 111 131.663  -1.492  12.362
  240    HE1  TYR 111           HE1      TYR 111 133.094   3.208  12.110
  241    HE2  TYR 111           HE2      TYR 111 130.948   0.100  14.094
  242    HH   TYR 111           HH       TYR 111 131.281   3.456  13.757
  243    H    ILE 112           H        ILE 112 133.970  -1.087   7.451
  244    HA   ILE 112           HA       ILE 112 133.825  -3.886   6.552
  245    HB   ILE 112           HB       ILE 112 134.293  -1.549   4.703
  246   1HG1  ILE 112          2HG1      ILE 112 131.784  -3.216   4.960
  247   2HG1  ILE 112          1HG1      ILE 112 131.971  -1.614   5.667
  248   1HG2  ILE 112          1HG2      ILE 112 135.068  -4.085   4.344
  249   2HG2  ILE 112          2HG2      ILE 112 134.552  -3.040   3.021
  250   3HG2  ILE 112          3HG2      ILE 112 133.422  -4.196   3.725
  251   1HD1  ILE 112          1HD1      ILE 112 132.103  -2.281   2.736
  252   2HD1  ILE 112          2HD1      ILE 112 132.300  -0.675   3.438
  253   3HD1  ILE 112          3HD1      ILE 112 130.755  -1.514   3.575
  254    H    ASP 113           H        ASP 113 135.745  -4.889   6.181
  255    HA   ASP 113           HA       ASP 113 138.194  -3.272   6.323
  256   1HB   ASP 113          2HB       ASP 113 137.470  -4.536   8.508
  257   2HB   ASP 113          1HB       ASP 113 138.102  -5.947   7.667
  258    H    LEU 114           H        LEU 114 140.156  -4.698   5.744
  259    HA   LEU 114           HA       LEU 114 139.856  -5.601   3.116
  260   1HB   LEU 114          2HB       LEU 114 141.966  -4.935   4.641
  261   2HB   LEU 114          1HB       LEU 114 142.116  -6.681   4.694
  262    HG   LEU 114           HG       LEU 114 143.498  -5.865   2.919
  263   1HD1  LEU 114          1HD1      LEU 114 140.967  -7.066   1.804
  264   2HD1  LEU 114          2HD1      LEU 114 142.340  -7.950   2.467
  265   3HD1  LEU 114          3HD1      LEU 114 142.528  -7.015   0.984
  266   1HD2  LEU 114          1HD2      LEU 114 141.026  -4.430   1.967
  267   2HD2  LEU 114          2HD2      LEU 114 142.495  -4.613   1.008
  268   3HD2  LEU 114          3HD2      LEU 114 142.537  -3.711   2.524
  269    H    GLU 115           H        GLU 115 140.102  -7.414   6.152
  270    HA   GLU 115           HA       GLU 115 140.141  -9.988   5.058
  271   1HB   GLU 115          2HB       GLU 115 139.318 -10.729   7.283
  272   2HB   GLU 115          1HB       GLU 115 140.685  -9.627   7.382
  273   1HG   GLU 115          2HG       GLU 115 138.783  -7.824   7.604
  274   2HG   GLU 115          1HG       GLU 115 137.850  -9.213   8.158
  275    H    GLU 116           H        GLU 116 137.402  -7.997   6.129
  276    HA   GLU 116           HA       GLU 116 135.432  -9.939   5.447
  277   1HB   GLU 116          2HB       GLU 116 135.133  -8.088   7.120
  278   2HB   GLU 116          1HB       GLU 116 135.043  -6.961   5.772
  279   1HG   GLU 116          2HG       GLU 116 133.113  -8.338   4.909
  280   2HG   GLU 116          1HG       GLU 116 133.133  -9.170   6.464
  281    H    LEU 117           H        LEU 117 136.873  -7.195   3.787
  282    HA   LEU 117           HA       LEU 117 135.068  -7.154   1.599
  283   1HB   LEU 117          2HB       LEU 117 136.793  -5.377   2.405
  284   2HB   LEU 117          1HB       LEU 117 137.917  -6.257   1.388
  285    HG   LEU 117           HG       LEU 117 136.512  -5.834  -0.568
  286   1HD1  LEU 117          1HD1      LEU 117 134.639  -4.181  -0.319
  287   2HD1  LEU 117          2HD1      LEU 117 134.741  -4.436   1.423
  288   3HD1  LEU 117          3HD1      LEU 117 134.328  -5.781   0.357
  289   1HD2  LEU 117          1HD2      LEU 117 136.600  -3.176  -0.263
  290   2HD2  LEU 117          2HD2      LEU 117 138.035  -4.161  -0.548
  291   3HD2  LEU 117          3HD2      LEU 117 137.624  -3.657   1.091
  292    H    LYS 118           H        LYS 118 137.959  -8.974   2.314
  293    HA   LYS 118           HA       LYS 118 138.494  -9.882  -0.314
  294   1HB   LYS 118          2HB       LYS 118 139.832 -10.023   2.028
  295   2HB   LYS 118          1HB       LYS 118 139.189 -11.658   1.950
  296   1HG   LYS 118          2HG       LYS 118 140.154 -11.405  -0.553
  297   2HG   LYS 118          1HG       LYS 118 141.272 -10.362   0.328
  298   1HD   LYS 118          2HD       LYS 118 141.867 -12.151   1.812
  299   2HD   LYS 118          1HD       LYS 118 140.613 -13.193   1.134
  300   1HE   LYS 118          2HE       LYS 118 142.020 -12.552  -1.094
  301   2HE   LYS 118          1HE       LYS 118 143.298 -12.549   0.122
  302   1HZ   LYS 118          1HZ       LYS 118 141.413 -14.788  -0.393
  303   2HZ   LYS 118          2HZ       LYS 118 142.655 -14.786   0.755
  304   3HZ   LYS 118          3HZ       LYS 118 143.028 -14.728  -0.892
  305    H    ILE 119           H        ILE 119 136.240 -10.875   2.132
  306    HA   ILE 119           HA       ILE 119 135.737 -13.491   1.139
  307    HB   ILE 119           HB       ILE 119 133.857 -11.761   2.745
  308   1HG1  ILE 119          2HG1      ILE 119 135.822 -13.774   3.838
  309   2HG1  ILE 119          1HG1      ILE 119 136.204 -12.060   3.703
  310   1HG2  ILE 119          1HG2      ILE 119 134.062 -14.760   2.720
  311   2HG2  ILE 119          2HG2      ILE 119 132.996 -13.870   1.632
  312   3HG2  ILE 119          3HG2      ILE 119 132.770 -13.755   3.377
  313   1HD1  ILE 119          1HD1      ILE 119 134.128 -11.643   5.093
  314   2HD1  ILE 119          2HD1      ILE 119 135.500 -12.385   5.913
  315   3HD1  ILE 119          3HD1      ILE 119 134.128 -13.375   5.417
  316    H    MET 120           H        MET 120 134.097 -10.369   0.705
  317    HA   MET 120           HA       MET 120 132.019 -11.339  -0.934
  318   1HB   MET 120          2HB       MET 120 131.608  -9.014  -1.504
  319   2HB   MET 120          1HB       MET 120 131.934  -9.165   0.218
  320   1HG   MET 120          2HG       MET 120 133.794  -7.922   0.112
  321   2HG   MET 120          1HG       MET 120 134.291  -8.609  -1.433
  322   1HE   MET 120          1HE       MET 120 132.451  -6.871  -4.053
  323   2HE   MET 120          2HE       MET 120 133.531  -8.150  -3.500
  324   3HE   MET 120          3HE       MET 120 134.151  -6.518  -3.749
  325    H    LEU 121           H        LEU 121 135.317 -10.459  -1.597
  326    HA   LEU 121           HA       LEU 121 135.084 -10.062  -4.385
  327   1HB   LEU 121          2HB       LEU 121 137.024  -9.377  -2.957
  328   2HB   LEU 121          1HB       LEU 121 137.494 -11.065  -2.872
  329    HG   LEU 121           HG       LEU 121 137.135 -10.078  -5.610
  330   1HD1  LEU 121          1HD1      LEU 121 138.741  -8.482  -5.724
  331   2HD1  LEU 121          2HD1      LEU 121 139.646  -9.136  -4.358
  332   3HD1  LEU 121          3HD1      LEU 121 138.192  -8.177  -4.076
  333   1HD2  LEU 121          1HD2      LEU 121 138.729 -11.608  -6.064
  334   2HD2  LEU 121          2HD2      LEU 121 138.290 -12.227  -4.470
  335   3HD2  LEU 121          3HD2      LEU 121 139.696 -11.178  -4.653
  336    H    GLN 122           H        GLN 122 135.393 -12.915  -2.398
  337    HA   GLN 122           HA       GLN 122 136.224 -14.757  -4.331
  338   1HB   GLN 122          2HB       GLN 122 134.569 -15.052  -1.832
  339   2HB   GLN 122          1HB       GLN 122 134.990 -16.432  -2.837
  340   1HG   GLN 122          2HG       GLN 122 137.412 -15.229  -2.480
  341   2HG   GLN 122          1HG       GLN 122 136.612 -14.919  -0.941
  342   1HE2  GLN 122          1HE2      GLN 122 138.435 -17.084  -2.672
  343   2HE2  GLN 122          2HE2      GLN 122 138.167 -18.497  -1.714
  344    H    ALA 123           H        ALA 123 133.089 -13.369  -3.667
  345    HA   ALA 123           HA       ALA 123 131.477 -15.202  -5.048
  346   1HB   ALA 123          1HB       ALA 123 131.033 -12.240  -4.701
  347   2HB   ALA 123          2HB       ALA 123 130.593 -13.485  -3.533
  348   3HB   ALA 123          3HB       ALA 123 129.806 -13.438  -5.112
  349    H    THR 124           H        THR 124 133.017 -12.196  -6.161
  350    HA   THR 124           HA       THR 124 132.050 -12.257  -8.788
  351    HB   THR 124           HB       THR 124 133.985 -10.774  -9.309
  352    HG1  THR 124           HG1      THR 124 134.682 -11.174  -6.592
  353   1HG2  THR 124          1HG2      THR 124 133.438  -9.343  -6.994
  354   2HG2  THR 124          2HG2      THR 124 131.972 -10.269  -7.319
  355   3HG2  THR 124          3HG2      THR 124 132.630  -9.199  -8.556
  356    H    GLY 125           H        GLY 125 132.951 -12.980 -10.729
  357   1HA   GLY 125          2HA       GLY 125 134.713 -15.300 -10.411
  358   2HA   GLY 125          1HA       GLY 125 133.709 -14.949 -11.810
  359    H    GLU 126           H        GLU 126 135.729 -12.513 -10.343
  360    HA   GLU 126           HA       GLU 126 137.288 -12.386 -12.815
  361   1HB   GLU 126          2HB       GLU 126 137.064 -10.430 -10.521
  362   2HB   GLU 126          1HB       GLU 126 138.011 -10.170 -11.980
  363   1HG   GLU 126          2HG       GLU 126 135.680 -10.653 -13.134
  364   2HG   GLU 126          1HG       GLU 126 135.076 -10.087 -11.576
  365    H    THR 127           H        THR 127 139.638 -11.578 -12.416
  366    HA   THR 127           HA       THR 127 140.854 -13.458 -10.518
  367    HB   THR 127           HB       THR 127 142.939 -13.037 -11.898
  368    HG1  THR 127           HG1      THR 127 141.100 -11.907 -13.729
  369   1HG2  THR 127          1HG2      THR 127 140.934 -14.818 -12.341
  370   2HG2  THR 127          2HG2      THR 127 142.479 -14.789 -13.195
  371   3HG2  THR 127          3HG2      THR 127 141.062 -14.016 -13.907
  372    H    ILE 128           H        ILE 128 140.408 -11.951  -8.757
  373    HA   ILE 128           HA       ILE 128 142.252  -9.655  -8.708
  374    HB   ILE 128           HB       ILE 128 139.908 -10.100  -6.863
  375   1HG1  ILE 128          2HG1      ILE 128 139.979  -8.245  -9.246
  376   2HG1  ILE 128          1HG1      ILE 128 139.291  -9.863  -9.319
  377   1HG2  ILE 128          1HG2      ILE 128 141.352  -8.600  -5.831
  378   2HG2  ILE 128          2HG2      ILE 128 140.219  -7.547  -6.677
  379   3HG2  ILE 128          3HG2      ILE 128 141.818  -7.849  -7.356
  380   1HD1  ILE 128          1HD1      ILE 128 137.739  -9.208  -7.489
  381   2HD1  ILE 128          2HD1      ILE 128 137.522  -8.307  -8.990
  382   3HD1  ILE 128          3HD1      ILE 128 138.357  -7.561  -7.628
  383    H    THR 129           H        THR 129 143.549  -9.302  -6.879
  384    HA   THR 129           HA       THR 129 144.003 -11.714  -5.256
  385    HB   THR 129           HB       THR 129 146.294 -10.943  -4.969
  386    HG1  THR 129           HG1      THR 129 145.454  -8.717  -6.506
  387   1HG2  THR 129          1HG2      THR 129 145.691 -10.632  -7.889
  388   2HG2  THR 129          2HG2      THR 129 145.666 -12.193  -7.069
  389   3HG2  THR 129          3HG2      THR 129 147.157 -11.252  -7.129
  390    H    GLU 130           H        GLU 130 145.419 -10.825  -3.181
  391    HA   GLU 130           HA       GLU 130 143.443  -9.503  -1.581
  392   1HB   GLU 130          2HB       GLU 130 145.132 -11.355  -0.896
  393   2HB   GLU 130          1HB       GLU 130 146.262 -10.024  -0.687
  394   1HG   GLU 130          2HG       GLU 130 143.975  -9.203   0.651
  395   2HG   GLU 130          1HG       GLU 130 144.120 -10.918   1.029
  396    H    ASP 131           H        ASP 131 146.427  -8.589  -3.151
  397    HA   ASP 131           HA       ASP 131 146.760  -6.118  -1.764
  398   1HB   ASP 131          2HB       ASP 131 148.119  -7.584  -3.876
  399   2HB   ASP 131          1HB       ASP 131 148.057  -5.858  -4.220
  400    H    ASP 132           H        ASP 132 145.027  -7.134  -4.620
  401    HA   ASP 132           HA       ASP 132 144.588  -4.558  -5.718
  402   1HB   ASP 132          2HB       ASP 132 143.420  -7.273  -6.119
  403   2HB   ASP 132          1HB       ASP 132 142.526  -5.887  -6.736
  404    H    ILE 133           H        ILE 133 142.857  -6.524  -3.372
  405    HA   ILE 133           HA       ILE 133 140.489  -5.003  -3.264
  406    HB   ILE 133           HB       ILE 133 141.725  -6.578  -1.002
  407   1HG1  ILE 133          2HG1      ILE 133 139.597  -7.729  -2.734
  408   2HG1  ILE 133          1HG1      ILE 133 141.222  -7.646  -3.409
  409   1HG2  ILE 133          1HG2      ILE 133 139.511  -6.738  -0.116
  410   2HG2  ILE 133          2HG2      ILE 133 138.827  -5.962  -1.544
  411   3HG2  ILE 133          3HG2      ILE 133 139.843  -5.036  -0.440
  412   1HD1  ILE 133          1HD1      ILE 133 141.682  -8.699  -0.934
  413   2HD1  ILE 133          2HD1      ILE 133 141.516  -9.621  -2.428
  414   3HD1  ILE 133          3HD1      ILE 133 140.126  -9.406  -1.364
  415    H    GLU 134           H        GLU 134 143.628  -4.580  -1.797
  416    HA   GLU 134           HA       GLU 134 142.960  -2.797   0.254
  417   1HB   GLU 134          2HB       GLU 134 145.467  -3.152  -1.380
  418   2HB   GLU 134          1HB       GLU 134 145.358  -1.973  -0.079
  419   1HG   GLU 134          2HG       GLU 134 144.714  -3.871   1.438
  420   2HG   GLU 134          1HG       GLU 134 145.137  -4.963   0.120
  421    H    GLU 135           H        GLU 135 143.333  -2.324  -3.183
  422    HA   GLU 135           HA       GLU 135 143.597   0.483  -3.193
  423   1HB   GLU 135          2HB       GLU 135 142.856  -1.597  -5.185
  424   2HB   GLU 135          1HB       GLU 135 142.418   0.064  -5.559
  425   1HG   GLU 135          2HG       GLU 135 144.765   0.728  -5.260
  426   2HG   GLU 135          1HG       GLU 135 145.184  -0.957  -4.954
  427    H    LEU 136           H        LEU 136 140.816  -1.641  -3.006
  428    HA   LEU 136           HA       LEU 136 138.842   0.321  -3.551
  429   1HB   LEU 136          2HB       LEU 136 138.887  -2.431  -2.451
  430   2HB   LEU 136          1HB       LEU 136 137.487  -1.453  -2.057
  431    HG   LEU 136           HG       LEU 136 137.727  -1.071  -4.773
  432   1HD1  LEU 136          1HD1      LEU 136 139.447  -2.783  -4.946
  433   2HD1  LEU 136          2HD1      LEU 136 137.962  -3.304  -5.744
  434   3HD1  LEU 136          3HD1      LEU 136 138.383  -3.948  -4.157
  435   1HD2  LEU 136          1HD2      LEU 136 135.921  -3.043  -4.694
  436   2HD2  LEU 136          2HD2      LEU 136 135.588  -1.409  -4.117
  437   3HD2  LEU 136          3HD2      LEU 136 136.022  -2.678  -2.971
  438    H    MET 137           H        MET 137 140.527  -0.678  -0.651
  439    HA   MET 137           HA       MET 137 138.797   0.745   1.144
  440   1HB   MET 137          2HB       MET 137 141.537  -0.472   1.514
  441   2HB   MET 137          1HB       MET 137 140.617   0.278   2.811
  442   1HG   MET 137          2HG       MET 137 138.882  -1.561   1.610
  443   2HG   MET 137          1HG       MET 137 140.438  -2.377   1.741
  444   1HE   MET 137          1HE       MET 137 137.579  -0.678   4.557
  445   2HE   MET 137          2HE       MET 137 137.270  -2.411   4.441
  446   3HE   MET 137          3HE       MET 137 137.365  -1.431   2.977
  447    H    LYS 138           H        LYS 138 141.728   1.439  -0.623
  448    HA   LYS 138           HA       LYS 138 142.605   3.690   0.792
  449   1HB   LYS 138          2HB       LYS 138 143.377   2.316  -1.516
  450   2HB   LYS 138          1HB       LYS 138 143.035   3.951  -2.066
  451   1HG   LYS 138          2HG       LYS 138 144.527   4.752  -0.187
  452   2HG   LYS 138          1HG       LYS 138 145.020   3.069   0.007
  453   1HD   LYS 138          2HD       LYS 138 146.604   3.589  -1.500
  454   2HD   LYS 138          1HD       LYS 138 145.303   3.406  -2.678
  455   1HE   LYS 138          2HE       LYS 138 145.223   5.609  -3.111
  456   2HE   LYS 138          1HE       LYS 138 145.437   6.049  -1.416
  457   1HZ   LYS 138          1HZ       LYS 138 147.859   5.128  -1.981
  458   2HZ   LYS 138          2HZ       LYS 138 147.422   6.751  -2.177
  459   3HZ   LYS 138          3HZ       LYS 138 147.424   5.710  -3.509
  460    H    ASP 139           H        ASP 139 140.489   3.479  -2.064
  461    HA   ASP 139           HA       ASP 139 139.884   6.304  -1.906
  462   1HB   ASP 139          2HB       ASP 139 138.682   6.015  -3.947
  463   2HB   ASP 139          1HB       ASP 139 140.145   5.046  -4.080
  464    H    GLY 140           H        GLY 140 138.539   3.342  -0.767
  465   1HA   GLY 140          2HA       GLY 140 135.850   4.314  -0.469
  466   2HA   GLY 140          1HA       GLY 140 136.501   2.826   0.199
  467    H    ASP 141           H        ASP 141 138.736   4.329   1.481
  468    HA   ASP 141           HA       ASP 141 137.244   5.131   3.857
  469   1HB   ASP 141          2HB       ASP 141 139.336   3.518   3.723
  470   2HB   ASP 141          1HB       ASP 141 140.231   5.035   3.786
  471    H    LYS 142           H        LYS 142 136.981   7.181   4.444
  472    HA   LYS 142           HA       LYS 142 138.581   9.235   3.072
  473   1HB   LYS 142          2HB       LYS 142 135.802   9.360   4.248
  474   2HB   LYS 142          1HB       LYS 142 136.678  10.771   3.671
  475   1HG   LYS 142          2HG       LYS 142 135.840   8.393   2.026
  476   2HG   LYS 142          1HG       LYS 142 135.123  10.005   1.991
  477   1HD   LYS 142          2HD       LYS 142 137.347  10.895   1.286
  478   2HD   LYS 142          1HD       LYS 142 137.915   9.229   1.157
  479   1HE   LYS 142          2HE       LYS 142 137.237   9.417  -0.979
  480   2HE   LYS 142          1HE       LYS 142 135.641   9.102  -0.302
  481   1HZ   LYS 142          1HZ       LYS 142 136.709  11.847  -0.580
  482   2HZ   LYS 142          2HZ       LYS 142 135.105  11.366  -0.348
  483   3HZ   LYS 142          3HZ       LYS 142 135.864  11.084  -1.833
  484    H    ASN 143           H        ASN 143 137.528   8.026   6.166
  485    HA   ASN 143           HA       ASN 143 138.620  10.270   7.630
  486   1HB   ASN 143          2HB       ASN 143 137.475   7.633   8.575
  487   2HB   ASN 143          1HB       ASN 143 137.978   8.946   9.636
  488   1HD2  ASN 143          1HD2      ASN 143 136.477  10.331  10.224
  489   2HD2  ASN 143          2HD2      ASN 143 134.971  10.601   9.419
  490    H    ASN 144           H        ASN 144 139.722   7.243   6.440
  491    HA   ASN 144           HA       ASN 144 141.756   6.228   6.500
  492   1HB   ASN 144          2HB       ASN 144 142.562   8.632   6.315
  493   2HB   ASN 144          1HB       ASN 144 142.780   8.599   8.062
  494   1HD2  ASN 144          1HD2      ASN 144 143.997   7.598   5.014
  495   2HD2  ASN 144          2HD2      ASN 144 145.445   6.853   5.588
  496    H    ASP 145           H        ASP 145 139.818   5.689   8.499
  497    HA   ASP 145           HA       ASP 145 141.282   5.401  10.995
  498   1HB   ASP 145          2HB       ASP 145 139.173   4.515  11.886
  499   2HB   ASP 145          1HB       ASP 145 138.925   6.063  11.084
  500    H    GLY 146           H        GLY 146 140.551   3.552   8.187
  501   1HA   GLY 146          2HA       GLY 146 142.035   1.574   7.932
  502   2HA   GLY 146          1HA       GLY 146 141.533   1.121   9.553
  503    H    ARG 147           H        ARG 147 138.740   2.022   8.945
  504    HA   ARG 147           HA       ARG 147 137.944  -0.128   7.104
  505   1HB   ARG 147          2HB       ARG 147 136.567   0.495   9.720
  506   2HB   ARG 147          1HB       ARG 147 136.143  -0.782   8.590
  507   1HG   ARG 147          2HG       ARG 147 137.961  -2.082   9.173
  508   2HG   ARG 147          1HG       ARG 147 138.868  -0.709   9.808
  509   1HD   ARG 147          2HD       ARG 147 137.164  -0.547  11.637
  510   2HD   ARG 147          1HD       ARG 147 136.479  -2.062  11.049
  511    HE   ARG 147           HE       ARG 147 139.120  -2.620  11.437
  512   1HH1  ARG 147          1HH1      ARG 147 136.566  -1.346  13.444
  513   2HH1  ARG 147          2HH1      ARG 147 137.219  -2.002  14.907
  514   1HH2  ARG 147          1HH2      ARG 147 139.981  -3.484  13.360
  515   2HH2  ARG 147          2HH2      ARG 147 139.157  -3.214  14.860
  516    H    ILE 148           H        ILE 148 135.526   0.092   6.558
  517    HA   ILE 148           HA       ILE 148 134.910   2.948   6.163
  518    HB   ILE 148           HB       ILE 148 134.092   0.698   4.326
  519   1HG1  ILE 148          2HG1      ILE 148 136.283   2.725   3.857
  520   2HG1  ILE 148          1HG1      ILE 148 136.588   1.092   4.439
  521   1HG2  ILE 148          1HG2      ILE 148 133.965   3.698   4.079
  522   2HG2  ILE 148          2HG2      ILE 148 132.608   2.578   4.195
  523   3HG2  ILE 148          3HG2      ILE 148 133.634   2.575   2.760
  524   1HD1  ILE 148          1HD1      ILE 148 136.747   1.703   1.890
  525   2HD1  ILE 148          2HD1      ILE 148 135.007   1.421   1.950
  526   3HD1  ILE 148          3HD1      ILE 148 136.125   0.142   2.424
  527    H    ASP 149           H        ASP 149 132.858   3.654   6.554
  528    HA   ASP 149           HA       ASP 149 130.852   1.671   7.368
  529   1HB   ASP 149          2HB       ASP 149 130.219   3.056   9.290
  530   2HB   ASP 149          1HB       ASP 149 131.900   2.549   9.410
  531    H    TYR 150           H        TYR 150 128.763   3.253   7.988
  532    HA   TYR 150           HA       TYR 150 127.724   4.004   5.516
  533   1HB   TYR 150          2HB       TYR 150 126.427   3.459   7.612
  534   2HB   TYR 150          1HB       TYR 150 126.801   5.081   8.183
  535    HD1  TYR 150           HD1      TYR 150 124.875   6.355   8.122
  536    HD2  TYR 150           HD2      TYR 150 125.731   3.780   4.845
  537    HE1  TYR 150           HE1      TYR 150 122.911   7.230   6.930
  538    HE2  TYR 150           HE2      TYR 150 123.770   4.649   3.643
  539    HH   TYR 150           HH       TYR 150 122.359   6.658   3.630
  540    H    ASP 151           H        ASP 151 128.938   6.083   8.142
  541    HA   ASP 151           HA       ASP 151 128.525   8.543   6.917
  542   1HB   ASP 151          2HB       ASP 151 130.457   7.573   8.992
  543   2HB   ASP 151          1HB       ASP 151 130.596   9.213   8.369
  544    H    GLU 152           H        GLU 152 131.228   6.297   6.611
  545    HA   GLU 152           HA       GLU 152 132.761   8.090   4.958
  546   1HB   GLU 152          2HB       GLU 152 133.219   5.128   5.271
  547   2HB   GLU 152          1HB       GLU 152 134.395   6.370   4.860
  548   1HG   GLU 152          2HG       GLU 152 134.222   7.297   7.102
  549   2HG   GLU 152          1HG       GLU 152 133.013   6.083   7.518
  550    H    PHE 153           H        PHE 153 130.621   5.344   4.470
  551    HA   PHE 153           HA       PHE 153 131.178   4.996   1.707
  552   1HB   PHE 153          2HB       PHE 153 129.948   3.444   3.466
  553   2HB   PHE 153          1HB       PHE 153 128.518   4.259   2.846
  554    HD1  PHE 153           HD1      PHE 153 127.380   3.025   1.297
  555    HD2  PHE 153           HD2      PHE 153 131.630   2.835   1.350
  556    HE1  PHE 153           HE1      PHE 153 127.331   1.481  -0.619
  557    HE2  PHE 153           HE2      PHE 153 131.591   1.292  -0.565
  558    HZ   PHE 153           HZ       PHE 153 129.438   0.612  -1.552
  559    H    LEU 154           H        LEU 154 128.851   6.923   3.508
  560    HA   LEU 154           HA       LEU 154 127.169   7.674   1.409
  561   1HB   LEU 154          2HB       LEU 154 127.969   9.157   3.910
  562   2HB   LEU 154          1HB       LEU 154 126.714   9.710   2.820
  563    HG   LEU 154           HG       LEU 154 126.493   6.950   3.918
  564   1HD1  LEU 154          1HD1      LEU 154 126.771   7.781   6.001
  565   2HD1  LEU 154          2HD1      LEU 154 125.098   8.286   5.769
  566   3HD1  LEU 154          3HD1      LEU 154 126.410   9.437   5.509
  567   1HD2  LEU 154          1HD2      LEU 154 124.216   8.808   3.838
  568   2HD2  LEU 154          2HD2      LEU 154 124.338   7.133   3.299
  569   3HD2  LEU 154          3HD2      LEU 154 124.941   8.435   2.274
  570    H    GLU 155           H        GLU 155 130.289   8.932   2.416
  571    HA   GLU 155           HA       GLU 155 130.179  11.146   0.558
  572   1HB   GLU 155          2HB       GLU 155 132.227  10.123   2.502
  573   2HB   GLU 155          1HB       GLU 155 132.663  11.326   1.296
  574   1HG   GLU 155          2HG       GLU 155 130.319  12.285   2.447
  575   2HG   GLU 155          1HG       GLU 155 131.263  11.645   3.791
  576    H    PHE 156           H        PHE 156 131.666   7.968   0.760
  577    HA   PHE 156           HA       PHE 156 133.434   8.166  -1.397
  578   1HB   PHE 156          2HB       PHE 156 133.396   6.301   0.249
  579   2HB   PHE 156          1HB       PHE 156 131.919   5.706  -0.503
  580    HD1  PHE 156           HD1      PHE 156 135.074   7.014  -1.992
  581    HD2  PHE 156           HD2      PHE 156 132.429   3.711  -1.535
  582    HE1  PHE 156           HE1      PHE 156 136.416   5.722  -3.597
  583    HE2  PHE 156           HE2      PHE 156 133.768   2.413  -3.138
  584    HZ   PHE 156           HZ       PHE 156 135.764   3.417  -4.172
  585    H    MET 157           H        MET 157 129.984   7.680  -1.290
  586    HA   MET 157           HA       MET 157 129.920   7.221  -4.186
  587   1HB   MET 157          2HB       MET 157 128.468   6.094  -2.074
  588   2HB   MET 157          1HB       MET 157 127.329   7.155  -2.893
  589   1HG   MET 157          2HG       MET 157 127.091   5.727  -4.565
  590   2HG   MET 157          1HG       MET 157 128.834   5.627  -4.806
  591   1HE   MET 157          1HE       MET 157 130.221   4.120  -4.321
  592   2HE   MET 157          2HE       MET 157 129.522   2.558  -4.742
  593   3HE   MET 157          3HE       MET 157 130.156   2.833  -3.119
  594    H    LYS 158           H        LYS 158 130.423   9.832  -2.796
  595    HA   LYS 158           HA       LYS 158 128.054  11.380  -3.476
  596   1HB   LYS 158          2HB       LYS 158 129.791  11.665  -1.453
  597   2HB   LYS 158          1HB       LYS 158 130.560  12.725  -2.628
  598   1HG   LYS 158          2HG       LYS 158 128.671  14.132  -2.744
  599   2HG   LYS 158          1HG       LYS 158 127.658  12.962  -1.895
  600   1HD   LYS 158          2HD       LYS 158 129.631  13.348  -0.077
  601   2HD   LYS 158          1HD       LYS 158 129.566  14.939  -0.839
  602   1HE   LYS 158          2HE       LYS 158 128.077  14.913   1.051
  603   2HE   LYS 158          1HE       LYS 158 127.125  14.987  -0.431
  604   1HZ   LYS 158          1HZ       LYS 158 126.632  13.278   1.536
  605   2HZ   LYS 158          2HZ       LYS 158 127.674  12.327   0.602
  606   3HZ   LYS 158          3HZ       LYS 158 126.259  12.954  -0.082
  607    H    GLY 159           H        GLY 159 129.814  10.042  -5.533
  608   1HA   GLY 159          2HA       GLY 159 129.909  10.829  -7.797
  609   2HA   GLY 159          1HA       GLY 159 130.212  12.447  -7.180
  610    H    VAL 160           H        VAL 160 131.679   9.200  -7.001
  611    HA   VAL 160           HA       VAL 160 134.323  10.464  -7.101
  612    HB   VAL 160           HB       VAL 160 135.116   8.108  -6.523
  613   1HG1  VAL 160          1HG1      VAL 160 135.197   9.793  -4.858
  614   2HG1  VAL 160          2HG1      VAL 160 134.446   8.384  -4.110
  615   3HG1  VAL 160          3HG1      VAL 160 133.450   9.745  -4.626
  616   1HG2  VAL 160          1HG2      VAL 160 133.541   6.582  -5.557
  617   2HG2  VAL 160          2HG2      VAL 160 132.978   7.008  -7.174
  618   3HG2  VAL 160          3HG2      VAL 160 132.225   7.740  -5.756
  619    H    GLU 161           H        GLU 161 133.913  10.878  -9.429
  620    HA   GLU 161           HA       GLU 161 134.132   8.510 -11.131
  621   1HB   GLU 161          2HB       GLU 161 133.793  10.154 -12.995
  622   2HB   GLU 161          1HB       GLU 161 132.455  10.048 -11.859
  623   1HG   GLU 161          2HG       GLU 161 132.662  12.178 -11.233
  624   2HG   GLU 161          1HG       GLU 161 134.421  12.084 -11.158
  Start of MODEL    8
    1   1H    MET  81          1HT       MET  81  93.196  14.410   6.386
    2   2H    MET  81          2HT       MET  81  94.004  12.907   6.584
    3   3H    MET  81          3HT       MET  81  92.302  13.005   6.790
    4    HA   MET  81           HA       MET  81  92.622  12.056   4.732
    5   1HB   MET  81          2HB       MET  81  91.114  14.177   5.070
    6   2HB   MET  81          1HB       MET  81  92.286  14.945   4.007
    7   1HG   MET  81          2HG       MET  81  91.757  12.711   2.600
    8   2HG   MET  81          1HG       MET  81  90.213  12.944   3.418
    9   1HE   MET  81          1HE       MET  81  90.184  12.926   0.371
   10   2HE   MET  81          2HE       MET  81  89.303  14.397  -0.045
   11   3HE   MET  81          3HE       MET  81  88.764  13.398   1.306
   12    H    VAL  82           H        VAL  82  94.497  15.077   4.910
   13    HA   VAL  82           HA       VAL  82  96.277  14.010   2.822
   14    HB   VAL  82           HB       VAL  82  95.208  16.157   2.260
   15   1HG1  VAL  82          1HG1      VAL  82  95.530  16.791   4.894
   16   2HG1  VAL  82          2HG1      VAL  82  95.131  17.938   3.617
   17   3HG1  VAL  82          3HG1      VAL  82  96.805  17.741   4.133
   18   1HG2  VAL  82          1HG2      VAL  82  97.323  15.729   1.249
   19   2HG2  VAL  82          2HG2      VAL  82  98.186  16.212   2.708
   20   3HG2  VAL  82          3HG2      VAL  82  97.317  17.416   1.757
   21    H    ARG  83           H        ARG  83  96.122  15.293   6.067
   22    HA   ARG  83           HA       ARG  83  99.029  15.154   6.347
   23   1HB   ARG  83          2HB       ARG  83  98.677  16.221   8.525
   24   2HB   ARG  83          1HB       ARG  83  97.914  17.141   7.235
   25   1HG   ARG  83          2HG       ARG  83  95.879  15.515   8.032
   26   2HG   ARG  83          1HG       ARG  83  96.731  15.805   9.549
   27   1HD   ARG  83          2HD       ARG  83  96.490  18.157   9.334
   28   2HD   ARG  83          1HD       ARG  83  95.943  18.015   7.665
   29    HE   ARG  83           HE       ARG  83  94.102  16.612   9.115
   30   1HH1  ARG  83          1HH1      ARG  83  95.333  19.876   9.195
   31   2HH1  ARG  83          2HH1      ARG  83  93.857  20.552   9.799
   32   1HH2  ARG  83          1HH2      ARG  83  92.159  17.498   9.911
   33   2HH2  ARG  83          2HH2      ARG  83  92.055  19.203  10.207
   34    H    CYS  84           H        CYS  84  99.654  13.080   6.586
   35    HA   CYS  84           HA       CYS  84  98.882  11.708   9.005
   36   1HB   CYS  84          2HB       CYS  84  97.175  11.050   7.241
   37   2HB   CYS  84          1HB       CYS  84  98.495  10.258   6.388
   38    HG   CYS  84           HG       CYS  84  97.518   8.398   7.781
   39    H    MET  85           H        MET  85 100.391  10.914   5.869
   40    HA   MET  85           HA       MET  85 102.866  10.274   7.329
   41   1HB   MET  85          2HB       MET  85 101.675   8.705   5.035
   42   2HB   MET  85          1HB       MET  85 103.242   8.397   5.769
   43   1HG   MET  85          2HG       MET  85 100.983   8.446   7.639
   44   2HG   MET  85          1HG       MET  85 100.947   7.145   6.452
   45   1HE   MET  85          1HE       MET  85 102.617   6.430  10.276
   46   2HE   MET  85          2HE       MET  85 101.028   6.615   9.533
   47   3HE   MET  85          3HE       MET  85 101.999   8.039   9.902
   48    H    LYS  86           H        LYS  86 104.374  11.669   6.714
   49    HA   LYS  86           HA       LYS  86 104.280  12.804   4.019
   50   1HB   LYS  86          2HB       LYS  86 104.601  14.090   6.322
   51   2HB   LYS  86          1HB       LYS  86 106.288  13.683   6.039
   52   1HG   LYS  86          2HG       LYS  86 106.258  14.839   3.924
   53   2HG   LYS  86          1HG       LYS  86 104.530  15.157   4.089
   54   1HD   LYS  86          2HD       LYS  86 106.097  16.062   6.380
   55   2HD   LYS  86          1HD       LYS  86 106.557  16.845   4.867
   56   1HE   LYS  86          2HE       LYS  86 104.187  17.420   4.482
   57   2HE   LYS  86          1HE       LYS  86 103.780  16.700   6.039
   58   1HZ   LYS  86          1HZ       LYS  86 105.878  18.703   6.094
   59   2HZ   LYS  86          2HZ       LYS  86 104.588  18.456   7.159
   60   3HZ   LYS  86          3HZ       LYS  86 104.335  19.280   5.705
   61    H    ASP  87           H        ASP  87 106.459  11.060   6.195
   62    HA   ASP  87           HA       ASP  87 108.400  10.746   4.032
   63   1HB   ASP  87          2HB       ASP  87 109.812   9.702   5.840
   64   2HB   ASP  87          1HB       ASP  87 109.392  11.390   6.113
   65    H    ASP  88           H        ASP  88 105.999   9.420   3.610
   66    HA   ASP  88           HA       ASP  88 106.371   6.642   4.372
   67   1HB   ASP  88          2HB       ASP  88 104.127   8.095   4.003
   68   2HB   ASP  88          1HB       ASP  88 104.277   7.369   2.405
   69    H    SER  89           H        SER  89 105.787   8.281   1.254
   70    HA   SER  89           HA       SER  89 107.145   6.109  -0.127
   71   1HB   SER  89          2HB       SER  89 105.300   8.302  -0.904
   72   2HB   SER  89          1HB       SER  89 106.462   7.780  -2.123
   73    HG   SER  89           HG       SER  89 104.686   6.070  -0.714
   74    H    LYS  90           H        LYS  90 109.307   6.254  -0.023
   75    HA   LYS  90           HA       LYS  90 110.545   8.856  -0.637
   76   1HB   LYS  90          2HB       LYS  90 111.539   6.532   1.010
   77   2HB   LYS  90          1HB       LYS  90 112.592   7.834   0.474
   78   1HG   LYS  90          2HG       LYS  90 111.038   9.430   1.635
   79   2HG   LYS  90          1HG       LYS  90 110.236   8.021   2.331
   80   1HD   LYS  90          2HD       LYS  90 112.669   7.363   3.043
   81   2HD   LYS  90          1HD       LYS  90 112.979   9.088   2.833
   82   1HE   LYS  90          2HE       LYS  90 111.431   9.680   4.497
   83   2HE   LYS  90          1HE       LYS  90 110.684   8.083   4.486
   84   1HZ   LYS  90          1HZ       LYS  90 113.152   7.433   5.178
   85   2HZ   LYS  90          2HZ       LYS  90 111.963   7.837   6.311
   86   3HZ   LYS  90          3HZ       LYS  90 113.101   8.995   5.828
   87    H    GLY  91           H        GLY  91 111.448   9.016  -2.574
   88   1HA   GLY  91          2HA       GLY  91 111.692   6.813  -4.342
   89   2HA   GLY  91          1HA       GLY  91 112.321   8.432  -4.619
   90    H    LYS  92           H        LYS  92 114.348   8.063  -5.315
   91    HA   LYS  92           HA       LYS  92 116.032   6.183  -3.828
   92   1HB   LYS  92          2HB       LYS  92 116.264   7.472  -6.536
   93   2HB   LYS  92          1HB       LYS  92 117.648   6.701  -5.771
   94   1HG   LYS  92          2HG       LYS  92 116.787   4.600  -6.006
   95   2HG   LYS  92          1HG       LYS  92 115.113   5.162  -5.973
   96   1HD   LYS  92          2HD       LYS  92 115.046   5.457  -8.200
   97   2HD   LYS  92          1HD       LYS  92 116.669   6.149  -8.254
   98   1HE   LYS  92          2HE       LYS  92 117.649   4.156  -8.672
   99   2HE   LYS  92          1HE       LYS  92 116.515   3.265  -7.658
  100   1HZ   LYS  92          1HZ       LYS  92 116.065   2.580  -9.830
  101   2HZ   LYS  92          2HZ       LYS  92 116.160   4.148 -10.458
  102   3HZ   LYS  92          3HZ       LYS  92 114.844   3.703  -9.493
  103    H    THR  93           H        THR  93 116.095   7.709  -2.008
  104    HA   THR  93           HA       THR  93 117.654  10.130  -2.409
  105    HB   THR  93           HB       THR  93 115.810  10.359  -0.908
  106    HG1  THR  93           HG1      THR  93 117.987  10.096   0.861
  107   1HG2  THR  93          1HG2      THR  93 115.037   8.656   0.263
  108   2HG2  THR  93          2HG2      THR  93 116.429   8.808   1.335
  109   3HG2  THR  93          3HG2      THR  93 116.498   7.719  -0.050
  110    H    GLU  94           H        GLU  94 119.353  10.525  -0.577
  111    HA   GLU  94           HA       GLU  94 121.565   8.963  -1.046
  112   1HB   GLU  94          2HB       GLU  94 120.799  10.892   1.079
  113   2HB   GLU  94          1HB       GLU  94 122.194   9.872   1.398
  114   1HG   GLU  94          2HG       GLU  94 123.488  11.037   0.022
  115   2HG   GLU  94          1HG       GLU  94 122.272  11.033  -1.256
  116    H    GLU  95           H        GLU  95 118.958   8.384   1.177
  117    HA   GLU  95           HA       GLU  95 120.186   6.572   2.923
  118   1HB   GLU  95          2HB       GLU  95 117.387   7.135   2.082
  119   2HB   GLU  95          1HB       GLU  95 117.694   5.627   2.935
  120   1HG   GLU  95          2HG       GLU  95 118.934   7.168   4.630
  121   2HG   GLU  95          1HG       GLU  95 117.953   8.435   3.895
  122    H    GLU  96           H        GLU  96 119.032   6.193  -0.339
  123    HA   GLU  96           HA       GLU  96 118.709   3.428  -0.459
  124   1HB   GLU  96          2HB       GLU  96 118.965   3.630  -2.845
  125   2HB   GLU  96          1HB       GLU  96 118.073   5.026  -2.255
  126   1HG   GLU  96          2HG       GLU  96 119.502   6.141  -3.581
  127   2HG   GLU  96          1HG       GLU  96 120.558   6.022  -2.173
  128    H    LEU  97           H        LEU  97 121.604   5.360  -0.378
  129    HA   LEU  97           HA       LEU  97 123.456   3.564  -1.432
  130   1HB   LEU  97          2HB       LEU  97 123.582   5.835   0.482
  131   2HB   LEU  97          1HB       LEU  97 124.968   4.765   0.408
  132    HG   LEU  97           HG       LEU  97 123.831   6.061  -2.058
  133   1HD1  LEU  97          1HD1      LEU  97 126.028   7.517  -1.578
  134   2HD1  LEU  97          2HD1      LEU  97 125.497   7.228   0.079
  135   3HD1  LEU  97          3HD1      LEU  97 124.411   8.006  -1.072
  136   1HD2  LEU  97          1HD2      LEU  97 126.115   5.663  -2.901
  137   2HD2  LEU  97          2HD2      LEU  97 125.290   4.172  -2.447
  138   3HD2  LEU  97          3HD2      LEU  97 126.515   4.862  -1.381
  139    H    SER  98           H        SER  98 121.853   3.608   1.659
  140    HA   SER  98           HA       SER  98 123.564   1.981   3.147
  141   1HB   SER  98          2HB       SER  98 121.443   3.253   3.894
  142   2HB   SER  98          1HB       SER  98 120.566   1.812   3.379
  143    HG   SER  98           HG       SER  98 122.739   1.749   5.197
  144    H    ASP  99           H        ASP  99 121.264   1.188   0.645
  145    HA   ASP  99           HA       ASP  99 121.064  -1.586   1.163
  146   1HB   ASP  99          2HB       ASP  99 120.493   0.167  -1.198
  147   2HB   ASP  99          1HB       ASP  99 120.478  -1.583  -1.396
  148    H    LEU 100           H        LEU 100 123.218   0.331  -0.888
  149    HA   LEU 100           HA       LEU 100 124.559  -1.913  -2.019
  150   1HB   LEU 100          2HB       LEU 100 125.123   1.029  -1.891
  151   2HB   LEU 100          1HB       LEU 100 126.332  -0.077  -2.511
  152    HG   LEU 100           HG       LEU 100 124.114  -0.822  -3.937
  153   1HD1  LEU 100          1HD1      LEU 100 123.402   1.518  -4.830
  154   2HD1  LEU 100          2HD1      LEU 100 123.902   2.070  -3.232
  155   3HD1  LEU 100          3HD1      LEU 100 122.634   0.854  -3.389
  156   1HD2  LEU 100          1HD2      LEU 100 125.747   1.380  -5.054
  157   2HD2  LEU 100          2HD2      LEU 100 125.351  -0.199  -5.733
  158   3HD2  LEU 100          3HD2      LEU 100 126.605  -0.058  -4.501
  159    H    PHE 101           H        PHE 101 125.319   0.320   0.631
  160    HA   PHE 101           HA       PHE 101 127.849  -0.698   1.264
  161   1HB   PHE 101          2HB       PHE 101 126.987   1.435   2.142
  162   2HB   PHE 101          1HB       PHE 101 125.814   0.559   3.120
  163    HD1  PHE 101           HD1      PHE 101 126.492  -0.632   5.106
  164    HD2  PHE 101           HD2      PHE 101 129.334   1.460   2.727
  165    HE1  PHE 101           HE1      PHE 101 128.130  -0.788   6.934
  166    HE2  PHE 101           HE2      PHE 101 130.979   1.306   4.551
  167    HZ   PHE 101           HZ       PHE 101 130.378   0.182   6.658
  168    H    ARG 102           H        ARG 102 124.629  -1.614   2.424
  169    HA   ARG 102           HA       ARG 102 125.431  -3.460   4.372
  170   1HB   ARG 102          2HB       ARG 102 123.097  -2.514   3.936
  171   2HB   ARG 102          1HB       ARG 102 122.947  -3.742   2.688
  172   1HG   ARG 102          2HG       ARG 102 123.817  -5.137   4.925
  173   2HG   ARG 102          1HG       ARG 102 122.652  -3.969   5.552
  174   1HD   ARG 102          2HD       ARG 102 121.361  -4.868   3.339
  175   2HD   ARG 102          1HD       ARG 102 122.246  -6.313   3.824
  176    HE   ARG 102           HE       ARG 102 121.110  -5.470   6.133
  177   1HH1  ARG 102          1HH1      ARG 102 119.849  -6.140   2.949
  178   2HH1  ARG 102          2HH1      ARG 102 118.293  -6.628   3.532
  179   1HH2  ARG 102          1HH2      ARG 102 119.064  -6.108   6.901
  180   2HH2  ARG 102          2HH2      ARG 102 117.846  -6.609   5.775
  181    H    MET 103           H        MET 103 125.116  -3.742   0.898
  182    HA   MET 103           HA       MET 103 125.225  -6.570   0.753
  183   1HB   MET 103          2HB       MET 103 125.501  -4.309  -1.147
  184   2HB   MET 103          1HB       MET 103 126.226  -5.836  -1.636
  185   1HG   MET 103          2HG       MET 103 123.457  -5.926  -0.604
  186   2HG   MET 103          1HG       MET 103 123.708  -5.188  -2.183
  187   1HE   MET 103          1HE       MET 103 123.231  -9.512  -1.336
  188   2HE   MET 103          2HE       MET 103 122.207  -8.108  -1.035
  189   3HE   MET 103          3HE       MET 103 123.652  -8.372  -0.058
  190    H    PHE 104           H        PHE 104 127.699  -4.043   0.599
  191    HA   PHE 104           HA       PHE 104 129.880  -5.719   0.009
  192   1HB   PHE 104          2HB       PHE 104 129.540  -2.966   1.086
  193   2HB   PHE 104          1HB       PHE 104 131.106  -3.738   1.325
  194    HD1  PHE 104           HD1      PHE 104 129.212  -1.746  -0.827
  195    HD2  PHE 104           HD2      PHE 104 132.095  -4.874  -0.847
  196    HE1  PHE 104           HE1      PHE 104 129.858  -1.131  -3.120
  197    HE2  PHE 104           HE2      PHE 104 132.749  -4.264  -3.138
  198    HZ   PHE 104           HZ       PHE 104 131.630  -2.389  -4.278
  199    H    ASP 105           H        ASP 105 128.328  -4.842   3.031
  200    HA   ASP 105           HA       ASP 105 130.316  -5.811   4.781
  201   1HB   ASP 105          2HB       ASP 105 127.511  -4.954   4.984
  202   2HB   ASP 105          1HB       ASP 105 127.986  -6.156   6.181
  203    H    LYS 106           H        LYS 106 130.452  -7.766   5.930
  204    HA   LYS 106           HA       LYS 106 129.443 -10.058   4.440
  205   1HB   LYS 106          2HB       LYS 106 131.843  -9.920   5.072
  206   2HB   LYS 106          1HB       LYS 106 131.374  -9.979   6.765
  207   1HG   LYS 106          2HG       LYS 106 131.901 -12.168   6.390
  208   2HG   LYS 106          1HG       LYS 106 130.171 -12.188   6.043
  209   1HD   LYS 106          2HD       LYS 106 131.144 -11.558   3.607
  210   2HD   LYS 106          1HD       LYS 106 132.474 -12.533   4.234
  211   1HE   LYS 106          2HE       LYS 106 131.266 -14.440   4.199
  212   2HE   LYS 106          1HE       LYS 106 129.775 -13.627   4.670
  213   1HZ   LYS 106          1HZ       LYS 106 129.913 -12.666   2.283
  214   2HZ   LYS 106          2HZ       LYS 106 129.332 -14.238   2.516
  215   3HZ   LYS 106          3HZ       LYS 106 130.920 -13.994   1.987
  216    H    ASN 107           H        ASN 107 129.663  -9.112   7.877
  217    HA   ASN 107           HA       ASN 107 127.359 -10.844   8.427
  218   1HB   ASN 107          2HB       ASN 107 128.037 -10.646  10.803
  219   2HB   ASN 107          1HB       ASN 107 129.309 -11.319   9.790
  220   1HD2  ASN 107          1HD2      ASN 107 131.034 -10.725  10.986
  221   2HD2  ASN 107          2HD2      ASN 107 131.489  -9.085  11.284
  222    H    ALA 108           H        ALA 108 127.685  -7.818   7.490
  223    HA   ALA 108           HA       ALA 108 126.529  -5.874   7.742
  224   1HB   ALA 108          1HB       ALA 108 124.709  -7.796   7.558
  225   2HB   ALA 108          2HB       ALA 108 124.267  -6.111   7.831
  226   3HB   ALA 108          3HB       ALA 108 124.325  -7.238   9.187
  227    H    ASP 109           H        ASP 109 128.338  -5.566   9.433
  228    HA   ASP 109           HA       ASP 109 127.207  -5.266  12.126
  229   1HB   ASP 109          2HB       ASP 109 129.530  -5.065  12.895
  230   2HB   ASP 109          1HB       ASP 109 129.284  -6.559  11.995
  231    H    GLY 110           H        GLY 110 128.427  -3.501   9.402
  232   1HA   GLY 110          2HA       GLY 110 127.500  -1.171   9.339
  233   2HA   GLY 110          1HA       GLY 110 128.180  -0.995  10.949
  234    H    TYR 111           H        TYR 111 130.545  -2.664  10.003
  235    HA   TYR 111           HA       TYR 111 131.857  -0.620   8.344
  236   1HB   TYR 111          2HB       TYR 111 133.200  -2.025  10.656
  237   2HB   TYR 111          1HB       TYR 111 133.832  -0.689   9.700
  238    HD1  TYR 111           HD1      TYR 111 131.523  -1.645  12.378
  239    HD2  TYR 111           HD2      TYR 111 133.075   1.586  10.088
  240    HE1  TYR 111           HE1      TYR 111 130.591  -0.054  14.004
  241    HE2  TYR 111           HE2      TYR 111 132.149   3.186  11.708
  242    HH   TYR 111           HH       TYR 111 129.901   2.797  13.600
  243    H    ILE 112           H        ILE 112 133.630  -1.365   7.073
  244    HA   ILE 112           HA       ILE 112 133.778  -4.291   6.770
  245    HB   ILE 112           HB       ILE 112 133.813  -2.362   4.452
  246   1HG1  ILE 112          2HG1      ILE 112 131.527  -4.048   4.369
  247   2HG1  ILE 112          1HG1      ILE 112 131.576  -3.319   5.971
  248   1HG2  ILE 112          1HG2      ILE 112 134.093  -5.297   4.766
  249   2HG2  ILE 112          2HG2      ILE 112 134.872  -4.196   3.628
  250   3HG2  ILE 112          3HG2      ILE 112 133.204  -4.707   3.360
  251   1HD1  ILE 112          1HD1      ILE 112 130.260  -2.040   4.312
  252   2HD1  ILE 112          2HD1      ILE 112 131.744  -1.767   3.400
  253   3HD1  ILE 112          3HD1      ILE 112 131.580  -1.120   5.033
  254    H    ASP 113           H        ASP 113 135.763  -5.129   6.085
  255    HA   ASP 113           HA       ASP 113 137.995  -3.226   5.924
  256   1HB   ASP 113          2HB       ASP 113 139.344  -4.925   7.261
  257   2HB   ASP 113          1HB       ASP 113 138.150  -3.995   8.160
  258    H    LEU 114           H        LEU 114 140.083  -4.612   5.347
  259    HA   LEU 114           HA       LEU 114 139.732  -5.530   2.731
  260   1HB   LEU 114          2HB       LEU 114 141.944  -5.505   4.697
  261   2HB   LEU 114          1HB       LEU 114 142.095  -6.653   3.381
  262    HG   LEU 114           HG       LEU 114 141.571  -4.577   1.874
  263   1HD1  LEU 114          1HD1      LEU 114 142.916  -3.116   4.106
  264   2HD1  LEU 114          2HD1      LEU 114 141.156  -3.225   4.047
  265   3HD1  LEU 114          3HD1      LEU 114 142.037  -2.479   2.717
  266   1HD2  LEU 114          1HD2      LEU 114 143.623  -5.593   1.547
  267   2HD2  LEU 114          2HD2      LEU 114 144.139  -5.322   3.212
  268   3HD2  LEU 114          3HD2      LEU 114 144.089  -3.975   2.075
  269    H    GLU 115           H        GLU 115 140.139  -7.336   5.758
  270    HA   GLU 115           HA       GLU 115 140.195  -9.907   4.639
  271   1HB   GLU 115          2HB       GLU 115 139.654  -8.773   7.331
  272   2HB   GLU 115          1HB       GLU 115 139.119 -10.421   7.037
  273   1HG   GLU 115          2HG       GLU 115 141.303 -11.173   6.627
  274   2HG   GLU 115          1HG       GLU 115 141.921  -9.530   6.455
  275    H    GLU 116           H        GLU 116 137.464  -8.109   6.058
  276    HA   GLU 116           HA       GLU 116 135.495 -10.023   5.522
  277   1HB   GLU 116          2HB       GLU 116 135.607  -7.404   6.595
  278   2HB   GLU 116          1HB       GLU 116 134.385  -7.384   5.331
  279   1HG   GLU 116          2HG       GLU 116 133.350  -9.384   6.414
  280   2HG   GLU 116          1HG       GLU 116 134.487  -9.171   7.746
  281    H    LEU 117           H        LEU 117 136.568  -7.228   3.617
  282    HA   LEU 117           HA       LEU 117 134.719  -7.526   1.518
  283   1HB   LEU 117          2HB       LEU 117 136.498  -5.636   2.157
  284   2HB   LEU 117          1HB       LEU 117 137.427  -6.464   0.920
  285    HG   LEU 117           HG       LEU 117 135.631  -6.087  -0.702
  286   1HD1  LEU 117          1HD1      LEU 117 133.838  -4.415   0.004
  287   2HD1  LEU 117          2HD1      LEU 117 134.264  -4.843   1.662
  288   3HD1  LEU 117          3HD1      LEU 117 133.660  -6.079   0.559
  289   1HD2  LEU 117          1HD2      LEU 117 136.085  -3.408   0.513
  290   2HD2  LEU 117          2HD2      LEU 117 136.217  -3.924  -1.167
  291   3HD2  LEU 117          3HD2      LEU 117 137.482  -4.347  -0.014
  292    H    LYS 118           H        LYS 118 137.824  -9.014   2.153
  293    HA   LYS 118           HA       LYS 118 138.314 -10.069  -0.407
  294   1HB   LYS 118          2HB       LYS 118 139.525 -10.180   2.148
  295   2HB   LYS 118          1HB       LYS 118 139.287 -11.844   1.633
  296   1HG   LYS 118          2HG       LYS 118 140.914 -11.720   0.120
  297   2HG   LYS 118          1HG       LYS 118 140.355 -10.160  -0.482
  298   1HD   LYS 118          2HD       LYS 118 141.829  -9.016   0.769
  299   2HD   LYS 118          1HD       LYS 118 141.568 -10.043   2.180
  300   1HE   LYS 118          2HE       LYS 118 143.061 -11.709   1.321
  301   2HE   LYS 118          1HE       LYS 118 143.199 -10.859  -0.218
  302   1HZ   LYS 118          1HZ       LYS 118 144.041  -9.651   2.352
  303   2HZ   LYS 118          2HZ       LYS 118 144.414  -9.132   0.786
  304   3HZ   LYS 118          3HZ       LYS 118 145.092 -10.560   1.386
  305    H    ILE 119           H        ILE 119 136.218 -11.093   2.175
  306    HA   ILE 119           HA       ILE 119 135.849 -13.776   1.317
  307    HB   ILE 119           HB       ILE 119 133.900 -12.104   2.900
  308   1HG1  ILE 119          2HG1      ILE 119 136.239 -13.761   3.873
  309   2HG1  ILE 119          1HG1      ILE 119 136.125 -12.004   3.930
  310   1HG2  ILE 119          1HG2      ILE 119 133.306 -14.332   3.867
  311   2HG2  ILE 119          2HG2      ILE 119 134.326 -15.072   2.633
  312   3HG2  ILE 119          3HG2      ILE 119 132.906 -14.141   2.160
  313   1HD1  ILE 119          1HD1      ILE 119 134.059 -13.674   5.288
  314   2HD1  ILE 119          2HD1      ILE 119 134.591 -12.030   5.646
  315   3HD1  ILE 119          3HD1      ILE 119 135.627 -13.399   6.050
  316    H    MET 120           H        MET 120 133.774 -10.890   0.992
  317    HA   MET 120           HA       MET 120 131.792 -12.050  -0.581
  318   1HB   MET 120          2HB       MET 120 131.162  -9.790  -1.206
  319   2HB   MET 120          1HB       MET 120 131.586  -9.845   0.500
  320   1HG   MET 120          2HG       MET 120 133.288  -8.424   0.248
  321   2HG   MET 120          1HG       MET 120 133.829  -9.182  -1.247
  322   1HE   MET 120          1HE       MET 120 134.485  -6.980  -2.451
  323   2HE   MET 120          2HE       MET 120 133.258  -6.402  -3.579
  324   3HE   MET 120          3HE       MET 120 133.634  -8.123  -3.490
  325    H    LEU 121           H        LEU 121 134.976 -10.950  -1.437
  326    HA   LEU 121           HA       LEU 121 134.522 -10.757  -4.246
  327   1HB   LEU 121          2HB       LEU 121 137.007 -10.971  -2.562
  328   2HB   LEU 121          1HB       LEU 121 137.074 -10.922  -4.314
  329    HG   LEU 121           HG       LEU 121 135.598  -8.759  -2.881
  330   1HD1  LEU 121          1HD1      LEU 121 138.573  -9.116  -2.963
  331   2HD1  LEU 121          2HD1      LEU 121 137.544  -8.656  -1.606
  332   3HD1  LEU 121          3HD1      LEU 121 137.841  -7.512  -2.915
  333   1HD2  LEU 121          1HD2      LEU 121 137.364  -8.696  -5.320
  334   2HD2  LEU 121          2HD2      LEU 121 136.235  -7.455  -4.774
  335   3HD2  LEU 121          3HD2      LEU 121 135.627  -9.001  -5.371
  336    H    GLN 122           H        GLN 122 135.395 -13.335  -2.061
  337    HA   GLN 122           HA       GLN 122 136.400 -15.173  -3.939
  338   1HB   GLN 122          2HB       GLN 122 134.876 -15.891  -1.437
  339   2HB   GLN 122          1HB       GLN 122 136.109 -16.841  -2.253
  340   1HG   GLN 122          2HG       GLN 122 137.603 -14.744  -1.728
  341   2HG   GLN 122          1HG       GLN 122 136.395 -14.482  -0.471
  342   1HE2  GLN 122          1HE2      GLN 122 137.568 -14.970   1.296
  343   2HE2  GLN 122          2HE2      GLN 122 138.273 -16.516   1.604
  344    H    ALA 123           H        ALA 123 133.148 -14.281  -3.037
  345    HA   ALA 123           HA       ALA 123 131.741 -16.477  -4.039
  346   1HB   ALA 123          1HB       ALA 123 129.983 -14.507  -4.484
  347   2HB   ALA 123          2HB       ALA 123 131.097 -13.663  -3.408
  348   3HB   ALA 123          3HB       ALA 123 130.319 -15.154  -2.878
  349    H    THR 124           H        THR 124 133.093 -13.671  -5.658
  350    HA   THR 124           HA       THR 124 131.777 -13.958  -8.129
  351    HB   THR 124           HB       THR 124 133.462 -12.491  -9.026
  352    HG1  THR 124           HG1      THR 124 135.386 -13.165  -8.377
  353   1HG2  THR 124          1HG2      THR 124 131.905 -11.439  -7.444
  354   2HG2  THR 124          2HG2      THR 124 133.485 -10.654  -7.473
  355   3HG2  THR 124          3HG2      THR 124 133.060 -11.733  -6.144
  356    H    GLY 125           H        GLY 125 132.852 -14.574 -10.195
  357   1HA   GLY 125          2HA       GLY 125 134.059 -17.202  -9.872
  358   2HA   GLY 125          1HA       GLY 125 133.451 -16.510 -11.368
  359    H    GLU 126           H        GLU 126 134.911 -14.045 -11.183
  360    HA   GLU 126           HA       GLU 126 137.411 -14.958 -12.265
  361   1HB   GLU 126          2HB       GLU 126 137.837 -12.556 -12.679
  362   2HB   GLU 126          1HB       GLU 126 136.288 -13.091 -13.318
  363   1HG   GLU 126          2HG       GLU 126 135.119 -12.085 -11.484
  364   2HG   GLU 126          1HG       GLU 126 136.639 -11.675 -10.691
  365    H    THR 127           H        THR 127 139.503 -14.311 -11.542
  366    HA   THR 127           HA       THR 127 139.688 -14.231  -8.640
  367    HB   THR 127           HB       THR 127 142.078 -14.682  -8.992
  368    HG1  THR 127           HG1      THR 127 141.478 -14.673 -11.760
  369   1HG2  THR 127          1HG2      THR 127 141.707 -16.762 -10.614
  370   2HG2  THR 127          2HG2      THR 127 140.026 -16.407 -10.218
  371   3HG2  THR 127          3HG2      THR 127 141.183 -16.747  -8.931
  372    H    ILE 128           H        ILE 128 139.633 -12.301  -7.700
  373    HA   ILE 128           HA       ILE 128 140.543  -9.929  -9.093
  374    HB   ILE 128           HB       ILE 128 139.559 -10.096  -6.248
  375   1HG1  ILE 128          2HG1      ILE 128 137.912 -11.108  -7.796
  376   2HG1  ILE 128          1HG1      ILE 128 137.326  -9.604  -7.094
  377   1HG2  ILE 128          1HG2      ILE 128 138.751  -7.708  -7.193
  378   2HG2  ILE 128          2HG2      ILE 128 140.228  -7.932  -8.131
  379   3HG2  ILE 128          3HG2      ILE 128 140.289  -7.967  -6.367
  380   1HD1  ILE 128          1HD1      ILE 128 137.928 -10.285  -9.882
  381   2HD1  ILE 128          2HD1      ILE 128 138.452  -8.682  -9.364
  382   3HD1  ILE 128          3HD1      ILE 128 136.757  -9.148  -9.211
  383    H    THR 129           H        THR 129 142.306  -8.696  -8.591
  384    HA   THR 129           HA       THR 129 144.447 -10.015  -7.197
  385    HB   THR 129           HB       THR 129 145.816  -8.147  -7.917
  386    HG1  THR 129           HG1      THR 129 143.371  -6.952  -8.715
  387   1HG2  THR 129          1HG2      THR 129 145.909  -8.825 -10.021
  388   2HG2  THR 129          2HG2      THR 129 144.299  -8.196 -10.370
  389   3HG2  THR 129          3HG2      THR 129 144.486  -9.809  -9.681
  390    H    GLU 130           H        GLU 130 145.625  -9.148  -5.417
  391    HA   GLU 130           HA       GLU 130 143.964  -8.138  -3.345
  392   1HB   GLU 130          2HB       GLU 130 146.867  -8.807  -3.602
  393   2HB   GLU 130          1HB       GLU 130 146.325  -7.884  -2.208
  394   1HG   GLU 130          2HG       GLU 130 145.262  -9.641  -1.279
  395   2HG   GLU 130          1HG       GLU 130 144.781 -10.314  -2.835
  396    H    ASP 131           H        ASP 131 146.216  -6.685  -5.582
  397    HA   ASP 131           HA       ASP 131 146.581  -4.225  -4.246
  398   1HB   ASP 131          2HB       ASP 131 147.792  -5.296  -6.344
  399   2HB   ASP 131          1HB       ASP 131 146.602  -4.348  -7.231
  400    H    ASP 132           H        ASP 132 144.118  -5.402  -6.453
  401    HA   ASP 132           HA       ASP 132 142.889  -2.871  -6.904
  402   1HB   ASP 132          2HB       ASP 132 142.229  -5.712  -7.486
  403   2HB   ASP 132          1HB       ASP 132 140.890  -4.569  -7.463
  404    H    ILE 133           H        ILE 133 142.507  -5.408  -4.520
  405    HA   ILE 133           HA       ILE 133 140.069  -4.368  -3.423
  406    HB   ILE 133           HB       ILE 133 142.008  -6.251  -2.082
  407   1HG1  ILE 133          2HG1      ILE 133 139.613  -7.067  -3.722
  408   2HG1  ILE 133          1HG1      ILE 133 141.220  -6.925  -4.430
  409   1HG2  ILE 133          1HG2      ILE 133 139.097  -5.617  -1.676
  410   2HG2  ILE 133          2HG2      ILE 133 140.421  -5.458  -0.522
  411   3HG2  ILE 133          3HG2      ILE 133 139.867  -7.058  -1.011
  412   1HD1  ILE 133          1HD1      ILE 133 142.054  -8.700  -3.180
  413   2HD1  ILE 133          2HD1      ILE 133 140.439  -9.228  -3.656
  414   3HD1  ILE 133          3HD1      ILE 133 140.726  -8.631  -2.021
  415    H    GLU 134           H        GLU 134 143.483  -3.921  -2.835
  416    HA   GLU 134           HA       GLU 134 143.181  -2.649  -0.293
  417   1HB   GLU 134          2HB       GLU 134 145.402  -3.144  -2.200
  418   2HB   GLU 134          1HB       GLU 134 145.600  -1.801  -1.082
  419   1HG   GLU 134          2HG       GLU 134 145.429  -3.220   0.801
  420   2HG   GLU 134          1HG       GLU 134 144.877  -4.573  -0.185
  421    H    GLU 135           H        GLU 135 143.272  -1.579  -3.626
  422    HA   GLU 135           HA       GLU 135 143.651   1.178  -3.113
  423   1HB   GLU 135          2HB       GLU 135 142.916  -0.499  -5.419
  424   2HB   GLU 135          1HB       GLU 135 142.278   1.139  -5.472
  425   1HG   GLU 135          2HG       GLU 135 144.986   1.319  -4.692
  426   2HG   GLU 135          1HG       GLU 135 144.902   0.219  -6.066
  427    H    LEU 136           H        LEU 136 140.750  -0.809  -3.552
  428    HA   LEU 136           HA       LEU 136 138.858   1.252  -3.497
  429   1HB   LEU 136          2HB       LEU 136 138.816  -1.673  -2.961
  430   2HB   LEU 136          1HB       LEU 136 137.438  -0.731  -2.422
  431    HG   LEU 136           HG       LEU 136 138.330  -0.357  -5.232
  432   1HD1  LEU 136          1HD1      LEU 136 138.435  -2.764  -5.024
  433   2HD1  LEU 136          2HD1      LEU 136 137.007  -2.304  -5.950
  434   3HD1  LEU 136          3HD1      LEU 136 136.843  -2.795  -4.263
  435   1HD2  LEU 136          1HD2      LEU 136 136.011   0.020  -5.614
  436   2HD2  LEU 136          2HD2      LEU 136 136.446   0.888  -4.141
  437   3HD2  LEU 136          3HD2      LEU 136 135.581  -0.646  -4.038
  438    H    MET 137           H        MET 137 140.600  -0.344  -0.928
  439    HA   MET 137           HA       MET 137 138.933   0.701   1.172
  440   1HB   MET 137          2HB       MET 137 141.387  -0.963   1.003
  441   2HB   MET 137          1HB       MET 137 141.139  -0.060   2.491
  442   1HG   MET 137          2HG       MET 137 138.794  -1.536   1.530
  443   2HG   MET 137          1HG       MET 137 140.166  -2.534   2.009
  444   1HE   MET 137          1HE       MET 137 137.146  -1.571   2.749
  445   2HE   MET 137          2HE       MET 137 136.969  -0.826   4.339
  446   3HE   MET 137          3HE       MET 137 137.219  -2.567   4.203
  447    H    LYS 138           H        LYS 138 141.875   1.639  -0.460
  448    HA   LYS 138           HA       LYS 138 142.746   3.571   1.419
  449   1HB   LYS 138          2HB       LYS 138 143.381   2.882  -1.397
  450   2HB   LYS 138          1HB       LYS 138 143.802   4.505  -0.868
  451   1HG   LYS 138          2HG       LYS 138 145.258   3.693   0.798
  452   2HG   LYS 138          1HG       LYS 138 144.634   2.049   0.645
  453   1HD   LYS 138          2HD       LYS 138 145.520   2.013  -1.690
  454   2HD   LYS 138          1HD       LYS 138 146.275   3.576  -1.372
  455   1HE   LYS 138          2HE       LYS 138 147.282   2.325   0.696
  456   2HE   LYS 138          1HE       LYS 138 146.931   0.885  -0.260
  457   1HZ   LYS 138          1HZ       LYS 138 148.328   1.661  -1.997
  458   2HZ   LYS 138          2HZ       LYS 138 149.207   1.809  -0.561
  459   3HZ   LYS 138          3HZ       LYS 138 148.516   3.179  -1.274
  460    H    ASP 139           H        ASP 139 141.190   4.048  -1.760
  461    HA   ASP 139           HA       ASP 139 140.634   6.788  -1.281
  462   1HB   ASP 139          2HB       ASP 139 139.480   6.767  -3.367
  463   2HB   ASP 139          1HB       ASP 139 140.863   5.693  -3.542
  464    H    GLY 140           H        GLY 140 139.064   3.909  -0.304
  465   1HA   GLY 140          2HA       GLY 140 136.453   5.138  -0.002
  466   2HA   GLY 140          1HA       GLY 140 136.897   3.503   0.462
  467    H    ASP 141           H        ASP 141 139.269   4.542   1.958
  468    HA   ASP 141           HA       ASP 141 137.825   5.173   4.412
  469   1HB   ASP 141          2HB       ASP 141 139.592   3.336   4.242
  470   2HB   ASP 141          1HB       ASP 141 140.781   4.633   4.151
  471    H    LYS 142           H        LYS 142 137.510   7.242   4.870
  472    HA   LYS 142           HA       LYS 142 139.616   9.179   4.164
  473   1HB   LYS 142          2HB       LYS 142 136.670   9.702   4.597
  474   2HB   LYS 142          1HB       LYS 142 137.873  10.888   4.110
  475   1HG   LYS 142          2HG       LYS 142 137.732   8.537   2.372
  476   2HG   LYS 142          1HG       LYS 142 136.258   9.510   2.414
  477   1HD   LYS 142          2HD       LYS 142 138.953  10.775   2.034
  478   2HD   LYS 142          1HD       LYS 142 138.059  10.096   0.671
  479   1HE   LYS 142          2HE       LYS 142 136.100  11.539   1.547
  480   2HE   LYS 142          1HE       LYS 142 137.348  12.412   2.435
  481   1HZ   LYS 142          1HZ       LYS 142 136.690  13.239   0.118
  482   2HZ   LYS 142          2HZ       LYS 142 137.608  11.946  -0.468
  483   3HZ   LYS 142          3HZ       LYS 142 138.338  13.137   0.486
  484    H    ASN 143           H        ASN 143 137.912   7.714   6.742
  485    HA   ASN 143           HA       ASN 143 138.404   9.856   8.629
  486   1HB   ASN 143          2HB       ASN 143 137.263   7.078   8.961
  487   2HB   ASN 143          1HB       ASN 143 137.454   8.221  10.285
  488   1HD2  ASN 143          1HD2      ASN 143 136.246  10.178  10.225
  489   2HD2  ASN 143          2HD2      ASN 143 134.762  10.264   9.346
  490    H    ASN 144           H        ASN 144 140.148   7.242   7.368
  491    HA   ASN 144           HA       ASN 144 142.183   6.361   7.852
  492   1HB   ASN 144          2HB       ASN 144 142.191   8.941   9.289
  493   2HB   ASN 144          1HB       ASN 144 143.356   7.755   9.872
  494   1HD2  ASN 144          1HD2      ASN 144 144.987   9.207   9.138
  495   2HD2  ASN 144          2HD2      ASN 144 145.429   9.248   7.468
  496    H    ASP 145           H        ASP 145 139.786   5.470   9.234
  497    HA   ASP 145           HA       ASP 145 140.709   4.747  11.899
  498   1HB   ASP 145          2HB       ASP 145 138.476   3.755  12.173
  499   2HB   ASP 145          1HB       ASP 145 138.370   5.424  11.621
  500    H    GLY 146           H        GLY 146 140.378   3.366   8.726
  501   1HA   GLY 146          2HA       GLY 146 141.916   1.469   8.311
  502   2HA   GLY 146          1HA       GLY 146 141.312   0.779   9.809
  503    H    ARG 147           H        ARG 147 138.547   1.754   9.063
  504    HA   ARG 147           HA       ARG 147 137.958  -0.214   6.955
  505   1HB   ARG 147          2HB       ARG 147 136.479   0.194   9.559
  506   2HB   ARG 147          1HB       ARG 147 135.873  -0.777   8.225
  507   1HG   ARG 147          2HG       ARG 147 138.150  -2.023   8.466
  508   2HG   ARG 147          1HG       ARG 147 138.142  -1.315  10.083
  509   1HD   ARG 147          2HD       ARG 147 135.835  -2.279  10.371
  510   2HD   ARG 147          1HD       ARG 147 136.092  -3.153   8.862
  511    HE   ARG 147           HE       ARG 147 137.396  -4.636  10.002
  512   1HH1  ARG 147          1HH1      ARG 147 137.151  -1.709  11.888
  513   2HH1  ARG 147          2HH1      ARG 147 137.984  -2.371  13.254
  514   1HH2  ARG 147          1HH2      ARG 147 138.495  -5.507  11.797
  515   2HH2  ARG 147          2HH2      ARG 147 138.747  -4.527  13.202
  516    H    ILE 148           H        ILE 148 135.408   0.078   6.469
  517    HA   ILE 148           HA       ILE 148 135.025   2.958   5.964
  518    HB   ILE 148           HB       ILE 148 134.005   0.704   4.234
  519   1HG1  ILE 148          2HG1      ILE 148 136.216   2.566   3.432
  520   2HG1  ILE 148          1HG1      ILE 148 136.586   1.134   4.385
  521   1HG2  ILE 148          1HG2      ILE 148 134.218   3.637   3.597
  522   2HG2  ILE 148          2HG2      ILE 148 132.763   2.889   4.251
  523   3HG2  ILE 148          3HG2      ILE 148 133.381   2.385   2.679
  524   1HD1  ILE 148          1HD1      ILE 148 135.312  -0.153   2.573
  525   2HD1  ILE 148          2HD1      ILE 148 136.921   0.457   2.193
  526   3HD1  ILE 148          3HD1      ILE 148 135.493   1.311   1.608
  527    H    ASP 149           H        ASP 149 132.996   3.830   6.252
  528    HA   ASP 149           HA       ASP 149 130.890   2.054   7.262
  529   1HB   ASP 149          2HB       ASP 149 130.353   3.749   9.012
  530   2HB   ASP 149          1HB       ASP 149 131.923   2.984   9.239
  531    H    TYR 150           H        TYR 150 128.779   3.390   7.523
  532    HA   TYR 150           HA       TYR 150 128.021   4.296   4.980
  533   1HB   TYR 150          2HB       TYR 150 126.548   3.364   6.860
  534   2HB   TYR 150          1HB       TYR 150 126.559   4.995   7.520
  535    HD1  TYR 150           HD1      TYR 150 124.611   6.140   7.095
  536    HD2  TYR 150           HD2      TYR 150 126.125   3.520   4.107
  537    HE1  TYR 150           HE1      TYR 150 122.741   6.752   5.619
  538    HE2  TYR 150           HE2      TYR 150 124.261   4.126   2.621
  539    HH   TYR 150           HH       TYR 150 121.791   5.047   3.051
  540    H    ASP 151           H        ASP 151 129.384   5.973   7.692
  541    HA   ASP 151           HA       ASP 151 128.529   8.587   7.062
  542   1HB   ASP 151          2HB       ASP 151 130.928   7.568   8.587
  543   2HB   ASP 151          1HB       ASP 151 130.534   9.278   8.443
  544    H    GLU 152           H        GLU 152 131.684   7.025   6.468
  545    HA   GLU 152           HA       GLU 152 132.515   9.126   4.699
  546   1HB   GLU 152          2HB       GLU 152 134.536   7.831   4.398
  547   2HB   GLU 152          1HB       GLU 152 134.113   7.868   6.105
  548   1HG   GLU 152          2HG       GLU 152 132.890   5.616   5.474
  549   2HG   GLU 152          1HG       GLU 152 134.098   5.609   4.190
  550    H    PHE 153           H        PHE 153 131.191   5.893   4.350
  551    HA   PHE 153           HA       PHE 153 131.686   5.490   1.632
  552   1HB   PHE 153          2HB       PHE 153 130.810   3.780   3.249
  553   2HB   PHE 153          1HB       PHE 153 129.236   4.562   3.144
  554    HD1  PHE 153           HD1      PHE 153 127.933   4.456   1.079
  555    HD2  PHE 153           HD2      PHE 153 131.646   2.413   1.475
  556    HE1  PHE 153           HE1      PHE 153 127.388   3.092  -0.896
  557    HE2  PHE 153           HE2      PHE 153 131.108   1.046  -0.500
  558    HZ   PHE 153           HZ       PHE 153 128.977   1.386  -1.688
  559    H    LEU 154           H        LEU 154 129.311   7.450   3.258
  560    HA   LEU 154           HA       LEU 154 127.527   7.802   1.092
  561   1HB   LEU 154          2HB       LEU 154 127.960   8.968   3.740
  562   2HB   LEU 154          1HB       LEU 154 127.341  10.122   2.573
  563    HG   LEU 154           HG       LEU 154 125.382   8.804   2.184
  564   1HD1  LEU 154          1HD1      LEU 154 125.597   6.727   4.106
  565   2HD1  LEU 154          2HD1      LEU 154 127.011   6.652   3.056
  566   3HD1  LEU 154          3HD1      LEU 154 125.392   6.595   2.360
  567   1HD2  LEU 154          1HD2      LEU 154 124.301   9.080   4.224
  568   2HD2  LEU 154          2HD2      LEU 154 125.652  10.209   4.325
  569   3HD2  LEU 154          3HD2      LEU 154 125.737   8.655   5.155
  570    H    GLU 155           H        GLU 155 130.505   9.389   2.037
  571    HA   GLU 155           HA       GLU 155 130.209  11.478   0.053
  572   1HB   GLU 155          2HB       GLU 155 132.446  10.768   1.952
  573   2HB   GLU 155          1HB       GLU 155 132.532  12.103   0.812
  574   1HG   GLU 155          2HG       GLU 155 130.932  13.337   1.934
  575   2HG   GLU 155          1HG       GLU 155 130.262  11.921   2.743
  576    H    PHE 156           H        PHE 156 132.101   8.535   0.518
  577    HA   PHE 156           HA       PHE 156 133.807   8.791  -1.686
  578   1HB   PHE 156          2HB       PHE 156 134.143   7.126   0.090
  579   2HB   PHE 156          1HB       PHE 156 132.703   6.264  -0.443
  580    HD1  PHE 156           HD1      PHE 156 135.732   7.666  -2.124
  581    HD2  PHE 156           HD2      PHE 156 133.188   4.308  -1.519
  582    HE1  PHE 156           HE1      PHE 156 137.105   6.350  -3.685
  583    HE2  PHE 156           HE2      PHE 156 134.557   2.986  -3.079
  584    HZ   PHE 156           HZ       PHE 156 136.517   4.007  -4.164
  585    H    MET 157           H        MET 157 130.607   7.289  -1.407
  586    HA   MET 157           HA       MET 157 130.518   6.489  -4.152
  587   1HB   MET 157          2HB       MET 157 128.884   6.168  -1.795
  588   2HB   MET 157          1HB       MET 157 127.886   6.633  -3.166
  589   1HG   MET 157          2HG       MET 157 129.833   4.340  -3.183
  590   2HG   MET 157          1HG       MET 157 128.110   4.186  -2.848
  591   1HE   MET 157          1HE       MET 157 128.110   2.388  -5.800
  592   2HE   MET 157          2HE       MET 157 129.354   2.487  -4.555
  593   3HE   MET 157          3HE       MET 157 129.743   2.899  -6.226
  594    H    LYS 158           H        LYS 158 129.550   9.309  -2.341
  595    HA   LYS 158           HA       LYS 158 127.950  10.420  -4.457
  596   1HB   LYS 158          2HB       LYS 158 127.477  10.946  -2.108
  597   2HB   LYS 158          1HB       LYS 158 129.058  11.701  -1.952
  598   1HG   LYS 158          2HG       LYS 158 128.067  13.090  -4.039
  599   2HG   LYS 158          1HG       LYS 158 126.582  12.723  -3.160
  600   1HD   LYS 158          2HD       LYS 158 127.768  13.582  -1.088
  601   2HD   LYS 158          1HD       LYS 158 129.013  14.199  -2.176
  602   1HE   LYS 158          2HE       LYS 158 127.465  15.641  -3.259
  603   2HE   LYS 158          1HE       LYS 158 126.093  14.870  -2.466
  604   1HZ   LYS 158          1HZ       LYS 158 128.137  16.639  -1.262
  605   2HZ   LYS 158          2HZ       LYS 158 127.119  15.671  -0.320
  606   3HZ   LYS 158          3HZ       LYS 158 126.460  16.866  -1.320
  607    H    GLY 159           H        GLY 159 129.974   9.922  -5.897
  608   1HA   GLY 159          2HA       GLY 159 131.084  11.330  -7.492
  609   2HA   GLY 159          1HA       GLY 159 131.384  12.487  -6.205
  610    H    VAL 160           H        VAL 160 132.144   9.122  -7.093
  611    HA   VAL 160           HA       VAL 160 134.442   8.938  -5.460
  612    HB   VAL 160           HB       VAL 160 133.890   7.362  -7.976
  613   1HG1  VAL 160          1HG1      VAL 160 136.150   7.373  -6.508
  614   2HG1  VAL 160          2HG1      VAL 160 135.553   5.961  -7.377
  615   3HG1  VAL 160          3HG1      VAL 160 135.225   6.138  -5.653
  616   1HG2  VAL 160          1HG2      VAL 160 133.211   6.186  -5.369
  617   2HG2  VAL 160          2HG2      VAL 160 132.363   6.093  -6.912
  618   3HG2  VAL 160          3HG2      VAL 160 132.172   7.514  -5.886
  619    H    GLU 161           H        GLU 161 133.958   9.883  -8.824
  620    HA   GLU 161           HA       GLU 161 136.826  10.500  -9.032
  621   1HB   GLU 161          2HB       GLU 161 134.724   9.866 -11.083
  622   2HB   GLU 161          1HB       GLU 161 136.196  10.713 -11.538
  623   1HG   GLU 161          2HG       GLU 161 137.255   8.656 -10.177
  624   2HG   GLU 161          1HG       GLU 161 135.782   7.898 -10.781
  Start of MODEL    9
    1   1H    MET  81          1HT       MET  81  90.147   8.601   1.213
    2   2H    MET  81          2HT       MET  81  91.727   9.209   0.930
    3   3H    MET  81          3HT       MET  81  90.356  10.106   0.418
    4    HA   MET  81           HA       MET  81  91.476  10.906   2.454
    5   1HB   MET  81          2HB       MET  81  89.310  11.340   3.553
    6   2HB   MET  81          1HB       MET  81  89.216  11.553   1.810
    7   1HG   MET  81          2HG       MET  81  87.771   9.855   1.541
    8   2HG   MET  81          1HG       MET  81  88.525   8.871   2.795
    9   1HE   MET  81          1HE       MET  81  85.730   9.116   1.952
   10   2HE   MET  81          2HE       MET  81  84.615  10.125   2.875
   11   3HE   MET  81          3HE       MET  81  85.188   8.599   3.549
   12    H    VAL  82           H        VAL  82  92.403   8.280   2.568
   13    HA   VAL  82           HA       VAL  82  92.393   7.817   5.362
   14    HB   VAL  82           HB       VAL  82  90.188   6.850   4.902
   15   1HG1  VAL  82          1HG1      VAL  82  89.921   5.959   2.865
   16   2HG1  VAL  82          2HG1      VAL  82  90.596   4.494   3.579
   17   3HG1  VAL  82          3HG1      VAL  82  91.640   5.603   2.691
   18   1HG2  VAL  82          1HG2      VAL  82  91.934   5.856   6.548
   19   2HG2  VAL  82          2HG2      VAL  82  91.992   4.516   5.401
   20   3HG2  VAL  82          3HG2      VAL  82  90.468   4.944   6.183
   21    H    ARG  83           H        ARG  83  94.554   8.228   4.056
   22    HA   ARG  83           HA       ARG  83  95.832   5.603   3.835
   23   1HB   ARG  83          2HB       ARG  83  97.141   6.413   1.868
   24   2HB   ARG  83          1HB       ARG  83  95.427   6.192   1.544
   25   1HG   ARG  83          2HG       ARG  83  95.179   8.682   1.989
   26   2HG   ARG  83          1HG       ARG  83  96.939   8.758   1.898
   27   1HD   ARG  83          2HD       ARG  83  96.945   8.556  -0.333
   28   2HD   ARG  83          1HD       ARG  83  95.720   7.286  -0.309
   29    HE   ARG  83           HE       ARG  83  94.116   8.870  -0.706
   30   1HH1  ARG  83          1HH1      ARG  83  97.055  10.465   0.293
   31   2HH1  ARG  83          2HH1      ARG  83  96.462  12.053  -0.062
   32   1HH2  ARG  83          1HH2      ARG  83  93.334  10.957  -1.174
   33   2HH2  ARG  83          2HH2      ARG  83  94.350  12.332  -0.895
   34    H    CYS  84           H        CYS  84  98.120   5.631   4.191
   35    HA   CYS  84           HA       CYS  84  98.964   7.939   5.804
   36   1HB   CYS  84          2HB       CYS  84 100.638   6.325   6.771
   37   2HB   CYS  84          1HB       CYS  84  98.956   5.937   7.110
   38    HG   CYS  84           HG       CYS  84  99.913   4.398   4.708
   39    H    MET  85           H        MET  85  99.129   7.971   2.947
   40    HA   MET  85           HA       MET  85 101.985   8.465   2.690
   41   1HB   MET  85          2HB       MET  85 100.553   6.292   1.329
   42   2HB   MET  85          1HB       MET  85 101.478   7.324   0.248
   43   1HG   MET  85          2HG       MET  85 103.274   6.900   2.236
   44   2HG   MET  85          1HG       MET  85 102.385   5.378   2.238
   45   1HE   MET  85          1HE       MET  85 105.894   5.217   0.576
   46   2HE   MET  85          2HE       MET  85 105.261   6.344   1.777
   47   3HE   MET  85          3HE       MET  85 105.637   6.909   0.149
   48    H    LYS  86           H        LYS  86 101.853  10.597   2.313
   49    HA   LYS  86           HA       LYS  86  99.989  11.524   0.230
   50   1HB   LYS  86          2HB       LYS  86 100.404  13.804   1.283
   51   2HB   LYS  86          1HB       LYS  86  99.472  12.655   2.235
   52   1HG   LYS  86          2HG       LYS  86 101.465  12.118   3.543
   53   2HG   LYS  86          1HG       LYS  86 102.400  13.269   2.588
   54   1HD   LYS  86          2HD       LYS  86 101.543  15.054   3.669
   55   2HD   LYS  86          1HD       LYS  86  99.932  14.342   3.779
   56   1HE   LYS  86          2HE       LYS  86 100.351  14.009   5.941
   57   2HE   LYS  86          1HE       LYS  86 101.486  12.757   5.439
   58   1HZ   LYS  86          1HZ       LYS  86 102.997  14.931   5.185
   59   2HZ   LYS  86          2HZ       LYS  86 102.922  14.013   6.603
   60   3HZ   LYS  86          3HZ       LYS  86 102.001  15.425   6.460
   61    H    ASP  87           H        ASP  87 103.321  11.424   1.248
   62    HA   ASP  87           HA       ASP  87 104.414  13.366  -0.436
   63   1HB   ASP  87          2HB       ASP  87 106.530  12.024  -0.235
   64   2HB   ASP  87          1HB       ASP  87 105.764  12.410   1.304
   65    H    ASP  88           H        ASP  88 106.150  12.514  -2.172
   66    HA   ASP  88           HA       ASP  88 104.629  11.721  -4.411
   67   1HB   ASP  88          2HB       ASP  88 107.469  12.335  -3.859
   68   2HB   ASP  88          1HB       ASP  88 107.169  11.297  -5.249
   69    H    SER  89           H        SER  89 105.524   9.871  -5.875
   70    HA   SER  89           HA       SER  89 105.064   7.428  -4.447
   71   1HB   SER  89          2HB       SER  89 104.378   8.065  -6.883
   72   2HB   SER  89          1HB       SER  89 106.006   7.528  -7.297
   73    HG   SER  89           HG       SER  89 104.098   5.977  -5.880
   74    H    LYS  90           H        LYS  90 107.819   8.809  -6.220
   75    HA   LYS  90           HA       LYS  90 109.551   6.623  -5.530
   76   1HB   LYS  90          2HB       LYS  90 109.592   8.761  -7.378
   77   2HB   LYS  90          1HB       LYS  90 110.999   8.968  -6.345
   78   1HG   LYS  90          2HG       LYS  90 110.509   6.243  -7.369
   79   2HG   LYS  90          1HG       LYS  90 111.003   7.460  -8.548
   80   1HD   LYS  90          2HD       LYS  90 113.060   7.776  -7.558
   81   2HD   LYS  90          1HD       LYS  90 112.499   7.231  -5.975
   82   1HE   LYS  90          2HE       LYS  90 113.629   5.357  -6.503
   83   2HE   LYS  90          1HE       LYS  90 112.168   4.972  -7.414
   84   1HZ   LYS  90          1HZ       LYS  90 113.159   5.658  -9.409
   85   2HZ   LYS  90          2HZ       LYS  90 114.352   4.746  -8.630
   86   3HZ   LYS  90          3HZ       LYS  90 114.441   6.435  -8.621
   87    H    GLY  91           H        GLY  91 109.691   6.471  -3.314
   88   1HA   GLY  91          2HA       GLY  91 110.596   8.840  -1.836
   89   2HA   GLY  91          1HA       GLY  91 109.949   7.371  -1.123
   90    H    LYS  92           H        LYS  92 112.378   7.314  -3.634
   91    HA   LYS  92           HA       LYS  92 114.211   6.014  -1.776
   92   1HB   LYS  92          2HB       LYS  92 114.104   6.239  -4.776
   93   2HB   LYS  92          1HB       LYS  92 115.531   5.631  -3.949
   94   1HG   LYS  92          2HG       LYS  92 112.785   4.454  -3.612
   95   2HG   LYS  92          1HG       LYS  92 113.968   3.878  -4.789
   96   1HD   LYS  92          2HD       LYS  92 115.292   2.933  -3.199
   97   2HD   LYS  92          1HD       LYS  92 114.877   4.142  -1.981
   98   1HE   LYS  92          2HE       LYS  92 112.654   3.096  -1.746
   99   2HE   LYS  92          1HE       LYS  92 113.135   1.860  -2.908
  100   1HZ   LYS  92          1HZ       LYS  92 114.515   2.369  -0.329
  101   2HZ   LYS  92          2HZ       LYS  92 114.834   1.112  -1.414
  102   3HZ   LYS  92          3HZ       LYS  92 113.366   1.152  -0.576
  103    H    THR  93           H        THR  93 114.989   7.756  -0.582
  104    HA   THR  93           HA       THR  93 116.289   9.948  -1.989
  105    HB   THR  93           HB       THR  93 114.902  10.441  -0.014
  106    HG1  THR  93           HG1      THR  93 116.407  11.962  -0.224
  107   1HG2  THR  93          1HG2      THR  93 116.776   9.651   2.014
  108   2HG2  THR  93          2HG2      THR  93 116.151   8.246   1.150
  109   3HG2  THR  93          3HG2      THR  93 115.036   9.378   1.917
  110    H    GLU  94           H        GLU  94 118.376  10.594  -0.378
  111    HA   GLU  94           HA       GLU  94 120.455   8.997  -1.315
  112   1HB   GLU  94          2HB       GLU  94 120.181  11.351   0.265
  113   2HB   GLU  94          1HB       GLU  94 121.299  10.277   1.092
  114   1HG   GLU  94          2HG       GLU  94 122.895  10.513  -0.473
  115   2HG   GLU  94          1HG       GLU  94 121.736  10.580  -1.800
  116    H    GLU  95           H        GLU  95 118.470   8.659   1.509
  117    HA   GLU  95           HA       GLU  95 120.121   7.072   3.111
  118   1HB   GLU  95          2HB       GLU  95 117.661   8.102   3.422
  119   2HB   GLU  95          1HB       GLU  95 117.222   6.439   3.054
  120   1HG   GLU  95          2HG       GLU  95 118.829   5.752   4.881
  121   2HG   GLU  95          1HG       GLU  95 118.891   7.456   5.332
  122    H    GLU  96           H        GLU  96 118.292   6.304   0.250
  123    HA   GLU  96           HA       GLU  96 118.048   3.545   0.490
  124   1HB   GLU  96          2HB       GLU  96 117.809   3.481  -1.904
  125   2HB   GLU  96          1HB       GLU  96 117.026   4.937  -1.306
  126   1HG   GLU  96          2HG       GLU  96 118.136   5.894  -3.005
  127   2HG   GLU  96          1HG       GLU  96 119.459   5.926  -1.841
  128    H    LEU  97           H        LEU  97 120.852   5.486  -0.153
  129    HA   LEU  97           HA       LEU  97 122.527   3.658  -1.408
  130   1HB   LEU  97          2HB       LEU  97 122.927   6.034   0.324
  131   2HB   LEU  97          1HB       LEU  97 124.305   4.974   0.096
  132    HG   LEU  97           HG       LEU  97 122.779   6.046  -2.257
  133   1HD1  LEU  97          1HD1      LEU  97 125.215   7.382  -1.131
  134   2HD1  LEU  97          2HD1      LEU  97 123.589   7.875  -0.663
  135   3HD1  LEU  97          3HD1      LEU  97 124.089   7.977  -2.351
  136   1HD2  LEU  97          1HD2      LEU  97 125.703   5.478  -2.152
  137   2HD2  LEU  97          2HD2      LEU  97 124.581   5.375  -3.510
  138   3HD2  LEU  97          3HD2      LEU  97 124.567   4.133  -2.257
  139    H    SER  98           H        SER  98 121.497   3.841   1.914
  140    HA   SER  98           HA       SER  98 123.480   2.302   3.140
  141   1HB   SER  98          2HB       SER  98 121.935   1.989   4.943
  142   2HB   SER  98          1HB       SER  98 121.635   3.598   4.287
  143    HG   SER  98           HG       SER  98 119.861   1.767   4.643
  144    H    ASP  99           H        ASP  99 120.757   1.378   1.163
  145    HA   ASP  99           HA       ASP  99 120.607  -1.341   1.843
  146   1HB   ASP  99          2HB       ASP  99 119.038   0.136   0.368
  147   2HB   ASP  99          1HB       ASP  99 120.083  -0.381  -0.951
  148    H    LEU 100           H        LEU 100 122.782   0.421  -0.236
  149    HA   LEU 100           HA       LEU 100 123.863  -1.957  -1.467
  150   1HB   LEU 100          2HB       LEU 100 124.583   0.961  -1.574
  151   2HB   LEU 100          1HB       LEU 100 125.595  -0.263  -2.317
  152    HG   LEU 100           HG       LEU 100 122.687   0.150  -3.005
  153   1HD1  LEU 100          1HD1      LEU 100 123.411   1.319  -4.966
  154   2HD1  LEU 100          2HD1      LEU 100 125.105   1.071  -4.546
  155   3HD1  LEU 100          3HD1      LEU 100 124.095   2.121  -3.552
  156   1HD2  LEU 100          1HD2      LEU 100 124.872  -1.382  -4.407
  157   2HD2  LEU 100          2HD2      LEU 100 123.195  -1.233  -4.930
  158   3HD2  LEU 100          3HD2      LEU 100 123.581  -2.097  -3.442
  159    H    PHE 101           H        PHE 101 124.628   0.157   1.207
  160    HA   PHE 101           HA       PHE 101 127.300  -0.702   1.601
  161   1HB   PHE 101          2HB       PHE 101 126.425   1.394   2.549
  162   2HB   PHE 101          1HB       PHE 101 125.349   0.472   3.594
  163    HD1  PHE 101           HD1      PHE 101 126.014   0.339   5.776
  164    HD2  PHE 101           HD2      PHE 101 128.985   0.453   2.731
  165    HE1  PHE 101           HE1      PHE 101 127.773   0.234   7.494
  166    HE2  PHE 101           HE2      PHE 101 130.748   0.348   4.443
  167    HZ   PHE 101           HZ       PHE 101 130.144   0.237   6.827
  168    H    ARG 102           H        ARG 102 124.220  -1.674   3.080
  169    HA   ARG 102           HA       ARG 102 125.250  -3.540   4.890
  170   1HB   ARG 102          2HB       ARG 102 122.979  -4.510   4.897
  171   2HB   ARG 102          1HB       ARG 102 122.958  -2.758   5.038
  172   1HG   ARG 102          2HG       ARG 102 121.645  -2.592   3.268
  173   2HG   ARG 102          1HG       ARG 102 122.816  -3.466   2.278
  174   1HD   ARG 102          2HD       ARG 102 120.947  -4.910   4.127
  175   2HD   ARG 102          1HD       ARG 102 120.443  -4.431   2.506
  176    HE   ARG 102           HE       ARG 102 122.772  -5.741   2.073
  177   1HH1  ARG 102          1HH1      ARG 102 119.848  -6.563   3.792
  178   2HH1  ARG 102          2HH1      ARG 102 119.999  -8.261   3.487
  179   1HH2  ARG 102          1HH2      ARG 102 122.971  -7.974   1.672
  180   2HH2  ARG 102          2HH2      ARG 102 121.772  -9.062   2.285
  181    H    MET 103           H        MET 103 124.611  -3.769   1.467
  182    HA   MET 103           HA       MET 103 124.659  -6.588   1.249
  183   1HB   MET 103          2HB       MET 103 125.100  -4.340  -0.696
  184   2HB   MET 103          1HB       MET 103 125.339  -6.012  -1.185
  185   1HG   MET 103          2HG       MET 103 122.903  -6.171  -0.024
  186   2HG   MET 103          1HG       MET 103 122.862  -4.529  -0.659
  187   1HE   MET 103          1HE       MET 103 120.875  -7.152  -2.962
  188   2HE   MET 103          2HE       MET 103 120.696  -5.436  -2.593
  189   3HE   MET 103          3HE       MET 103 120.908  -6.603  -1.287
  190    H    PHE 104           H        PHE 104 127.182  -4.118   0.926
  191    HA   PHE 104           HA       PHE 104 129.272  -5.817   0.156
  192   1HB   PHE 104          2HB       PHE 104 129.007  -3.080   1.171
  193   2HB   PHE 104          1HB       PHE 104 130.524  -3.849   1.619
  194    HD1  PHE 104           HD1      PHE 104 132.166  -4.429  -0.048
  195    HD2  PHE 104           HD2      PHE 104 128.465  -2.637  -1.150
  196    HE1  PHE 104           HE1      PHE 104 133.073  -3.941  -2.282
  197    HE2  PHE 104           HE2      PHE 104 129.365  -2.149  -3.388
  198    HZ   PHE 104           HZ       PHE 104 131.671  -2.801  -3.956
  199    H    ASP 105           H        ASP 105 128.213  -4.772   3.376
  200    HA   ASP 105           HA       ASP 105 130.233  -6.072   4.836
  201   1HB   ASP 105          2HB       ASP 105 128.106  -4.421   5.447
  202   2HB   ASP 105          1HB       ASP 105 127.644  -5.945   6.198
  203    H    LYS 106           H        LYS 106 130.517  -8.129   5.454
  204    HA   LYS 106           HA       LYS 106 128.862 -10.172   4.324
  205   1HB   LYS 106          2HB       LYS 106 131.489  -9.986   5.392
  206   2HB   LYS 106          1HB       LYS 106 130.644 -11.234   6.297
  207   1HG   LYS 106          2HG       LYS 106 130.573 -11.204   3.306
  208   2HG   LYS 106          1HG       LYS 106 131.946 -11.890   4.176
  209   1HD   LYS 106          2HD       LYS 106 129.108 -12.705   4.748
  210   2HD   LYS 106          1HD       LYS 106 130.084 -13.495   3.509
  211   1HE   LYS 106          2HE       LYS 106 130.981 -13.210   6.366
  212   2HE   LYS 106          1HE       LYS 106 130.061 -14.597   5.787
  213   1HZ   LYS 106          1HZ       LYS 106 132.582 -13.760   4.489
  214   2HZ   LYS 106          2HZ       LYS 106 131.797 -15.256   4.397
  215   3HZ   LYS 106          3HZ       LYS 106 132.578 -14.796   5.826
  216    H    ASN 107           H        ASN 107 129.844  -9.631   7.712
  217    HA   ASN 107           HA       ASN 107 127.503 -11.074   8.631
  218   1HB   ASN 107          2HB       ASN 107 128.502 -10.640  10.906
  219   2HB   ASN 107          1HB       ASN 107 129.523 -11.560   9.807
  220   1HD2  ASN 107          1HD2      ASN 107 129.363  -8.947  11.875
  221   2HD2  ASN 107          2HD2      ASN 107 130.826  -8.154  11.412
  222    H    ALA 108           H        ALA 108 128.231  -7.879   7.864
  223    HA   ALA 108           HA       ALA 108 127.104  -5.922   8.123
  224   1HB   ALA 108          1HB       ALA 108 124.719  -6.336   9.303
  225   2HB   ALA 108          2HB       ALA 108 125.066  -7.966   8.726
  226   3HB   ALA 108          3HB       ALA 108 125.024  -6.618   7.589
  227    H    ASP 109           H        ASP 109 128.834  -5.516   9.717
  228    HA   ASP 109           HA       ASP 109 127.844  -5.453  12.484
  229   1HB   ASP 109          2HB       ASP 109 130.264  -5.078  13.073
  230   2HB   ASP 109          1HB       ASP 109 129.915  -6.642  12.345
  231    H    GLY 110           H        GLY 110 128.726  -3.487   9.796
  232   1HA   GLY 110          2HA       GLY 110 127.723  -1.197   9.987
  233   2HA   GLY 110          1HA       GLY 110 128.585  -1.087  11.512
  234    H    TYR 111           H        TYR 111 130.884  -2.589  10.220
  235    HA   TYR 111           HA       TYR 111 131.912  -0.414   8.526
  236   1HB   TYR 111          2HB       TYR 111 133.396  -1.805  10.766
  237   2HB   TYR 111          1HB       TYR 111 134.119  -0.669   9.633
  238    HD1  TYR 111           HD1      TYR 111 133.757   1.699   9.852
  239    HD2  TYR 111           HD2      TYR 111 131.795  -1.027  12.462
  240    HE1  TYR 111           HE1      TYR 111 133.130   3.567  11.321
  241    HE2  TYR 111           HE2      TYR 111 131.161   0.833  13.939
  242    HH   TYR 111           HH       TYR 111 130.814   3.313  13.732
  243    H    ILE 112           H        ILE 112 133.825  -1.065   7.236
  244    HA   ILE 112           HA       ILE 112 133.832  -3.945   6.621
  245    HB   ILE 112           HB       ILE 112 133.983  -1.772   4.531
  246   1HG1  ILE 112          2HG1      ILE 112 131.640  -3.611   4.984
  247   2HG1  ILE 112          1HG1      ILE 112 131.741  -2.036   5.764
  248   1HG2  ILE 112          1HG2      ILE 112 135.097  -3.701   3.758
  249   2HG2  ILE 112          2HG2      ILE 112 133.493  -3.750   3.026
  250   3HG2  ILE 112          3HG2      ILE 112 133.859  -4.773   4.415
  251   1HD1  ILE 112          1HD1      ILE 112 130.404  -1.860   3.786
  252   2HD1  ILE 112          2HD1      ILE 112 131.679  -2.585   2.808
  253   3HD1  ILE 112          3HD1      ILE 112 131.919  -0.995   3.530
  254    H    ASP 113           H        ASP 113 135.789  -4.820   5.977
  255    HA   ASP 113           HA       ASP 113 138.108  -3.030   5.881
  256   1HB   ASP 113          2HB       ASP 113 139.385  -4.541   7.348
  257   2HB   ASP 113          1HB       ASP 113 137.992  -3.858   8.179
  258    H    LEU 114           H        LEU 114 140.138  -4.685   5.508
  259    HA   LEU 114           HA       LEU 114 139.886  -5.538   2.858
  260   1HB   LEU 114          2HB       LEU 114 141.925  -5.805   4.992
  261   2HB   LEU 114          1HB       LEU 114 142.043  -6.931   3.654
  262    HG   LEU 114           HG       LEU 114 143.448  -4.889   3.400
  263   1HD1  LEU 114          1HD1      LEU 114 142.103  -6.288   1.518
  264   2HD1  LEU 114          2HD1      LEU 114 143.264  -5.009   1.164
  265   3HD1  LEU 114          3HD1      LEU 114 141.537  -4.652   1.180
  266   1HD2  LEU 114          1HD2      LEU 114 140.806  -3.483   3.033
  267   2HD2  LEU 114          2HD2      LEU 114 142.415  -2.777   2.875
  268   3HD2  LEU 114          3HD2      LEU 114 141.843  -3.323   4.451
  269    H    GLU 115           H        GLU 115 139.633  -7.314   5.893
  270    HA   GLU 115           HA       GLU 115 139.538  -9.902   4.748
  271   1HB   GLU 115          2HB       GLU 115 138.260  -9.070   7.353
  272   2HB   GLU 115          1HB       GLU 115 138.844 -10.667   6.904
  273   1HG   GLU 115          2HG       GLU 115 140.494  -8.216   7.460
  274   2HG   GLU 115          1HG       GLU 115 140.391  -9.683   8.433
  275    H    GLU 116           H        GLU 116 136.965  -7.731   5.906
  276    HA   GLU 116           HA       GLU 116 134.819  -9.403   5.176
  277   1HB   GLU 116          2HB       GLU 116 134.814  -7.353   6.723
  278   2HB   GLU 116          1HB       GLU 116 134.667  -6.397   5.255
  279   1HG   GLU 116          2HG       GLU 116 132.473  -6.613   5.605
  280   2HG   GLU 116          1HG       GLU 116 132.690  -8.208   4.888
  281    H    LEU 117           H        LEU 117 136.647  -6.985   3.409
  282    HA   LEU 117           HA       LEU 117 134.865  -6.970   1.151
  283   1HB   LEU 117          2HB       LEU 117 136.617  -5.173   2.025
  284   2HB   LEU 117          1HB       LEU 117 137.681  -6.033   0.927
  285    HG   LEU 117           HG       LEU 117 136.023  -5.615  -0.902
  286   1HD1  LEU 117          1HD1      LEU 117 134.101  -4.476  -0.604
  287   2HD1  LEU 117          2HD1      LEU 117 134.785  -3.432   0.642
  288   3HD1  LEU 117          3HD1      LEU 117 134.260  -5.066   1.052
  289   1HD2  LEU 117          1HD2      LEU 117 136.756  -2.952   0.185
  290   2HD2  LEU 117          2HD2      LEU 117 136.985  -3.619  -1.432
  291   3HD2  LEU 117          3HD2      LEU 117 138.053  -4.107  -0.117
  292    H    LYS 118           H        LYS 118 137.730  -8.707   2.116
  293    HA   LYS 118           HA       LYS 118 138.515  -9.685  -0.403
  294   1HB   LYS 118          2HB       LYS 118 139.953  -9.797   1.582
  295   2HB   LYS 118          1HB       LYS 118 138.851 -10.950   2.323
  296   1HG   LYS 118          2HG       LYS 118 139.312 -12.518   0.463
  297   2HG   LYS 118          1HG       LYS 118 140.504 -11.375  -0.155
  298   1HD   LYS 118          2HD       LYS 118 141.640 -11.521   2.090
  299   2HD   LYS 118          1HD       LYS 118 140.554 -12.859   2.466
  300   1HE   LYS 118          2HE       LYS 118 142.507 -12.738   0.170
  301   2HE   LYS 118          1HE       LYS 118 142.701 -13.676   1.650
  302   1HZ   LYS 118          1HZ       LYS 118 140.460 -14.052  -0.258
  303   2HZ   LYS 118          2HZ       LYS 118 140.857 -15.035   1.060
  304   3HZ   LYS 118          3HZ       LYS 118 141.881 -14.969  -0.284
  305    H    ILE 119           H        ILE 119 136.021 -10.674   1.825
  306    HA   ILE 119           HA       ILE 119 135.573 -13.260   0.730
  307    HB   ILE 119           HB       ILE 119 133.579 -11.546   2.213
  308   1HG1  ILE 119          2HG1      ILE 119 135.070 -13.630   3.675
  309   2HG1  ILE 119          1HG1      ILE 119 136.031 -12.240   3.185
  310   1HG2  ILE 119          1HG2      ILE 119 133.629 -14.473   2.527
  311   2HG2  ILE 119          2HG2      ILE 119 133.125 -13.879   0.945
  312   3HG2  ILE 119          3HG2      ILE 119 132.263 -13.367   2.395
  313   1HD1  ILE 119          1HD1      ILE 119 133.951 -12.472   5.227
  314   2HD1  ILE 119          2HD1      ILE 119 133.851 -11.022   4.227
  315   3HD1  ILE 119          3HD1      ILE 119 135.329 -11.375   5.121
  316    H    MET 120           H        MET 120 133.619 -10.281   0.479
  317    HA   MET 120           HA       MET 120 131.842 -11.179  -1.451
  318   1HB   MET 120          2HB       MET 120 131.511  -8.757  -1.996
  319   2HB   MET 120          1HB       MET 120 131.388  -9.142  -0.285
  320   1HG   MET 120          2HG       MET 120 132.645  -7.229  -0.241
  321   2HG   MET 120          1HG       MET 120 133.893  -8.472  -0.220
  322   1HE   MET 120          1HE       MET 120 132.531  -5.726  -3.494
  323   2HE   MET 120          2HE       MET 120 131.532  -6.791  -2.503
  324   3HE   MET 120          3HE       MET 120 132.212  -7.378  -4.021
  325    H    LEU 121           H        LEU 121 135.102  -9.968  -1.807
  326    HA   LEU 121           HA       LEU 121 134.948  -9.631  -4.648
  327   1HB   LEU 121          2HB       LEU 121 136.710  -8.860  -2.651
  328   2HB   LEU 121          1HB       LEU 121 137.625 -10.036  -3.575
  329    HG   LEU 121           HG       LEU 121 136.789  -8.609  -5.628
  330   1HD1  LEU 121          1HD1      LEU 121 136.352  -6.844  -3.263
  331   2HD1  LEU 121          2HD1      LEU 121 135.395  -7.015  -4.735
  332   3HD1  LEU 121          3HD1      LEU 121 136.928  -6.144  -4.776
  333   1HD2  LEU 121          1HD2      LEU 121 138.915  -7.884  -5.761
  334   2HD2  LEU 121          2HD2      LEU 121 139.145  -8.898  -4.335
  335   3HD2  LEU 121          3HD2      LEU 121 138.883  -7.162  -4.151
  336    H    GLN 122           H        GLN 122 135.791 -12.222  -2.471
  337    HA   GLN 122           HA       GLN 122 137.150 -13.862  -4.338
  338   1HB   GLN 122          2HB       GLN 122 135.846 -14.315  -1.682
  339   2HB   GLN 122          1HB       GLN 122 136.339 -15.700  -2.645
  340   1HG   GLN 122          2HG       GLN 122 138.287 -13.504  -2.128
  341   2HG   GLN 122          1HG       GLN 122 137.945 -14.686  -0.865
  342   1HE2  GLN 122          1HE2      GLN 122 139.129 -14.260  -4.136
  343   2HE2  GLN 122          2HE2      GLN 122 140.029 -15.732  -4.206
  344    H    ALA 123           H        ALA 123 133.779 -13.356  -3.588
  345    HA   ALA 123           HA       ALA 123 132.695 -15.664  -4.758
  346   1HB   ALA 123          1HB       ALA 123 131.355 -12.971  -4.746
  347   2HB   ALA 123          2HB       ALA 123 131.513 -13.966  -3.300
  348   3HB   ALA 123          3HB       ALA 123 130.605 -14.566  -4.687
  349    H    THR 124           H        THR 124 133.630 -12.560  -6.143
  350    HA   THR 124           HA       THR 124 132.485 -12.864  -8.676
  351    HB   THR 124           HB       THR 124 134.039 -11.158  -9.420
  352    HG1  THR 124           HG1      THR 124 135.935 -11.969  -8.479
  353   1HG2  THR 124          1HG2      THR 124 133.188  -9.497  -8.207
  354   2HG2  THR 124          2HG2      THR 124 133.804 -10.156  -6.692
  355   3HG2  THR 124          3HG2      THR 124 132.296 -10.768  -7.371
  356    H    GLY 125           H        GLY 125 134.103 -12.868 -10.689
  357   1HA   GLY 125          2HA       GLY 125 135.516 -15.446 -10.496
  358   2HA   GLY 125          1HA       GLY 125 134.833 -14.775 -11.969
  359    H    GLU 126           H        GLU 126 135.962 -12.082 -11.235
  360    HA   GLU 126           HA       GLU 126 138.297 -12.194 -12.758
  361   1HB   GLU 126          2HB       GLU 126 137.159 -10.150 -10.875
  362   2HB   GLU 126          1HB       GLU 126 138.740  -9.903 -11.605
  363   1HG   GLU 126          2HG       GLU 126 137.410 -10.455 -13.819
  364   2HG   GLU 126          1HG       GLU 126 136.049  -9.889 -12.849
  365    H    THR 127           H        THR 127 140.458 -12.260 -12.273
  366    HA   THR 127           HA       THR 127 141.151 -13.490  -9.752
  367    HB   THR 127           HB       THR 127 143.460 -13.553 -10.767
  368    HG1  THR 127           HG1      THR 127 142.981 -11.713 -12.192
  369   1HG2  THR 127          1HG2      THR 127 142.776 -15.049 -12.736
  370   2HG2  THR 127          2HG2      THR 127 141.127 -14.787 -12.167
  371   3HG2  THR 127          3HG2      THR 127 142.318 -15.538 -11.105
  372    H    ILE 128           H        ILE 128 140.783 -11.803  -8.266
  373    HA   ILE 128           HA       ILE 128 142.486  -9.431  -8.508
  374    HB   ILE 128           HB       ILE 128 140.353  -9.973  -6.441
  375   1HG1  ILE 128          2HG1      ILE 128 139.821  -7.995  -8.558
  376   2HG1  ILE 128          1HG1      ILE 128 139.880  -9.664  -9.117
  377   1HG2  ILE 128          1HG2      ILE 128 140.563  -7.276  -6.703
  378   2HG2  ILE 128          2HG2      ILE 128 142.232  -7.782  -6.958
  379   3HG2  ILE 128          3HG2      ILE 128 141.390  -8.233  -5.475
  380   1HD1  ILE 128          1HD1      ILE 128 137.704  -9.625  -8.575
  381   2HD1  ILE 128          2HD1      ILE 128 137.901  -8.297  -7.432
  382   3HD1  ILE 128          3HD1      ILE 128 138.311  -9.943  -6.952
  383    H    THR 129           H        THR 129 144.190  -9.060  -7.210
  384    HA   THR 129           HA       THR 129 145.028 -11.199  -5.434
  385    HB   THR 129           HB       THR 129 146.662  -8.740  -5.676
  386    HG1  THR 129           HG1      THR 129 146.563  -8.725  -7.758
  387   1HG2  THR 129          1HG2      THR 129 147.877 -10.382  -4.654
  388   2HG2  THR 129          2HG2      THR 129 148.343 -10.625  -6.337
  389   3HG2  THR 129          3HG2      THR 129 147.133 -11.673  -5.597
  390    H    GLU 130           H        GLU 130 146.316 -10.258  -3.410
  391    HA   GLU 130           HA       GLU 130 144.314  -9.186  -1.688
  392   1HB   GLU 130          2HB       GLU 130 146.296 -10.803  -1.161
  393   2HB   GLU 130          1HB       GLU 130 147.214  -9.321  -0.942
  394   1HG   GLU 130          2HG       GLU 130 145.769  -8.604   0.818
  395   2HG   GLU 130          1HG       GLU 130 144.656  -9.935   0.511
  396    H    ASP 131           H        ASP 131 147.053  -7.868  -3.406
  397    HA   ASP 131           HA       ASP 131 147.159  -5.397  -1.988
  398   1HB   ASP 131          2HB       ASP 131 148.464  -6.585  -4.344
  399   2HB   ASP 131          1HB       ASP 131 148.280  -4.835  -4.420
  400    H    ASP 132           H        ASP 132 145.490  -6.531  -4.865
  401    HA   ASP 132           HA       ASP 132 144.601  -4.024  -5.799
  402   1HB   ASP 132          2HB       ASP 132 144.080  -6.836  -6.388
  403   2HB   ASP 132          1HB       ASP 132 142.647  -5.829  -6.578
  404    H    ILE 133           H        ILE 133 143.428  -6.174  -3.318
  405    HA   ILE 133           HA       ILE 133 140.850  -4.948  -3.070
  406    HB   ILE 133           HB       ILE 133 142.274  -6.624  -1.004
  407   1HG1  ILE 133          2HG1      ILE 133 140.263  -7.799  -2.862
  408   2HG1  ILE 133          1HG1      ILE 133 141.883  -7.520  -3.490
  409   1HG2  ILE 133          1HG2      ILE 133 139.617  -7.187  -0.834
  410   2HG2  ILE 133          2HG2      ILE 133 139.592  -5.477  -1.263
  411   3HG2  ILE 133          3HG2      ILE 133 140.465  -6.014   0.171
  412   1HD1  ILE 133          1HD1      ILE 133 142.440  -8.750  -1.144
  413   2HD1  ILE 133          2HD1      ILE 133 142.281  -9.570  -2.698
  414   3HD1  ILE 133          3HD1      ILE 133 140.914  -9.516  -1.585
  415    H    GLU 134           H        GLU 134 144.012  -4.410  -1.712
  416    HA   GLU 134           HA       GLU 134 143.249  -2.881   0.536
  417   1HB   GLU 134          2HB       GLU 134 145.752  -3.301  -1.011
  418   2HB   GLU 134          1HB       GLU 134 145.674  -1.875   0.015
  419   1HG   GLU 134          2HG       GLU 134 144.759  -3.803   1.698
  420   2HG   GLU 134          1HG       GLU 134 145.926  -4.699   0.727
  421    H    GLU 135           H        GLU 135 144.324  -1.879  -2.711
  422    HA   GLU 135           HA       GLU 135 144.072   0.875  -2.335
  423   1HB   GLU 135          2HB       GLU 135 144.048   1.054  -4.757
  424   2HB   GLU 135          1HB       GLU 135 145.222  -0.155  -4.258
  425   1HG   GLU 135          2HG       GLU 135 144.241  -1.687  -5.510
  426   2HG   GLU 135          1HG       GLU 135 142.699  -1.418  -4.698
  427    H    LEU 136           H        LEU 136 141.667  -1.561  -2.982
  428    HA   LEU 136           HA       LEU 136 139.590   0.055  -3.936
  429   1HB   LEU 136          2HB       LEU 136 139.919  -2.617  -3.362
  430   2HB   LEU 136          1HB       LEU 136 138.735  -2.116  -2.170
  431    HG   LEU 136           HG       LEU 136 137.970  -1.055  -4.715
  432   1HD1  LEU 136          1HD1      LEU 136 138.890  -2.634  -6.046
  433   2HD1  LEU 136          2HD1      LEU 136 137.467  -3.544  -5.540
  434   3HD1  LEU 136          3HD1      LEU 136 139.017  -3.818  -4.746
  435   1HD2  LEU 136          1HD2      LEU 136 135.912  -1.917  -4.155
  436   2HD2  LEU 136          2HD2      LEU 136 136.667  -1.776  -2.567
  437   3HD2  LEU 136          3HD2      LEU 136 136.598  -3.341  -3.376
  438    H    MET 137           H        MET 137 140.721  -0.591  -0.678
  439    HA   MET 137           HA       MET 137 138.499   0.810   0.540
  440   1HB   MET 137          2HB       MET 137 139.685  -1.188   1.563
  441   2HB   MET 137          1HB       MET 137 141.036  -0.110   1.890
  442   1HG   MET 137          2HG       MET 137 139.966   0.949   3.573
  443   2HG   MET 137          1HG       MET 137 138.382   0.785   2.818
  444   1HE   MET 137          1HE       MET 137 136.550  -1.180   4.171
  445   2HE   MET 137          2HE       MET 137 137.238  -2.677   3.540
  446   3HE   MET 137          3HE       MET 137 137.187  -1.234   2.528
  447    H    LYS 138           H        LYS 138 141.577   1.603  -0.723
  448    HA   LYS 138           HA       LYS 138 142.377   3.727   0.886
  449   1HB   LYS 138          2HB       LYS 138 143.388   2.561  -1.321
  450   2HB   LYS 138          1HB       LYS 138 142.757   4.037  -2.037
  451   1HG   LYS 138          2HG       LYS 138 144.691   4.965  -1.461
  452   2HG   LYS 138          1HG       LYS 138 144.077   4.951   0.193
  453   1HD   LYS 138          2HD       LYS 138 145.021   2.485   0.149
  454   2HD   LYS 138          1HD       LYS 138 146.045   3.148  -1.124
  455   1HE   LYS 138          2HE       LYS 138 146.357   5.079   0.675
  456   2HE   LYS 138          1HE       LYS 138 145.978   3.758   1.779
  457   1HZ   LYS 138          1HZ       LYS 138 147.910   2.710   1.334
  458   2HZ   LYS 138          2HZ       LYS 138 148.429   4.272   0.939
  459   3HZ   LYS 138          3HZ       LYS 138 147.955   3.204  -0.285
  460    H    ASP 139           H        ASP 139 140.637   4.003  -2.221
  461    HA   ASP 139           HA       ASP 139 139.936   6.724  -1.744
  462   1HB   ASP 139          2HB       ASP 139 138.792   6.639  -3.834
  463   2HB   ASP 139          1HB       ASP 139 140.242   5.656  -4.011
  464    H    GLY 140           H        GLY 140 138.522   3.713  -0.870
  465   1HA   GLY 140          2HA       GLY 140 135.848   4.771  -0.541
  466   2HA   GLY 140          1HA       GLY 140 136.400   3.166  -0.087
  467    H    ASP 141           H        ASP 141 138.684   4.351   1.432
  468    HA   ASP 141           HA       ASP 141 137.169   4.920   3.868
  469   1HB   ASP 141          2HB       ASP 141 138.892   3.094   3.830
  470   2HB   ASP 141          1HB       ASP 141 140.121   4.331   3.594
  471    H    LYS 142           H        LYS 142 137.237   6.826   4.913
  472    HA   LYS 142           HA       LYS 142 139.211   8.826   4.061
  473   1HB   LYS 142          2HB       LYS 142 136.242   9.305   4.372
  474   2HB   LYS 142          1HB       LYS 142 137.443  10.563   4.107
  475   1HG   LYS 142          2HG       LYS 142 137.361   8.336   2.157
  476   2HG   LYS 142          1HG       LYS 142 136.026   9.490   2.134
  477   1HD   LYS 142          2HD       LYS 142 137.849  11.296   2.112
  478   2HD   LYS 142          1HD       LYS 142 138.954   9.990   1.684
  479   1HE   LYS 142          2HE       LYS 142 138.098   9.765  -0.400
  480   2HE   LYS 142          1HE       LYS 142 136.456  10.148   0.119
  481   1HZ   LYS 142          1HZ       LYS 142 138.364  12.335   0.231
  482   2HZ   LYS 142          2HZ       LYS 142 136.749  12.331  -0.270
  483   3HZ   LYS 142          3HZ       LYS 142 137.963  11.795  -1.321
  484    H    ASN 143           H        ASN 143 138.860   7.068   6.454
  485    HA   ASN 143           HA       ASN 143 138.749   9.200   8.488
  486   1HB   ASN 143          2HB       ASN 143 137.579   6.467   8.461
  487   2HB   ASN 143          1HB       ASN 143 138.243   7.041   9.988
  488   1HD2  ASN 143          1HD2      ASN 143 137.617   9.561  10.205
  489   2HD2  ASN 143          2HD2      ASN 143 135.913   9.829  10.108
  490    H    ASN 144           H        ASN 144 140.756   7.065   6.911
  491    HA   ASN 144           HA       ASN 144 142.874   6.327   7.264
  492   1HB   ASN 144          2HB       ASN 144 142.633   8.759   8.895
  493   2HB   ASN 144          1HB       ASN 144 143.907   7.666   9.425
  494   1HD2  ASN 144          1HD2      ASN 144 142.618   8.659   6.270
  495   2HD2  ASN 144          2HD2      ASN 144 144.145   9.106   5.597
  496    H    ASP 145           H        ASP 145 140.626   5.063   8.652
  497    HA   ASP 145           HA       ASP 145 141.957   4.035  11.062
  498   1HB   ASP 145          2HB       ASP 145 139.748   3.184  11.718
  499   2HB   ASP 145          1HB       ASP 145 139.698   4.919  11.418
  500    H    GLY 146           H        GLY 146 141.107   3.226   7.845
  501   1HA   GLY 146          2HA       GLY 146 141.935   1.338   6.711
  502   2HA   GLY 146          1HA       GLY 146 142.157   0.534   8.257
  503    H    ARG 147           H        ARG 147 139.159   2.127   7.498
  504    HA   ARG 147           HA       ARG 147 137.871  -0.273   6.545
  505   1HB   ARG 147          2HB       ARG 147 137.010   0.881   9.202
  506   2HB   ARG 147          1HB       ARG 147 136.304  -0.502   8.375
  507   1HG   ARG 147          2HG       ARG 147 138.469  -1.688   8.624
  508   2HG   ARG 147          1HG       ARG 147 139.055  -0.327   9.583
  509   1HD   ARG 147          2HD       ARG 147 137.088  -0.694  11.107
  510   2HD   ARG 147          1HD       ARG 147 136.773  -2.187  10.224
  511    HE   ARG 147           HE       ARG 147 138.531  -3.166  11.318
  512   1HH1  ARG 147          1HH1      ARG 147 138.728   0.294  11.732
  513   2HH1  ARG 147          2HH1      ARG 147 140.012   0.207  12.892
  514   1HH2  ARG 147          1HH2      ARG 147 140.218  -3.283  12.844
  515   2HH2  ARG 147          2HH2      ARG 147 140.858  -1.823  13.522
  516    H    ILE 148           H        ILE 148 135.487   0.108   6.213
  517    HA   ILE 148           HA       ILE 148 134.993   2.951   5.599
  518    HB   ILE 148           HB       ILE 148 133.888   0.609   4.052
  519   1HG1  ILE 148          2HG1      ILE 148 136.163   2.441   3.264
  520   2HG1  ILE 148          1HG1      ILE 148 136.378   0.803   3.873
  521   1HG2  ILE 148          1HG2      ILE 148 133.802   3.588   3.705
  522   2HG2  ILE 148          2HG2      ILE 148 132.463   2.440   3.757
  523   3HG2  ILE 148          3HG2      ILE 148 133.531   2.488   2.354
  524   1HD1  ILE 148          1HD1      ILE 148 136.515   0.508   1.598
  525   2HD1  ILE 148          2HD1      ILE 148 135.282   1.722   1.260
  526   3HD1  ILE 148          3HD1      ILE 148 134.815   0.149   1.910
  527    H    ASP 149           H        ASP 149 132.963   3.780   6.005
  528    HA   ASP 149           HA       ASP 149 131.001   1.991   7.255
  529   1HB   ASP 149          2HB       ASP 149 130.557   3.679   8.998
  530   2HB   ASP 149          1HB       ASP 149 132.212   3.082   9.075
  531    H    TYR 150           H        TYR 150 128.967   3.591   7.790
  532    HA   TYR 150           HA       TYR 150 127.804   4.126   5.305
  533   1HB   TYR 150          2HB       TYR 150 126.644   3.707   7.542
  534   2HB   TYR 150          1HB       TYR 150 126.927   5.409   7.890
  535    HD1  TYR 150           HD1      TYR 150 125.844   3.645   4.777
  536    HD2  TYR 150           HD2      TYR 150 124.907   6.526   7.766
  537    HE1  TYR 150           HE1      TYR 150 123.788   4.230   3.561
  538    HE2  TYR 150           HE2      TYR 150 122.849   7.119   6.557
  539    HH   TYR 150           HH       TYR 150 121.931   6.993   4.312
  540    H    ASP 151           H        ASP 151 129.301   6.308   7.663
  541    HA   ASP 151           HA       ASP 151 128.704   8.721   6.362
  542   1HB   ASP 151          2HB       ASP 151 130.634   7.836   8.434
  543   2HB   ASP 151          1HB       ASP 151 131.022   9.335   7.593
  544    H    GLU 152           H        GLU 152 131.471   6.533   6.063
  545    HA   GLU 152           HA       GLU 152 132.834   8.188   4.162
  546   1HB   GLU 152          2HB       GLU 152 133.287   5.251   4.695
  547   2HB   GLU 152          1HB       GLU 152 134.422   6.393   3.987
  548   1HG   GLU 152          2HG       GLU 152 134.701   7.525   6.057
  549   2HG   GLU 152          1HG       GLU 152 133.367   6.635   6.790
  550    H    PHE 153           H        PHE 153 130.667   5.423   4.007
  551    HA   PHE 153           HA       PHE 153 130.999   4.807   1.284
  552   1HB   PHE 153          2HB       PHE 153 129.741   3.530   3.192
  553   2HB   PHE 153          1HB       PHE 153 128.356   4.476   2.660
  554    HD1  PHE 153           HD1      PHE 153 127.120   3.840   0.782
  555    HD2  PHE 153           HD2      PHE 153 130.923   2.071   1.502
  556    HE1  PHE 153           HE1      PHE 153 126.698   2.211  -1.013
  557    HE2  PHE 153           HE2      PHE 153 130.508   0.438  -0.293
  558    HZ   PHE 153           HZ       PHE 153 128.393   0.508  -1.553
  559    H    LEU 154           H        LEU 154 128.765   7.001   2.940
  560    HA   LEU 154           HA       LEU 154 127.254   7.741   0.691
  561   1HB   LEU 154          2HB       LEU 154 127.698   8.795   3.413
  562   2HB   LEU 154          1HB       LEU 154 127.143   9.967   2.233
  563    HG   LEU 154           HG       LEU 154 125.313   8.919   3.546
  564   1HD1  LEU 154          1HD1      LEU 154 124.799   9.882   1.406
  565   2HD1  LEU 154          2HD1      LEU 154 123.888   8.383   1.591
  566   3HD1  LEU 154          3HD1      LEU 154 125.329   8.420   0.575
  567   1HD2  LEU 154          1HD2      LEU 154 126.119   6.710   3.879
  568   2HD2  LEU 154          2HD2      LEU 154 126.276   6.436   2.144
  569   3HD2  LEU 154          3HD2      LEU 154 124.677   6.583   2.873
  570    H    GLU 155           H        GLU 155 129.990   9.421   2.243
  571    HA   GLU 155           HA       GLU 155 130.201  11.492   0.371
  572   1HB   GLU 155          2HB       GLU 155 131.966  10.319   2.448
  573   2HB   GLU 155          1HB       GLU 155 132.743  11.306   1.218
  574   1HG   GLU 155          2HG       GLU 155 130.335  12.336   2.646
  575   2HG   GLU 155          1HG       GLU 155 131.916  12.385   3.426
  576    H    PHE 156           H        PHE 156 131.739   8.306   0.490
  577    HA   PHE 156           HA       PHE 156 133.467   8.629  -1.691
  578   1HB   PHE 156          2HB       PHE 156 133.602   6.754  -0.085
  579   2HB   PHE 156          1HB       PHE 156 132.113   6.092  -0.750
  580    HD1  PHE 156           HD1      PHE 156 135.251   7.448  -2.251
  581    HD2  PHE 156           HD2      PHE 156 132.513   4.201  -1.975
  582    HE1  PHE 156           HE1      PHE 156 136.557   6.210  -3.931
  583    HE2  PHE 156           HE2      PHE 156 133.813   2.958  -3.653
  584    HZ   PHE 156           HZ       PHE 156 135.838   3.961  -4.633
  585    H    MET 157           H        MET 157 130.125   7.461  -1.536
  586    HA   MET 157           HA       MET 157 129.928   6.885  -4.314
  587   1HB   MET 157          2HB       MET 157 128.344   6.478  -2.040
  588   2HB   MET 157          1HB       MET 157 127.381   7.510  -3.088
  589   1HG   MET 157          2HG       MET 157 126.727   5.501  -3.886
  590   2HG   MET 157          1HG       MET 157 128.146   5.741  -4.905
  591   1HE   MET 157          1HE       MET 157 129.211   3.042  -5.299
  592   2HE   MET 157          2HE       MET 157 130.533   3.147  -4.135
  593   3HE   MET 157          3HE       MET 157 130.025   4.583  -5.025
  594    H    LYS 158           H        LYS 158 129.415   9.733  -2.365
  595    HA   LYS 158           HA       LYS 158 128.030  11.196  -4.415
  596   1HB   LYS 158          2HB       LYS 158 129.139  11.854  -1.711
  597   2HB   LYS 158          1HB       LYS 158 128.691  13.158  -2.803
  598   1HG   LYS 158          2HG       LYS 158 126.426  12.025  -2.988
  599   2HG   LYS 158          1HG       LYS 158 126.930  11.040  -1.612
  600   1HD   LYS 158          2HD       LYS 158 127.239  13.030  -0.261
  601   2HD   LYS 158          1HD       LYS 158 126.848  14.056  -1.643
  602   1HE   LYS 158          2HE       LYS 158 124.593  13.210  -1.696
  603   2HE   LYS 158          1HE       LYS 158 124.966  12.033  -0.436
  604   1HZ   LYS 158          1HZ       LYS 158 124.432  14.884  -0.214
  605   2HZ   LYS 158          2HZ       LYS 158 125.636  14.274   0.804
  606   3HZ   LYS 158          3HZ       LYS 158 124.075  13.627   0.861
  607    H    GLY 159           H        GLY 159 129.923  10.440  -5.909
  608   1HA   GLY 159          2HA       GLY 159 131.254  11.713  -7.448
  609   2HA   GLY 159          1HA       GLY 159 131.751  12.738  -6.111
  610    H    VAL 160           H        VAL 160 131.970   9.386  -7.272
  611    HA   VAL 160           HA       VAL 160 134.246   8.776  -5.656
  612    HB   VAL 160           HB       VAL 160 133.301   7.304  -8.118
  613   1HG1  VAL 160          1HG1      VAL 160 135.598   6.933  -6.744
  614   2HG1  VAL 160          2HG1      VAL 160 134.731   5.645  -7.582
  615   3HG1  VAL 160          3HG1      VAL 160 134.509   5.873  -5.847
  616   1HG2  VAL 160          1HG2      VAL 160 132.546   6.580  -5.309
  617   2HG2  VAL 160          2HG2      VAL 160 131.802   6.077  -6.827
  618   3HG2  VAL 160          3HG2      VAL 160 131.583   7.728  -6.242
  619    H    GLU 161           H        GLU 161 133.857   9.176  -9.182
  620    HA   GLU 161           HA       GLU 161 136.634   9.162  -9.724
  621   1HB   GLU 161          2HB       GLU 161 134.403  10.352 -11.383
  622   2HB   GLU 161          1HB       GLU 161 136.014   9.939 -11.954
  623   1HG   GLU 161          2HG       GLU 161 135.585   7.702 -11.989
  624   2HG   GLU 161          1HG       GLU 161 134.383   7.800 -10.702
  Start of MODEL   10
    1   1H    MET  81          1HT       MET  81  91.131  15.398  -2.641
    2   2H    MET  81          2HT       MET  81  92.306  14.877  -1.503
    3   3H    MET  81          3HT       MET  81  91.122  16.033  -1.050
    4    HA   MET  81           HA       MET  81  90.395  14.088  -0.127
    5   1HB   MET  81          2HB       MET  81  88.339  13.641  -1.364
    6   2HB   MET  81          1HB       MET  81  88.701  15.361  -1.387
    7   1HG   MET  81          2HG       MET  81  89.398  15.288  -3.634
    8   2HG   MET  81          1HG       MET  81  89.464  13.526  -3.635
    9   1HE   MET  81          1HE       MET  81  86.922  16.618  -4.431
   10   2HE   MET  81          2HE       MET  81  86.515  15.548  -5.772
   11   3HE   MET  81          3HE       MET  81  88.205  15.875  -5.385
   12    H    VAL  82           H        VAL  82  91.679  13.610  -3.348
   13    HA   VAL  82           HA       VAL  82  92.066  10.768  -2.713
   14    HB   VAL  82           HB       VAL  82  91.697  10.245  -5.140
   15   1HG1  VAL  82          1HG1      VAL  82  89.521   9.732  -4.752
   16   2HG1  VAL  82          2HG1      VAL  82  89.123  11.354  -4.186
   17   3HG1  VAL  82          3HG1      VAL  82  89.954  10.225  -3.116
   18   1HG2  VAL  82          1HG2      VAL  82  91.904  12.306  -6.235
   19   2HG2  VAL  82          2HG2      VAL  82  90.783  13.106  -5.131
   20   3HG2  VAL  82          3HG2      VAL  82  90.179  11.942  -6.311
   21    H    ARG  83           H        ARG  83  94.130  10.197  -2.849
   22    HA   ARG  83           HA       ARG  83  96.347  10.195  -3.348
   23   1HB   ARG  83          2HB       ARG  83  94.992  10.422  -5.782
   24   2HB   ARG  83          1HB       ARG  83  96.260  11.637  -5.864
   25   1HG   ARG  83          2HG       ARG  83  97.697   9.578  -4.941
   26   2HG   ARG  83          1HG       ARG  83  96.450   8.693  -5.821
   27   1HD   ARG  83          2HD       ARG  83  97.379   9.203  -7.775
   28   2HD   ARG  83          1HD       ARG  83  97.386  10.921  -7.380
   29    HE   ARG  83           HE       ARG  83  99.496   9.971  -5.989
   30   1HH1  ARG  83          1HH1      ARG  83  98.532   9.683  -9.332
   31   2HH1  ARG  83          2HH1      ARG  83 100.157   9.564  -9.919
   32   1HH2  ARG  83          1HH2      ARG  83 101.632   9.815  -6.761
   33   2HH2  ARG  83          2HH2      ARG  83 101.917   9.639  -8.460
   34    H    CYS  84           H        CYS  84  96.916  11.641  -1.706
   35    HA   CYS  84           HA       CYS  84  97.396  14.411  -2.594
   36   1HB   CYS  84          2HB       CYS  84  95.770  13.974  -0.645
   37   2HB   CYS  84          1HB       CYS  84  97.203  13.561   0.289
   38    HG   CYS  84           HG       CYS  84  97.133  15.980   0.784
   39    H    MET  85           H        MET  85  98.671  11.836  -0.491
   40    HA   MET  85           HA       MET  85 101.378  12.656  -1.242
   41   1HB   MET  85          2HB       MET  85 100.365  13.412   1.171
   42   2HB   MET  85          1HB       MET  85 101.087  11.864   1.584
   43   1HG   MET  85          2HG       MET  85 103.113  12.909   0.204
   44   2HG   MET  85          1HG       MET  85 102.361  14.400   0.768
   45   1HE   MET  85          1HE       MET  85 104.969  14.405   1.513
   46   2HE   MET  85          2HE       MET  85 105.289  14.180   3.232
   47   3HE   MET  85          3HE       MET  85 104.087  15.357   2.706
   48    H    LYS  86           H        LYS  86  99.928  10.494  -2.233
   49    HA   LYS  86           HA       LYS  86 100.977   8.148  -0.828
   50   1HB   LYS  86          2HB       LYS  86  98.561   8.283  -1.591
   51   2HB   LYS  86          1HB       LYS  86  99.164   8.174  -3.239
   52   1HG   LYS  86          2HG       LYS  86 100.398   6.046  -2.180
   53   2HG   LYS  86          1HG       LYS  86  98.966   6.103  -1.150
   54   1HD   LYS  86          2HD       LYS  86  97.509   5.865  -2.984
   55   2HD   LYS  86          1HD       LYS  86  98.782   6.240  -4.146
   56   1HE   LYS  86          2HE       LYS  86  99.867   4.087  -2.973
   57   2HE   LYS  86          1HE       LYS  86  98.159   3.706  -2.755
   58   1HZ   LYS  86          1HZ       LYS  86  98.943   4.610  -5.404
   59   2HZ   LYS  86          2HZ       LYS  86  97.858   3.395  -4.951
   60   3HZ   LYS  86          3HZ       LYS  86  99.521   3.088  -4.943
   61    H    ASP  87           H        ASP  87 102.711   9.976  -2.313
   62    HA   ASP  87           HA       ASP  87 103.601   8.204  -4.489
   63   1HB   ASP  87          2HB       ASP  87 104.906  10.251  -5.244
   64   2HB   ASP  87          1HB       ASP  87 103.154  10.355  -5.390
   65    H    ASP  88           H        ASP  88 104.154   7.784  -1.666
   66    HA   ASP  88           HA       ASP  88 107.026   8.358  -1.504
   67   1HB   ASP  88          2HB       ASP  88 105.343   8.857   0.407
   68   2HB   ASP  88          1HB       ASP  88 105.403   7.121   0.703
   69    H    SER  89           H        SER  89 107.444   6.734  -3.169
   70    HA   SER  89           HA       SER  89 106.959   3.961  -2.498
   71   1HB   SER  89          2HB       SER  89 108.629   5.067  -4.764
   72   2HB   SER  89          1HB       SER  89 107.950   3.445  -4.633
   73    HG   SER  89           HG       SER  89 105.926   4.267  -4.937
   74    H    LYS  90           H        LYS  90 108.947   2.450  -2.876
   75    HA   LYS  90           HA       LYS  90 111.007   3.347  -1.004
   76   1HB   LYS  90          2HB       LYS  90 109.928   0.698  -1.835
   77   2HB   LYS  90          1HB       LYS  90 111.601   0.768  -1.300
   78   1HG   LYS  90          2HG       LYS  90 110.685   1.989   0.760
   79   2HG   LYS  90          1HG       LYS  90 109.109   1.387   0.241
   80   1HD   LYS  90          2HD       LYS  90 109.590  -0.743   0.817
   81   2HD   LYS  90          1HD       LYS  90 111.274  -0.610   0.305
   82   1HE   LYS  90          2HE       LYS  90 111.591   0.862   2.374
   83   2HE   LYS  90          1HE       LYS  90 110.027   0.244   2.901
   84   1HZ   LYS  90          1HZ       LYS  90 112.382  -1.440   2.236
   85   2HZ   LYS  90          2HZ       LYS  90 110.896  -1.988   2.827
   86   3HZ   LYS  90          3HZ       LYS  90 111.892  -1.032   3.804
   87    H    GLY  91           H        GLY  91 111.145   4.436  -3.581
   88   1HA   GLY  91          2HA       GLY  91 113.389   2.974  -4.815
   89   2HA   GLY  91          1HA       GLY  91 112.370   4.143  -5.643
   90    H    LYS  92           H        LYS  92 114.367   4.092  -2.686
   91    HA   LYS  92           HA       LYS  92 115.023   6.808  -2.736
   92   1HB   LYS  92          2HB       LYS  92 116.446   4.438  -1.527
   93   2HB   LYS  92          1HB       LYS  92 116.975   6.096  -1.281
   94   1HG   LYS  92          2HG       LYS  92 114.588   6.524  -0.446
   95   2HG   LYS  92          1HG       LYS  92 114.465   4.767  -0.337
   96   1HD   LYS  92          2HD       LYS  92 116.650   4.899   1.007
   97   2HD   LYS  92          1HD       LYS  92 116.297   6.621   1.153
   98   1HE   LYS  92          2HE       LYS  92 113.955   5.783   1.942
   99   2HE   LYS  92          1HE       LYS  92 114.815   4.277   2.264
  100   1HZ   LYS  92          1HZ       LYS  92 114.617   6.218   4.038
  101   2HZ   LYS  92          2HZ       LYS  92 116.035   6.723   3.269
  102   3HZ   LYS  92          3HZ       LYS  92 115.956   5.186   3.969
  103    H    THR  93           H        THR  93 116.873   7.923  -3.407
  104    HA   THR  93           HA       THR  93 118.246   6.676  -5.677
  105    HB   THR  93           HB       THR  93 118.987   9.233  -5.890
  106    HG1  THR  93           HG1      THR  93 117.651  10.602  -4.950
  107   1HG2  THR  93          1HG2      THR  93 117.293   9.608  -7.464
  108   2HG2  THR  93          2HG2      THR  93 116.180   8.509  -6.649
  109   3HG2  THR  93          3HG2      THR  93 117.588   7.869  -7.496
  110    H    GLU  94           H        GLU  94 119.251   9.253  -3.443
  111    HA   GLU  94           HA       GLU  94 121.946   8.222  -3.425
  112   1HB   GLU  94          2HB       GLU  94 120.605  10.638  -2.249
  113   2HB   GLU  94          1HB       GLU  94 122.236  10.196  -1.767
  114   1HG   GLU  94          2HG       GLU  94 123.062  10.484  -3.964
  115   2HG   GLU  94          1HG       GLU  94 121.434  10.602  -4.633
  116    H    GLU  95           H        GLU  95 119.406   8.779  -0.996
  117    HA   GLU  95           HA       GLU  95 120.785   7.770   1.213
  118   1HB   GLU  95          2HB       GLU  95 117.958   8.308   0.535
  119   2HB   GLU  95          1HB       GLU  95 118.226   7.167   1.847
  120   1HG   GLU  95          2HG       GLU  95 118.993   8.750   3.249
  121   2HG   GLU  95          1HG       GLU  95 119.799   9.653   1.967
  122    H    GLU  96           H        GLU  96 119.308   6.126  -1.442
  123    HA   GLU  96           HA       GLU  96 118.773   3.641  -0.267
  124   1HB   GLU  96          2HB       GLU  96 118.566   2.792  -2.447
  125   2HB   GLU  96          1HB       GLU  96 118.120   4.485  -2.591
  126   1HG   GLU  96          2HG       GLU  96 119.505   4.449  -4.344
  127   2HG   GLU  96          1HG       GLU  96 120.759   4.636  -3.119
  128    H    LEU  97           H        LEU  97 121.760   5.163  -0.957
  129    HA   LEU  97           HA       LEU  97 123.498   3.122  -1.537
  130   1HB   LEU  97          2HB       LEU  97 123.771   5.616   0.091
  131   2HB   LEU  97          1HB       LEU  97 125.108   4.484   0.020
  132    HG   LEU  97           HG       LEU  97 123.865   5.512  -2.508
  133   1HD1  LEU  97          1HD1      LEU  97 125.894   6.905  -0.779
  134   2HD1  LEU  97          2HD1      LEU  97 124.347   7.528  -1.351
  135   3HD1  LEU  97          3HD1      LEU  97 125.665   7.260  -2.491
  136   1HD2  LEU  97          1HD2      LEU  97 125.708   3.608  -2.112
  137   2HD2  LEU  97          2HD2      LEU  97 126.760   5.022  -2.182
  138   3HD2  LEU  97          3HD2      LEU  97 125.688   4.653  -3.533
  139    H    SER  98           H        SER  98 121.845   3.742   1.461
  140    HA   SER  98           HA       SER  98 123.450   2.279   3.224
  141   1HB   SER  98          2HB       SER  98 121.046   1.901   4.335
  142   2HB   SER  98          1HB       SER  98 121.868   3.459   4.391
  143    HG   SER  98           HG       SER  98 119.581   2.726   3.071
  144    H    ASP  99           H        ASP  99 121.051   1.254   0.895
  145    HA   ASP  99           HA       ASP  99 120.817  -1.422   1.871
  146   1HB   ASP  99          2HB       ASP  99 119.257   0.007   0.265
  147   2HB   ASP  99          1HB       ASP  99 120.235  -0.761  -0.981
  148    H    LEU 100           H        LEU 100 122.856   0.212  -0.465
  149    HA   LEU 100           HA       LEU 100 123.944  -2.177  -1.600
  150   1HB   LEU 100          2HB       LEU 100 124.803   0.709  -1.672
  151   2HB   LEU 100          1HB       LEU 100 125.698  -0.563  -2.482
  152    HG   LEU 100           HG       LEU 100 122.810  -0.402  -3.109
  153   1HD1  LEU 100          1HD1      LEU 100 124.765   1.768  -3.737
  154   2HD1  LEU 100          2HD1      LEU 100 123.071   1.886  -3.257
  155   3HD1  LEU 100          3HD1      LEU 100 123.491   1.362  -4.886
  156   1HD2  LEU 100          1HD2      LEU 100 125.115  -0.570  -5.011
  157   2HD2  LEU 100          2HD2      LEU 100 123.479  -1.206  -5.183
  158   3HD2  LEU 100          3HD2      LEU 100 124.613  -1.974  -4.071
  159    H    PHE 101           H        PHE 101 124.725  -0.135   1.113
  160    HA   PHE 101           HA       PHE 101 127.385  -1.039   1.505
  161   1HB   PHE 101          2HB       PHE 101 126.601   1.046   2.495
  162   2HB   PHE 101          1HB       PHE 101 125.415   0.170   3.457
  163    HD1  PHE 101           HD1      PHE 101 128.926   1.074   3.099
  164    HD2  PHE 101           HD2      PHE 101 126.105  -1.154   5.376
  165    HE1  PHE 101           HE1      PHE 101 130.577   0.839   4.907
  166    HE2  PHE 101           HE2      PHE 101 127.750  -1.393   7.189
  167    HZ   PHE 101           HZ       PHE 101 129.990  -0.395   6.956
  168    H    ARG 102           H        ARG 102 124.266  -2.316   2.355
  169    HA   ARG 102           HA       ARG 102 125.028  -4.027   4.451
  170   1HB   ARG 102          2HB       ARG 102 122.673  -3.397   3.729
  171   2HB   ARG 102          1HB       ARG 102 122.842  -4.594   2.452
  172   1HG   ARG 102          2HG       ARG 102 122.181  -6.166   3.859
  173   2HG   ARG 102          1HG       ARG 102 123.595  -5.849   4.865
  174   1HD   ARG 102          2HD       ARG 102 122.351  -4.096   6.044
  175   2HD   ARG 102          1HD       ARG 102 120.938  -4.429   5.043
  176    HE   ARG 102           HE       ARG 102 121.888  -6.749   6.424
  177   1HH1  ARG 102          1HH1      ARG 102 119.940  -3.870   6.740
  178   2HH1  ARG 102          2HH1      ARG 102 118.956  -4.525   8.006
  179   1HH2  ARG 102          1HH2      ARG 102 120.595  -7.611   8.087
  180   2HH2  ARG 102          2HH2      ARG 102 119.327  -6.649   8.772
  181    H    MET 103           H        MET 103 124.574  -4.742   0.984
  182    HA   MET 103           HA       MET 103 125.364  -7.402   1.039
  183   1HB   MET 103          2HB       MET 103 126.026  -6.995  -1.390
  184   2HB   MET 103          1HB       MET 103 124.364  -6.637  -0.947
  185   1HG   MET 103          2HG       MET 103 124.807  -4.292  -0.908
  186   2HG   MET 103          1HG       MET 103 126.535  -4.567  -1.115
  187   1HE   MET 103          1HE       MET 103 126.981  -6.379  -3.980
  188   2HE   MET 103          2HE       MET 103 127.691  -5.180  -2.898
  189   3HE   MET 103          3HE       MET 103 127.271  -4.736  -4.552
  190    H    PHE 104           H        PHE 104 127.333  -4.490   0.644
  191    HA   PHE 104           HA       PHE 104 129.782  -5.693   0.093
  192   1HB   PHE 104          2HB       PHE 104 128.897  -3.078   1.157
  193   2HB   PHE 104          1HB       PHE 104 130.564  -3.523   1.513
  194    HD1  PHE 104           HD1      PHE 104 128.319  -2.201  -0.916
  195    HD2  PHE 104           HD2      PHE 104 132.052  -4.192  -0.447
  196    HE1  PHE 104           HE1      PHE 104 128.988  -1.471  -3.168
  197    HE2  PHE 104           HE2      PHE 104 132.726  -3.465  -2.699
  198    HZ   PHE 104           HZ       PHE 104 131.194  -2.102  -4.062
  199    H    ASP 105           H        ASP 105 128.072  -5.320   3.112
  200    HA   ASP 105           HA       ASP 105 130.323  -6.052   4.749
  201   1HB   ASP 105          2HB       ASP 105 127.711  -4.980   5.174
  202   2HB   ASP 105          1HB       ASP 105 127.873  -6.435   6.152
  203    H    LYS 106           H        LYS 106 130.536  -7.987   5.954
  204    HA   LYS 106           HA       LYS 106 129.368 -10.306   4.596
  205   1HB   LYS 106          2HB       LYS 106 131.960  -9.779   5.254
  206   2HB   LYS 106          1HB       LYS 106 131.458 -10.753   6.627
  207   1HG   LYS 106          2HG       LYS 106 132.420 -12.191   4.982
  208   2HG   LYS 106          1HG       LYS 106 130.683 -12.496   5.041
  209   1HD   LYS 106          2HD       LYS 106 130.687 -10.650   3.128
  210   2HD   LYS 106          1HD       LYS 106 132.328 -11.255   2.902
  211   1HE   LYS 106          2HE       LYS 106 131.229 -12.696   1.529
  212   2HE   LYS 106          1HE       LYS 106 131.078 -13.591   3.041
  213   1HZ   LYS 106          1HZ       LYS 106 129.043 -12.221   1.484
  214   2HZ   LYS 106          2HZ       LYS 106 128.911 -12.062   3.163
  215   3HZ   LYS 106          3HZ       LYS 106 128.918 -13.599   2.459
  216    H    ASN 107           H        ASN 107 130.133  -9.229   7.908
  217    HA   ASN 107           HA       ASN 107 128.164 -11.118   8.954
  218   1HB   ASN 107          2HB       ASN 107 129.093 -10.383  11.188
  219   2HB   ASN 107          1HB       ASN 107 130.239 -11.194  10.123
  220   1HD2  ASN 107          1HD2      ASN 107 131.823 -10.160  11.511
  221   2HD2  ASN 107          2HD2      ASN 107 132.303  -8.534  11.173
  222    H    ALA 108           H        ALA 108 128.265  -7.922   7.964
  223    HA   ALA 108           HA       ALA 108 126.816  -6.181   8.153
  224   1HB   ALA 108          1HB       ALA 108 125.190  -8.498   9.020
  225   2HB   ALA 108          2HB       ALA 108 124.909  -7.332   7.727
  226   3HB   ALA 108          3HB       ALA 108 124.566  -6.892   9.401
  227    H    ASP 109           H        ASP 109 128.790  -6.044   9.919
  228    HA   ASP 109           HA       ASP 109 127.697  -5.674  12.594
  229   1HB   ASP 109          2HB       ASP 109 130.086  -5.111  13.168
  230   2HB   ASP 109          1HB       ASP 109 129.835  -6.738  12.543
  231    H    GLY 110           H        GLY 110 128.520  -3.816   9.804
  232   1HA   GLY 110          2HA       GLY 110 127.375  -1.583   9.836
  233   2HA   GLY 110          1HA       GLY 110 128.186  -1.334  11.374
  234    H    TYR 111           H        TYR 111 130.581  -2.809  10.142
  235    HA   TYR 111           HA       TYR 111 131.538  -0.625   8.420
  236   1HB   TYR 111          2HB       TYR 111 133.099  -1.941  10.654
  237   2HB   TYR 111          1HB       TYR 111 133.724  -0.725   9.544
  238    HD1  TYR 111           HD1      TYR 111 133.813   1.442  10.319
  239    HD2  TYR 111           HD2      TYR 111 130.835  -1.165  11.882
  240    HE1  TYR 111           HE1      TYR 111 133.062   3.221  11.840
  241    HE2  TYR 111           HE2      TYR 111 130.075   0.609  13.406
  242    HH   TYR 111           HH       TYR 111 130.141   3.027  13.598
  243    H    ILE 112           H        ILE 112 133.490  -1.228   7.158
  244    HA   ILE 112           HA       ILE 112 133.601  -4.114   6.589
  245    HB   ILE 112           HB       ILE 112 133.705  -1.975   4.464
  246   1HG1  ILE 112          2HG1      ILE 112 131.412  -3.872   4.938
  247   2HG1  ILE 112          1HG1      ILE 112 131.460  -2.275   5.675
  248   1HG2  ILE 112          1HG2      ILE 112 134.051  -4.900   4.516
  249   2HG2  ILE 112          2HG2      ILE 112 134.721  -3.694   3.417
  250   3HG2  ILE 112          3HG2      ILE 112 133.066  -4.265   3.199
  251   1HD1  ILE 112          1HD1      ILE 112 131.904  -2.400   2.761
  252   2HD1  ILE 112          2HD1      ILE 112 131.024  -1.219   3.730
  253   3HD1  ILE 112          3HD1      ILE 112 130.280  -2.768   3.341
  254    H    ASP 113           H        ASP 113 135.592  -4.932   5.974
  255    HA   ASP 113           HA       ASP 113 137.854  -3.057   5.951
  256   1HB   ASP 113          2HB       ASP 113 139.161  -4.682   7.310
  257   2HB   ASP 113          1HB       ASP 113 137.798  -3.994   8.186
  258    H    LEU 114           H        LEU 114 139.936  -4.412   5.348
  259    HA   LEU 114           HA       LEU 114 139.628  -5.246   2.701
  260   1HB   LEU 114          2HB       LEU 114 141.732  -4.437   3.915
  261   2HB   LEU 114          1HB       LEU 114 141.910  -6.092   4.467
  262    HG   LEU 114           HG       LEU 114 141.620  -5.582   1.540
  263   1HD1  LEU 114          1HD1      LEU 114 143.288  -3.980   2.060
  264   2HD1  LEU 114          2HD1      LEU 114 144.126  -5.403   1.440
  265   3HD1  LEU 114          3HD1      LEU 114 144.095  -5.083   3.176
  266   1HD2  LEU 114          1HD2      LEU 114 141.630  -7.870   2.365
  267   2HD2  LEU 114          2HD2      LEU 114 143.167  -7.585   3.182
  268   3HD2  LEU 114          3HD2      LEU 114 143.083  -7.544   1.420
  269    H    GLU 115           H        GLU 115 140.039  -7.161   5.663
  270    HA   GLU 115           HA       GLU 115 140.060  -9.686   4.424
  271   1HB   GLU 115          2HB       GLU 115 140.558  -8.897   6.911
  272   2HB   GLU 115          1HB       GLU 115 138.882  -9.374   7.146
  273   1HG   GLU 115          2HG       GLU 115 140.202 -11.238   7.721
  274   2HG   GLU 115          1HG       GLU 115 139.484 -11.599   6.152
  275    H    GLU 116           H        GLU 116 137.395  -7.959   6.045
  276    HA   GLU 116           HA       GLU 116 135.407  -9.851   5.446
  277   1HB   GLU 116          2HB       GLU 116 135.490  -7.635   6.984
  278   2HB   GLU 116          1HB       GLU 116 134.594  -7.008   5.608
  279   1HG   GLU 116          2HG       GLU 116 132.743  -8.106   6.170
  280   2HG   GLU 116          1HG       GLU 116 133.622  -9.597   6.508
  281    H    LEU 117           H        LEU 117 136.744  -7.204   3.604
  282    HA   LEU 117           HA       LEU 117 134.676  -7.234   1.605
  283   1HB   LEU 117          2HB       LEU 117 136.121  -5.245   2.238
  284   2HB   LEU 117          1HB       LEU 117 137.422  -6.022   1.355
  285    HG   LEU 117           HG       LEU 117 135.935  -5.992  -0.680
  286   1HD1  LEU 117          1HD1      LEU 117 134.004  -4.616  -0.725
  287   2HD1  LEU 117          2HD1      LEU 117 134.308  -4.020   0.907
  288   3HD1  LEU 117          3HD1      LEU 117 133.827  -5.698   0.657
  289   1HD2  LEU 117          1HD2      LEU 117 136.551  -3.808  -1.271
  290   2HD2  LEU 117          2HD2      LEU 117 137.752  -4.306  -0.081
  291   3HD2  LEU 117          3HD2      LEU 117 136.435  -3.233   0.391
  292    H    LYS 118           H        LYS 118 137.777  -8.762   2.082
  293    HA   LYS 118           HA       LYS 118 138.187  -9.599  -0.597
  294   1HB   LYS 118          2HB       LYS 118 139.551  -9.817   1.884
  295   2HB   LYS 118          1HB       LYS 118 139.376 -11.443   1.242
  296   1HG   LYS 118          2HG       LYS 118 140.176  -9.838  -0.916
  297   2HG   LYS 118          1HG       LYS 118 141.179  -9.363   0.455
  298   1HD   LYS 118          2HD       LYS 118 140.783 -12.266   0.024
  299   2HD   LYS 118          1HD       LYS 118 141.789 -11.415  -1.151
  300   1HE   LYS 118          2HE       LYS 118 143.384 -10.857   0.422
  301   2HE   LYS 118          1HE       LYS 118 142.254 -10.992   1.768
  302   1HZ   LYS 118          1HZ       LYS 118 142.268 -13.499   0.914
  303   2HZ   LYS 118          2HZ       LYS 118 143.355 -12.920   2.074
  304   3HZ   LYS 118          3HZ       LYS 118 143.835 -13.052   0.457
  305    H    ILE 119           H        ILE 119 136.379 -10.899   2.092
  306    HA   ILE 119           HA       ILE 119 136.035 -13.524   1.080
  307    HB   ILE 119           HB       ILE 119 134.168 -12.033   2.926
  308   1HG1  ILE 119          2HG1      ILE 119 136.252 -13.906   3.946
  309   2HG1  ILE 119          1HG1      ILE 119 136.768 -12.293   3.465
  310   1HG2  ILE 119          1HG2      ILE 119 134.691 -14.992   2.725
  311   2HG2  ILE 119          2HG2      ILE 119 133.364 -14.174   1.902
  312   3HG2  ILE 119          3HG2      ILE 119 133.440 -14.180   3.665
  313   1HD1  ILE 119          1HD1      ILE 119 134.662 -11.651   4.987
  314   2HD1  ILE 119          2HD1      ILE 119 136.299 -11.836   5.616
  315   3HD1  ILE 119          3HD1      ILE 119 135.142 -13.160   5.760
  316    H    MET 120           H        MET 120 133.969 -10.629   0.961
  317    HA   MET 120           HA       MET 120 131.837 -11.770  -0.444
  318   1HB   MET 120          2HB       MET 120 131.204  -9.477  -1.018
  319   2HB   MET 120          1HB       MET 120 131.686  -9.595   0.669
  320   1HG   MET 120          2HG       MET 120 133.558  -8.338   0.370
  321   2HG   MET 120          1HG       MET 120 133.756  -8.829  -1.311
  322   1HE   MET 120          1HE       MET 120 131.099  -6.942  -3.175
  323   2HE   MET 120          2HE       MET 120 132.129  -8.367  -3.034
  324   3HE   MET 120          3HE       MET 120 132.842  -6.797  -3.403
  325    H    LEU 121           H        LEU 121 134.937 -10.610  -1.529
  326    HA   LEU 121           HA       LEU 121 134.265 -10.422  -4.294
  327   1HB   LEU 121          2HB       LEU 121 136.660 -10.149  -2.636
  328   2HB   LEU 121          1HB       LEU 121 136.985 -10.841  -4.215
  329    HG   LEU 121           HG       LEU 121 137.259  -8.375  -4.129
  330   1HD1  LEU 121          1HD1      LEU 121 136.537  -9.761  -6.178
  331   2HD1  LEU 121          2HD1      LEU 121 136.372  -8.005  -6.241
  332   3HD1  LEU 121          3HD1      LEU 121 134.959  -9.014  -5.933
  333   1HD2  LEU 121          1HD2      LEU 121 135.360  -6.933  -3.926
  334   2HD2  LEU 121          2HD2      LEU 121 135.398  -7.988  -2.515
  335   3HD2  LEU 121          3HD2      LEU 121 134.261  -8.309  -3.823
  336    H    GLN 122           H        GLN 122 135.340 -12.986  -2.191
  337    HA   GLN 122           HA       GLN 122 136.316 -14.806  -4.065
  338   1HB   GLN 122          2HB       GLN 122 134.866 -15.286  -1.458
  339   2HB   GLN 122          1HB       GLN 122 135.665 -16.551  -2.384
  340   1HG   GLN 122          2HG       GLN 122 137.791 -15.277  -2.162
  341   2HG   GLN 122          1HG       GLN 122 136.950 -14.159  -1.089
  342   1HE2  GLN 122          1HE2      GLN 122 138.073 -17.445  -1.493
  343   2HE2  GLN 122          2HE2      GLN 122 138.044 -17.867   0.183
  344    H    ALA 123           H        ALA 123 133.045 -13.932  -3.223
  345    HA   ALA 123           HA       ALA 123 131.666 -16.121  -4.281
  346   1HB   ALA 123          1HB       ALA 123 130.531 -13.376  -4.533
  347   2HB   ALA 123          2HB       ALA 123 130.845 -14.034  -2.928
  348   3HB   ALA 123          3HB       ALA 123 129.752 -14.875  -4.028
  349    H    THR 124           H        THR 124 133.102 -13.335  -5.839
  350    HA   THR 124           HA       THR 124 131.813 -13.579  -8.339
  351    HB   THR 124           HB       THR 124 133.497 -12.088  -9.181
  352    HG1  THR 124           HG1      THR 124 135.385 -11.675  -8.010
  353   1HG2  THR 124          1HG2      THR 124 132.770 -10.363  -8.012
  354   2HG2  THR 124          2HG2      THR 124 133.685 -10.876  -6.594
  355   3HG2  THR 124          3HG2      THR 124 132.058 -11.498  -6.866
  356    H    GLY 125           H        GLY 125 132.962 -14.149 -10.391
  357   1HA   GLY 125          2HA       GLY 125 134.017 -16.821 -10.148
  358   2HA   GLY 125          1HA       GLY 125 133.680 -15.964 -11.644
  359    H    GLU 126           H        GLU 126 135.254 -13.705 -11.313
  360    HA   GLU 126           HA       GLU 126 137.808 -14.726 -12.034
  361   1HB   GLU 126          2HB       GLU 126 138.465 -12.389 -12.268
  362   2HB   GLU 126          1HB       GLU 126 136.895 -12.668 -13.010
  363   1HG   GLU 126          2HG       GLU 126 135.826 -11.770 -10.966
  364   2HG   GLU 126          1HG       GLU 126 137.430 -11.381 -10.346
  365    H    THR 127           H        THR 127 139.827 -14.349 -11.000
  366    HA   THR 127           HA       THR 127 139.604 -14.354  -8.082
  367    HB   THR 127           HB       THR 127 141.975 -15.180  -8.178
  368    HG1  THR 127           HG1      THR 127 142.428 -14.311 -10.276
  369   1HG2  THR 127          1HG2      THR 127 140.747 -17.129  -9.928
  370   2HG2  THR 127          2HG2      THR 127 139.667 -16.611  -8.634
  371   3HG2  THR 127          3HG2      THR 127 141.255 -17.274  -8.246
  372    H    ILE 128           H        ILE 128 139.622 -12.314  -7.329
  373    HA   ILE 128           HA       ILE 128 141.357 -10.305  -8.496
  374    HB   ILE 128           HB       ILE 128 139.619 -10.030  -6.047
  375   1HG1  ILE 128          2HG1      ILE 128 138.231 -10.763  -7.910
  376   2HG1  ILE 128          1HG1      ILE 128 137.924  -9.064  -7.570
  377   1HG2  ILE 128          1HG2      ILE 128 140.809  -8.118  -5.970
  378   2HG2  ILE 128          2HG2      ILE 128 139.668  -7.604  -7.213
  379   3HG2  ILE 128          3HG2      ILE 128 141.262  -8.207  -7.672
  380   1HD1  ILE 128          1HD1      ILE 128 139.276 -10.316  -9.904
  381   2HD1  ILE 128          2HD1      ILE 128 139.707  -8.673  -9.433
  382   3HD1  ILE 128          3HD1      ILE 128 138.040  -9.061  -9.855
  383    H    THR 129           H        THR 129 143.046  -9.258  -7.436
  384    HA   THR 129           HA       THR 129 144.341 -10.866  -5.374
  385    HB   THR 129           HB       THR 129 146.287  -9.297  -5.837
  386    HG1  THR 129           HG1      THR 129 146.129  -8.080  -7.737
  387   1HG2  THR 129          1HG2      THR 129 146.829 -11.111  -7.010
  388   2HG2  THR 129          2HG2      THR 129 146.300 -10.178  -8.410
  389   3HG2  THR 129          3HG2      THR 129 145.195 -11.314  -7.638
  390    H    GLU 130           H        GLU 130 145.535  -9.648  -3.633
  391    HA   GLU 130           HA       GLU 130 143.681  -8.109  -2.137
  392   1HB   GLU 130          2HB       GLU 130 145.845  -9.610  -1.492
  393   2HB   GLU 130          1HB       GLU 130 146.528  -7.997  -1.349
  394   1HG   GLU 130          2HG       GLU 130 144.949  -7.377   0.304
  395   2HG   GLU 130          1HG       GLU 130 143.981  -8.820   0.012
  396    H    ASP 131           H        ASP 131 146.367  -7.307  -4.220
  397    HA   ASP 131           HA       ASP 131 146.741  -4.636  -3.397
  398   1HB   ASP 131          2HB       ASP 131 148.051  -6.283  -5.101
  399   2HB   ASP 131          1HB       ASP 131 147.196  -5.261  -6.253
  400    H    ASP 132           H        ASP 132 144.564  -6.132  -5.719
  401    HA   ASP 132           HA       ASP 132 143.634  -3.717  -6.885
  402   1HB   ASP 132          2HB       ASP 132 142.807  -6.570  -6.913
  403   2HB   ASP 132          1HB       ASP 132 141.579  -5.383  -7.345
  404    H    ILE 133           H        ILE 133 142.530  -5.703  -4.184
  405    HA   ILE 133           HA       ILE 133 140.150  -4.187  -3.725
  406    HB   ILE 133           HB       ILE 133 141.572  -5.973  -1.752
  407   1HG1  ILE 133          2HG1      ILE 133 141.196  -7.159  -3.881
  408   2HG1  ILE 133          1HG1      ILE 133 140.176  -7.797  -2.595
  409   1HG2  ILE 133          1HG2      ILE 133 138.998  -6.303  -1.203
  410   2HG2  ILE 133          2HG2      ILE 133 138.906  -4.682  -1.891
  411   3HG2  ILE 133          3HG2      ILE 133 139.945  -4.994  -0.500
  412   1HD1  ILE 133          1HD1      ILE 133 138.257  -6.714  -3.476
  413   2HD1  ILE 133          2HD1      ILE 133 139.063  -7.536  -4.812
  414   3HD1  ILE 133          3HD1      ILE 133 139.230  -5.791  -4.621
  415    H    GLU 134           H        GLU 134 143.461  -3.989  -2.648
  416    HA   GLU 134           HA       GLU 134 143.143  -2.411  -0.363
  417   1HB   GLU 134          2HB       GLU 134 145.314  -3.177  -2.137
  418   2HB   GLU 134          1HB       GLU 134 145.511  -1.534  -1.541
  419   1HG   GLU 134          2HG       GLU 134 144.986  -2.616   0.772
  420   2HG   GLU 134          1HG       GLU 134 145.471  -4.105  -0.038
  421    H    GLU 135           H        GLU 135 143.053  -1.586  -3.755
  422    HA   GLU 135           HA       GLU 135 143.315   1.228  -3.421
  423   1HB   GLU 135          2HB       GLU 135 142.457  -0.577  -5.644
  424   2HB   GLU 135          1HB       GLU 135 142.126   1.144  -5.770
  425   1HG   GLU 135          2HG       GLU 135 144.546   1.573  -5.403
  426   2HG   GLU 135          1HG       GLU 135 144.815  -0.167  -5.461
  427    H    LEU 136           H        LEU 136 140.622  -1.009  -3.397
  428    HA   LEU 136           HA       LEU 136 138.554   0.913  -3.620
  429   1HB   LEU 136          2HB       LEU 136 138.677  -1.821  -3.606
  430   2HB   LEU 136          1HB       LEU 136 137.948  -1.492  -2.046
  431    HG   LEU 136           HG       LEU 136 136.863  -0.354  -4.615
  432   1HD1  LEU 136          1HD1      LEU 136 136.923  -2.883  -4.557
  433   2HD1  LEU 136          2HD1      LEU 136 135.336  -2.142  -4.768
  434   3HD1  LEU 136          3HD1      LEU 136 135.810  -2.782  -3.194
  435   1HD2  LEU 136          1HD2      LEU 136 136.126   0.850  -2.692
  436   2HD2  LEU 136          2HD2      LEU 136 135.775  -0.643  -1.822
  437   3HD2  LEU 136          3HD2      LEU 136 134.798  -0.186  -3.217
  438    H    MET 137           H        MET 137 140.416  -0.321  -0.928
  439    HA   MET 137           HA       MET 137 138.724   0.998   1.029
  440   1HB   MET 137          2HB       MET 137 140.076  -1.265   1.243
  441   2HB   MET 137          1HB       MET 137 141.374  -0.183   1.731
  442   1HG   MET 137          2HG       MET 137 140.541  -0.061   3.770
  443   2HG   MET 137          1HG       MET 137 139.018   0.558   3.134
  444   1HE   MET 137          1HE       MET 137 136.594  -2.110   3.141
  445   2HE   MET 137          2HE       MET 137 137.088  -0.450   2.813
  446   3HE   MET 137          3HE       MET 137 136.867  -0.991   4.476
  447    H    LYS 138           H        LYS 138 141.786   1.477  -0.586
  448    HA   LYS 138           HA       LYS 138 142.883   3.439   1.087
  449   1HB   LYS 138          2HB       LYS 138 143.843   2.162  -1.018
  450   2HB   LYS 138          1HB       LYS 138 143.280   3.592  -1.871
  451   1HG   LYS 138          2HG       LYS 138 144.606   4.910  -0.106
  452   2HG   LYS 138          1HG       LYS 138 145.394   3.369   0.233
  453   1HD   LYS 138          2HD       LYS 138 146.409   3.282  -1.833
  454   2HD   LYS 138          1HD       LYS 138 145.194   4.312  -2.591
  455   1HE   LYS 138          2HE       LYS 138 146.083   6.255  -1.466
  456   2HE   LYS 138          1HE       LYS 138 147.225   5.254  -0.571
  457   1HZ   LYS 138          1HZ       LYS 138 148.069   4.580  -2.869
  458   2HZ   LYS 138          2HZ       LYS 138 148.469   6.125  -2.309
  459   3HZ   LYS 138          3HZ       LYS 138 147.230   5.934  -3.444
  460    H    ASP 139           H        ASP 139 140.835   3.769  -1.802
  461    HA   ASP 139           HA       ASP 139 140.630   6.628  -1.429
  462   1HB   ASP 139          2HB       ASP 139 139.417   6.663  -3.483
  463   2HB   ASP 139          1HB       ASP 139 140.734   5.514  -3.687
  464    H    GLY 140           H        GLY 140 138.945   3.856  -0.361
  465   1HA   GLY 140          2HA       GLY 140 136.381   5.145  -0.054
  466   2HA   GLY 140          1HA       GLY 140 136.833   3.559   0.552
  467    H    ASP 141           H        ASP 141 139.242   4.719   1.884
  468    HA   ASP 141           HA       ASP 141 137.878   5.538   4.320
  469   1HB   ASP 141          2HB       ASP 141 139.787   3.786   4.132
  470   2HB   ASP 141          1HB       ASP 141 140.852   5.188   4.057
  471    H    LYS 142           H        LYS 142 137.758   7.569   5.013
  472    HA   LYS 142           HA       LYS 142 139.489   9.579   3.734
  473   1HB   LYS 142          2HB       LYS 142 136.755   9.974   4.965
  474   2HB   LYS 142          1HB       LYS 142 137.718  11.210   4.166
  475   1HG   LYS 142          2HG       LYS 142 136.661   8.728   2.829
  476   2HG   LYS 142          1HG       LYS 142 135.903  10.319   2.755
  477   1HD   LYS 142          2HD       LYS 142 138.736  10.354   2.052
  478   2HD   LYS 142          1HD       LYS 142 137.765   9.341   0.982
  479   1HE   LYS 142          2HE       LYS 142 137.813  11.545   0.061
  480   2HE   LYS 142          1HE       LYS 142 136.197  11.263   0.708
  481   1HZ   LYS 142          1HZ       LYS 142 138.107  12.491   2.523
  482   2HZ   LYS 142          2HZ       LYS 142 136.464  12.820   2.296
  483   3HZ   LYS 142          3HZ       LYS 142 137.608  13.447   1.219
  484    H    ASN 143           H        ASN 143 138.190   8.390   6.762
  485    HA   ASN 143           HA       ASN 143 139.524  10.458   8.304
  486   1HB   ASN 143          2HB       ASN 143 138.576   9.213  10.264
  487   2HB   ASN 143          1HB       ASN 143 137.370   9.776   9.113
  488   1HD2  ASN 143          1HD2      ASN 143 136.009   8.167  10.111
  489   2HD2  ASN 143          2HD2      ASN 143 136.110   6.524   9.588
  490    H    ASN 144           H        ASN 144 140.353   7.470   6.977
  491    HA   ASN 144           HA       ASN 144 142.207   6.167   7.145
  492   1HB   ASN 144          2HB       ASN 144 143.281   8.497   7.403
  493   2HB   ASN 144          1HB       ASN 144 143.368   8.121   9.120
  494   1HD2  ASN 144          1HD2      ASN 144 144.065   6.531   6.022
  495   2HD2  ASN 144          2HD2      ASN 144 145.593   5.888   6.503
  496    H    ASP 145           H        ASP 145 140.319   5.067   8.454
  497    HA   ASP 145           HA       ASP 145 141.268   4.533  11.188
  498   1HB   ASP 145          2HB       ASP 145 138.996   3.719  11.660
  499   2HB   ASP 145          1HB       ASP 145 138.973   5.384  11.084
  500    H    GLY 146           H        GLY 146 140.538   3.119   8.091
  501   1HA   GLY 146          2HA       GLY 146 141.847   1.114   7.531
  502   2HA   GLY 146          1HA       GLY 146 141.458   0.513   9.136
  503    H    ARG 147           H        ARG 147 138.660   1.600   8.804
  504    HA   ARG 147           HA       ARG 147 137.648  -0.402   6.899
  505   1HB   ARG 147          2HB       ARG 147 135.700  -0.618   8.600
  506   2HB   ARG 147          1HB       ARG 147 137.206  -1.471   8.916
  507   1HG   ARG 147          2HG       ARG 147 137.892   0.296  10.452
  508   2HG   ARG 147          1HG       ARG 147 136.390   1.163  10.127
  509   1HD   ARG 147          2HD       ARG 147 136.247  -0.088  12.216
  510   2HD   ARG 147          1HD       ARG 147 135.106  -0.708  11.024
  511    HE   ARG 147           HE       ARG 147 137.366  -2.246  10.744
  512   1HH1  ARG 147          1HH1      ARG 147 135.136  -1.512  13.327
  513   2HH1  ARG 147          2HH1      ARG 147 135.346  -3.043  14.111
  514   1HH2  ARG 147          1HH2      ARG 147 137.644  -4.258  11.774
  515   2HH2  ARG 147          2HH2      ARG 147 136.771  -4.601  13.230
  516    H    ILE 148           H        ILE 148 135.288  -0.019   6.375
  517    HA   ILE 148           HA       ILE 148 134.778   2.881   6.189
  518    HB   ILE 148           HB       ILE 148 133.879   0.795   4.200
  519   1HG1  ILE 148          2HG1      ILE 148 136.189   2.741   3.995
  520   2HG1  ILE 148          1HG1      ILE 148 136.344   1.002   4.227
  521   1HG2  ILE 148          1HG2      ILE 148 133.967   3.799   3.961
  522   2HG2  ILE 148          2HG2      ILE 148 132.527   2.874   4.389
  523   3HG2  ILE 148          3HG2      ILE 148 133.279   2.655   2.808
  524   1HD1  ILE 148          1HD1      ILE 148 136.721   1.349   1.952
  525   2HD1  ILE 148          2HD1      ILE 148 135.381   2.489   1.813
  526   3HD1  ILE 148          3HD1      ILE 148 135.058   0.770   2.043
  527    H    ASP 149           H        ASP 149 132.672   3.615   6.451
  528    HA   ASP 149           HA       ASP 149 130.664   1.637   7.279
  529   1HB   ASP 149          2HB       ASP 149 130.004   3.053   9.169
  530   2HB   ASP 149          1HB       ASP 149 131.686   2.554   9.317
  531    H    TYR 150           H        TYR 150 128.552   3.175   7.828
  532    HA   TYR 150           HA       TYR 150 127.562   3.917   5.329
  533   1HB   TYR 150          2HB       TYR 150 126.199   3.314   7.349
  534   2HB   TYR 150          1HB       TYR 150 126.548   4.913   7.998
  535    HD1  TYR 150           HD1      TYR 150 125.561   3.719   4.595
  536    HD2  TYR 150           HD2      TYR 150 124.642   6.211   7.918
  537    HE1  TYR 150           HE1      TYR 150 123.632   4.630   3.371
  538    HE2  TYR 150           HE2      TYR 150 122.711   7.129   6.704
  539    HH   TYR 150           HH       TYR 150 121.211   6.468   4.863
  540    H    ASP 151           H        ASP 151 128.871   5.922   7.945
  541    HA   ASP 151           HA       ASP 151 128.350   8.427   6.817
  542   1HB   ASP 151          2HB       ASP 151 130.712   7.677   8.552
  543   2HB   ASP 151          1HB       ASP 151 130.049   9.293   8.325
  544    H    GLU 152           H        GLU 152 131.253   6.386   6.567
  545    HA   GLU 152           HA       GLU 152 132.635   8.167   4.834
  546   1HB   GLU 152          2HB       GLU 152 133.051   5.214   5.335
  547   2HB   GLU 152          1HB       GLU 152 134.171   6.258   4.470
  548   1HG   GLU 152          2HG       GLU 152 134.223   7.661   6.604
  549   2HG   GLU 152          1HG       GLU 152 133.465   6.272   7.380
  550    H    PHE 153           H        PHE 153 130.620   5.311   4.314
  551    HA   PHE 153           HA       PHE 153 131.068   4.995   1.569
  552   1HB   PHE 153          2HB       PHE 153 129.742   3.531   3.320
  553   2HB   PHE 153          1HB       PHE 153 128.363   4.446   2.719
  554    HD1  PHE 153           HD1      PHE 153 131.332   2.688   1.285
  555    HD2  PHE 153           HD2      PHE 153 127.147   3.424   1.078
  556    HE1  PHE 153           HE1      PHE 153 131.163   1.158  -0.635
  557    HE2  PHE 153           HE2      PHE 153 126.968   1.896  -0.842
  558    HZ   PHE 153           HZ       PHE 153 128.979   0.760  -1.702
  559    H    LEU 154           H        LEU 154 128.735   6.992   3.319
  560    HA   LEU 154           HA       LEU 154 127.317   7.891   1.044
  561   1HB   LEU 154          2HB       LEU 154 127.215   8.276   3.848
  562   2HB   LEU 154          1HB       LEU 154 127.309   9.867   3.119
  563    HG   LEU 154           HG       LEU 154 124.989   9.155   3.499
  564   1HD1  LEU 154          1HD1      LEU 154 125.187  10.716   1.777
  565   2HD1  LEU 154          2HD1      LEU 154 124.230   9.418   1.066
  566   3HD1  LEU 154          3HD1      LEU 154 125.947   9.557   0.687
  567   1HD2  LEU 154          1HD2      LEU 154 125.600   6.693   3.051
  568   2HD2  LEU 154          2HD2      LEU 154 125.336   7.094   1.354
  569   3HD2  LEU 154          3HD2      LEU 154 124.025   7.280   2.519
  570    H    GLU 155           H        GLU 155 130.161   9.089   2.739
  571    HA   GLU 155           HA       GLU 155 130.319  11.506   1.190
  572   1HB   GLU 155          2HB       GLU 155 132.343  10.188   3.009
  573   2HB   GLU 155          1HB       GLU 155 132.510  11.793   2.311
  574   1HG   GLU 155          2HG       GLU 155 130.079  11.187   3.908
  575   2HG   GLU 155          1HG       GLU 155 131.608  11.441   4.750
  576    H    PHE 156           H        PHE 156 131.816   8.321   1.119
  577    HA   PHE 156           HA       PHE 156 133.792   8.886  -0.814
  578   1HB   PHE 156          2HB       PHE 156 133.876   6.887   0.596
  579   2HB   PHE 156          1HB       PHE 156 132.416   6.269  -0.171
  580    HD1  PHE 156           HD1      PHE 156 132.758   4.590  -1.679
  581    HD2  PHE 156           HD2      PHE 156 135.723   7.616  -1.278
  582    HE1  PHE 156           HE1      PHE 156 134.129   3.467  -3.385
  583    HE2  PHE 156           HE2      PHE 156 137.098   6.498  -2.986
  584    HZ   PHE 156           HZ       PHE 156 136.299   4.421  -4.042
  585    H    MET 157           H        MET 157 130.520   7.529  -1.116
  586    HA   MET 157           HA       MET 157 130.609   7.263  -3.936
  587   1HB   MET 157          2HB       MET 157 128.826   6.582  -1.885
  588   2HB   MET 157          1HB       MET 157 127.928   7.683  -2.922
  589   1HG   MET 157          2HG       MET 157 127.441   5.756  -3.986
  590   2HG   MET 157          1HG       MET 157 128.958   6.120  -4.807
  591   1HE   MET 157          1HE       MET 157 129.150   4.097  -5.666
  592   2HE   MET 157          2HE       MET 157 129.129   2.520  -4.879
  593   3HE   MET 157          3HE       MET 157 130.633   3.435  -4.979
  594    H    LYS 158           H        LYS 158 129.511   9.822  -1.773
  595    HA   LYS 158           HA       LYS 158 128.422  11.452  -3.854
  596   1HB   LYS 158          2HB       LYS 158 127.857  11.490  -1.342
  597   2HB   LYS 158          1HB       LYS 158 129.315  12.457  -1.163
  598   1HG   LYS 158          2HG       LYS 158 128.188  13.880  -3.076
  599   2HG   LYS 158          1HG       LYS 158 126.720  13.146  -2.428
  600   1HD   LYS 158          2HD       LYS 158 127.530  13.919  -0.143
  601   2HD   LYS 158          1HD       LYS 158 128.714  14.898  -1.012
  602   1HE   LYS 158          2HE       LYS 158 127.095  16.459  -0.954
  603   2HE   LYS 158          1HE       LYS 158 126.454  15.566  -2.332
  604   1HZ   LYS 158          1HZ       LYS 158 125.032  16.118  -0.162
  605   2HZ   LYS 158          2HZ       LYS 158 125.650  14.611   0.291
  606   3HZ   LYS 158          3HZ       LYS 158 124.747  14.760  -1.132
  607    H    GLY 159           H        GLY 159 130.538  11.033  -5.121
  608   1HA   GLY 159          2HA       GLY 159 131.992  12.570  -6.250
  609   2HA   GLY 159          1HA       GLY 159 132.237  13.403  -4.722
  610    H    VAL 160           H        VAL 160 133.164  10.705  -6.709
  611    HA   VAL 160           HA       VAL 160 135.131   9.808  -4.743
  612    HB   VAL 160           HB       VAL 160 134.661   8.630  -7.478
  613   1HG1  VAL 160          1HG1      VAL 160 136.214   7.888  -5.072
  614   2HG1  VAL 160          2HG1      VAL 160 136.562   7.613  -6.780
  615   3HG1  VAL 160          3HG1      VAL 160 135.405   6.581  -5.938
  616   1HG2  VAL 160          1HG2      VAL 160 132.567   8.744  -6.065
  617   2HG2  VAL 160          2HG2      VAL 160 133.382   7.666  -4.931
  618   3HG2  VAL 160          3HG2      VAL 160 133.063   7.132  -6.582
  619    H    GLU 161           H        GLU 161 135.638  12.353  -5.692
  620    HA   GLU 161           HA       GLU 161 137.848  11.976  -7.597
  621   1HB   GLU 161          2HB       GLU 161 136.475  14.553  -6.812
  622   2HB   GLU 161          1HB       GLU 161 137.688  14.355  -8.070
  623   1HG   GLU 161          2HG       GLU 161 135.792  12.559  -8.840
  624   2HG   GLU 161          1HG       GLU 161 134.814  13.838  -8.124
  Start of MODEL   11
    1   1H    MET  81          1HT       MET  81  89.933  11.437  -4.054
    2   2H    MET  81          2HT       MET  81  89.975  10.967  -2.405
    3   3H    MET  81          3HT       MET  81  88.505  10.877  -3.287
    4    HA   MET  81           HA       MET  81  89.738   8.757  -2.885
    5   1HB   MET  81          2HB       MET  81  88.819   9.783  -5.562
    6   2HB   MET  81          1HB       MET  81  89.309   8.108  -5.345
    7   1HG   MET  81          2HG       MET  81  87.526   7.632  -3.944
    8   2HG   MET  81          1HG       MET  81  87.247   9.330  -3.560
    9   1HE   MET  81          1HE       MET  81  84.292   7.895  -4.600
   10   2HE   MET  81          2HE       MET  81  85.640   6.770  -4.434
   11   3HE   MET  81          3HE       MET  81  84.777   6.893  -5.967
   12    H    VAL  82           H        VAL  82  91.867  10.777  -3.002
   13    HA   VAL  82           HA       VAL  82  93.864   9.127  -4.316
   14    HB   VAL  82           HB       VAL  82  93.709  12.069  -4.976
   15   1HG1  VAL  82          1HG1      VAL  82  95.546   9.830  -5.734
   16   2HG1  VAL  82          2HG1      VAL  82  95.938  11.452  -5.160
   17   3HG1  VAL  82          3HG1      VAL  82  95.333  11.219  -6.800
   18   1HG2  VAL  82          1HG2      VAL  82  92.817   9.671  -6.563
   19   2HG2  VAL  82          2HG2      VAL  82  93.136  11.248  -7.286
   20   3HG2  VAL  82          3HG2      VAL  82  91.859  11.072  -6.082
   21    H    ARG  83           H        ARG  83  93.386  12.281  -2.721
   22    HA   ARG  83           HA       ARG  83  94.471  13.296  -0.998
   23   1HB   ARG  83          2HB       ARG  83  94.012  10.736  -0.170
   24   2HB   ARG  83          1HB       ARG  83  95.755  10.855   0.031
   25   1HG   ARG  83          2HG       ARG  83  95.063  11.574   2.077
   26   2HG   ARG  83          1HG       ARG  83  95.132  13.115   1.219
   27   1HD   ARG  83          2HD       ARG  83  92.811  13.213   0.969
   28   2HD   ARG  83          1HD       ARG  83  92.613  11.492   1.300
   29    HE   ARG  83           HE       ARG  83  93.621  12.442   3.617
   30   1HH1  ARG  83          1HH1      ARG  83  90.934  13.424   1.616
   31   2HH1  ARG  83          2HH1      ARG  83  90.006  14.032   2.946
   32   1HH2  ARG  83          1HH2      ARG  83  92.401  13.243   5.365
   33   2HH2  ARG  83          2HH2      ARG  83  90.837  13.930   5.073
   34    H    CYS  84           H        CYS  84  96.865  12.925   0.252
   35    HA   CYS  84           HA       CYS  84  98.713  13.632  -1.847
   36   1HB   CYS  84          2HB       CYS  84  98.584  14.816   0.371
   37   2HB   CYS  84          1HB       CYS  84  99.272  13.374   1.112
   38    HG   CYS  84           HG       CYS  84 100.812  15.501  -0.390
   39    H    MET  85           H        MET  85 100.053  12.283  -2.835
   40    HA   MET  85           HA       MET  85 101.059   9.938  -1.408
   41   1HB   MET  85          2HB       MET  85 100.625   8.498  -3.373
   42   2HB   MET  85          1HB       MET  85  99.148   9.091  -2.627
   43   1HG   MET  85          2HG       MET  85  98.484   9.911  -4.566
   44   2HG   MET  85          1HG       MET  85  99.910  10.945  -4.628
   45   1HE   MET  85          1HE       MET  85  98.807   7.513  -7.204
   46   2HE   MET  85          2HE       MET  85  97.927   8.244  -5.861
   47   3HE   MET  85          3HE       MET  85  99.051   6.917  -5.562
   48    H    LYS  86           H        LYS  86 103.185  10.251  -1.427
   49    HA   LYS  86           HA       LYS  86 104.678  10.224  -3.823
   50   1HB   LYS  86          2HB       LYS  86 103.734  12.689  -3.500
   51   2HB   LYS  86          1HB       LYS  86 105.117  12.818  -2.423
   52   1HG   LYS  86          2HG       LYS  86 105.452  11.785  -5.209
   53   2HG   LYS  86          1HG       LYS  86 105.376  13.518  -4.889
   54   1HD   LYS  86          2HD       LYS  86 107.427  13.560  -3.963
   55   2HD   LYS  86          1HD       LYS  86 107.188  12.025  -3.125
   56   1HE   LYS  86          2HE       LYS  86 107.631  12.166  -6.092
   57   2HE   LYS  86          1HE       LYS  86 108.974  12.111  -4.952
   58   1HZ   LYS  86          1HZ       LYS  86 106.917  10.102  -4.568
   59   2HZ   LYS  86          2HZ       LYS  86 108.601   9.960  -4.483
   60   3HZ   LYS  86          3HZ       LYS  86 107.826   9.946  -5.987
   61    H    ASP  87           H        ASP  87 104.633  11.152  -0.413
   62    HA   ASP  87           HA       ASP  87 107.397  10.238  -0.113
   63   1HB   ASP  87          2HB       ASP  87 107.229  11.214   2.165
   64   2HB   ASP  87          1HB       ASP  87 106.904  12.389   0.894
   65    H    ASP  88           H        ASP  88 105.389   8.295  -0.651
   66    HA   ASP  88           HA       ASP  88 105.147   6.907   1.930
   67   1HB   ASP  88          2HB       ASP  88 103.250   7.355  -0.056
   68   2HB   ASP  88          1HB       ASP  88 103.722   5.674  -0.290
   69    H    SER  89           H        SER  89 106.091   6.446  -1.453
   70    HA   SER  89           HA       SER  89 107.327   3.885  -0.768
   71   1HB   SER  89          2HB       SER  89 106.170   5.035  -3.176
   72   2HB   SER  89          1HB       SER  89 107.768   4.358  -3.483
   73    HG   SER  89           HG       SER  89 106.128   2.788  -3.718
   74    H    LYS  90           H        LYS  90 109.468   3.618  -0.586
   75    HA   LYS  90           HA       LYS  90 111.174   5.915  -0.589
   76   1HB   LYS  90          2HB       LYS  90 111.350   3.105   0.240
   77   2HB   LYS  90          1HB       LYS  90 112.861   3.758  -0.375
   78   1HG   LYS  90          2HG       LYS  90 113.173   5.070   1.412
   79   2HG   LYS  90          1HG       LYS  90 111.465   5.497   1.526
   80   1HD   LYS  90          2HD       LYS  90 111.146   3.077   2.363
   81   2HD   LYS  90          1HD       LYS  90 112.890   3.102   2.633
   82   1HE   LYS  90          2HE       LYS  90 111.521   5.463   3.667
   83   2HE   LYS  90          1HE       LYS  90 110.972   3.959   4.406
   84   1HZ   LYS  90          1HZ       LYS  90 113.456   3.479   4.680
   85   2HZ   LYS  90          2HZ       LYS  90 112.751   4.612   5.719
   86   3HZ   LYS  90          3HZ       LYS  90 113.681   5.134   4.405
   87    H    GLY  91           H        GLY  91 112.238   6.733  -2.259
   88   1HA   GLY  91          2HA       GLY  91 112.380   5.222  -4.746
   89   2HA   GLY  91          1HA       GLY  91 112.767   6.923  -4.534
   90    H    LYS  92           H        LYS  92 114.657   6.483  -5.832
   91    HA   LYS  92           HA       LYS  92 116.739   4.902  -4.515
   92   1HB   LYS  92          2HB       LYS  92 116.344   5.939  -7.296
   93   2HB   LYS  92          1HB       LYS  92 117.968   5.549  -6.742
   94   1HG   LYS  92          2HG       LYS  92 117.602   3.334  -6.811
   95   2HG   LYS  92          1HG       LYS  92 115.942   3.482  -6.232
   96   1HD   LYS  92          2HD       LYS  92 115.498   4.506  -8.585
   97   2HD   LYS  92          1HD       LYS  92 117.006   3.698  -9.021
   98   1HE   LYS  92          2HE       LYS  92 114.999   2.099  -7.543
   99   2HE   LYS  92          1HE       LYS  92 114.613   2.519  -9.212
  100   1HZ   LYS  92          1HZ       LYS  92 116.490   0.612  -8.208
  101   2HZ   LYS  92          2HZ       LYS  92 117.204   1.671  -9.315
  102   3HZ   LYS  92          3HZ       LYS  92 115.846   0.771  -9.764
  103    H    THR  93           H        THR  93 116.222   7.087  -3.061
  104    HA   THR  93           HA       THR  93 117.990   9.253  -3.841
  105    HB   THR  93           HB       THR  93 117.281  10.115  -1.503
  106    HG1  THR  93           HG1      THR  93 115.201   8.240  -1.852
  107   1HG2  THR  93          1HG2      THR  93 115.313  11.083  -2.306
  108   2HG2  THR  93          2HG2      THR  93 114.991   9.734  -3.395
  109   3HG2  THR  93          3HG2      THR  93 116.319  10.842  -3.735
  110    H    GLU  94           H        GLU  94 119.252  10.124  -1.714
  111    HA   GLU  94           HA       GLU  94 121.475   8.476  -1.428
  112   1HB   GLU  94          2HB       GLU  94 120.558  11.009  -0.352
  113   2HB   GLU  94          1HB       GLU  94 121.452  10.093   0.853
  114   1HG   GLU  94          2HG       GLU  94 123.163   9.782  -1.108
  115   2HG   GLU  94          1HG       GLU  94 122.372  11.228  -1.737
  116    H    GLU  95           H        GLU  95 118.461   8.415   0.249
  117    HA   GLU  95           HA       GLU  95 119.334   7.129   2.623
  118   1HB   GLU  95          2HB       GLU  95 116.961   8.216   1.720
  119   2HB   GLU  95          1HB       GLU  95 116.605   6.496   1.793
  120   1HG   GLU  95          2HG       GLU  95 117.931   7.806   4.115
  121   2HG   GLU  95          1HG       GLU  95 116.203   8.037   3.860
  122    H    GLU  96           H        GLU  96 118.523   5.994  -0.573
  123    HA   GLU  96           HA       GLU  96 118.163   3.259   0.143
  124   1HB   GLU  96          2HB       GLU  96 118.047   2.810  -2.182
  125   2HB   GLU  96          1HB       GLU  96 117.289   4.379  -1.947
  126   1HG   GLU  96          2HG       GLU  96 118.603   5.157  -3.547
  127   2HG   GLU  96          1HG       GLU  96 119.963   4.956  -2.444
  128    H    LEU  97           H        LEU  97 120.925   5.244  -0.502
  129    HA   LEU  97           HA       LEU  97 122.802   3.392  -1.353
  130   1HB   LEU  97          2HB       LEU  97 122.925   5.940   0.174
  131   2HB   LEU  97          1HB       LEU  97 124.364   4.938   0.154
  132    HG   LEU  97           HG       LEU  97 123.003   5.700  -2.408
  133   1HD1  LEU  97          1HD1      LEU  97 125.239   7.307  -1.229
  134   2HD1  LEU  97          2HD1      LEU  97 123.552   7.715  -0.913
  135   3HD1  LEU  97          3HD1      LEU  97 124.163   7.712  -2.567
  136   1HD2  LEU  97          1HD2      LEU  97 125.635   5.634  -2.909
  137   2HD2  LEU  97          2HD2      LEU  97 124.597   4.213  -3.009
  138   3HD2  LEU  97          3HD2      LEU  97 125.563   4.499  -1.562
  139    H    SER  98           H        SER  98 121.433   3.865   1.818
  140    HA   SER  98           HA       SER  98 123.349   2.540   3.370
  141   1HB   SER  98          2HB       SER  98 121.420   3.891   4.243
  142   2HB   SER  98          1HB       SER  98 120.361   2.538   3.847
  143    HG   SER  98           HG       SER  98 121.655   2.866   6.062
  144    H    ASP  99           H        ASP  99 120.831   1.324   1.283
  145    HA   ASP  99           HA       ASP  99 120.838  -1.347   2.270
  146   1HB   ASP  99          2HB       ASP  99 119.768   0.009  -0.176
  147   2HB   ASP  99          1HB       ASP  99 119.830  -1.751  -0.123
  148    H    LEU 100           H        LEU 100 122.463   0.280  -0.426
  149    HA   LEU 100           HA       LEU 100 123.671  -1.975  -1.563
  150   1HB   LEU 100          2HB       LEU 100 124.133   0.950  -1.638
  151   2HB   LEU 100          1HB       LEU 100 125.476  -0.064  -2.129
  152    HG   LEU 100           HG       LEU 100 122.719  -0.251  -3.336
  153   1HD1  LEU 100          1HD1      LEU 100 125.116   1.054  -4.590
  154   2HD1  LEU 100          2HD1      LEU 100 123.915   1.963  -3.671
  155   3HD1  LEU 100          3HD1      LEU 100 123.437   1.089  -5.128
  156   1HD2  LEU 100          1HD2      LEU 100 125.388  -1.332  -4.233
  157   2HD2  LEU 100          2HD2      LEU 100 123.855  -1.506  -5.087
  158   3HD2  LEU 100          3HD2      LEU 100 124.082  -2.276  -3.517
  159    H    PHE 101           H        PHE 101 124.598   0.028   1.160
  160    HA   PHE 101           HA       PHE 101 127.241  -0.988   1.422
  161   1HB   PHE 101          2HB       PHE 101 126.553   1.162   2.400
  162   2HB   PHE 101          1HB       PHE 101 125.460   0.318   3.491
  163    HD1  PHE 101           HD1      PHE 101 129.046   0.028   2.482
  164    HD2  PHE 101           HD2      PHE 101 126.203   0.160   5.645
  165    HE1  PHE 101           HE1      PHE 101 130.866  -0.197   4.122
  166    HE2  PHE 101           HE2      PHE 101 128.018  -0.065   7.292
  167    HZ   PHE 101           HZ       PHE 101 130.352  -0.243   6.531
  168    H    ARG 102           H        ARG 102 124.127  -1.851   2.855
  169    HA   ARG 102           HA       ARG 102 125.038  -3.699   4.744
  170   1HB   ARG 102          2HB       ARG 102 122.507  -2.940   3.565
  171   2HB   ARG 102          1HB       ARG 102 122.582  -4.680   3.808
  172   1HG   ARG 102          2HG       ARG 102 122.898  -4.451   6.123
  173   2HG   ARG 102          1HG       ARG 102 123.276  -2.733   5.983
  174   1HD   ARG 102          2HD       ARG 102 120.963  -2.317   5.233
  175   2HD   ARG 102          1HD       ARG 102 120.602  -4.028   5.460
  176    HE   ARG 102           HE       ARG 102 121.652  -2.812   7.823
  177   1HH1  ARG 102          1HH1      ARG 102 118.750  -3.249   5.936
  178   2HH1  ARG 102          2HH1      ARG 102 117.689  -3.031   7.287
  179   1HH2  ARG 102          1HH2      ARG 102 120.260  -2.524   9.600
  180   2HH2  ARG 102          2HH2      ARG 102 118.545  -2.619   9.369
  181    H    MET 103           H        MET 103 124.589  -3.979   1.296
  182    HA   MET 103           HA       MET 103 124.711  -6.830   1.196
  183   1HB   MET 103          2HB       MET 103 124.763  -4.611  -0.784
  184   2HB   MET 103          1HB       MET 103 125.409  -6.165  -1.293
  185   1HG   MET 103          2HG       MET 103 123.234  -7.181  -0.516
  186   2HG   MET 103          1HG       MET 103 122.626  -5.534  -0.363
  187   1HE   MET 103          1HE       MET 103 121.767  -8.064  -1.804
  188   2HE   MET 103          2HE       MET 103 122.614  -8.422  -3.310
  189   3HE   MET 103          3HE       MET 103 121.099  -7.519  -3.343
  190    H    PHE 104           H        PHE 104 127.056  -4.243   1.134
  191    HA   PHE 104           HA       PHE 104 129.245  -5.818   0.213
  192   1HB   PHE 104          2HB       PHE 104 128.953  -3.112   1.462
  193   2HB   PHE 104          1HB       PHE 104 130.552  -3.843   1.349
  194    HD1  PHE 104           HD1      PHE 104 128.821  -1.433  -0.100
  195    HD2  PHE 104           HD2      PHE 104 130.554  -5.158  -1.210
  196    HE1  PHE 104           HE1      PHE 104 129.007  -0.649  -2.425
  197    HE2  PHE 104           HE2      PHE 104 130.744  -4.381  -3.537
  198    HZ   PHE 104           HZ       PHE 104 129.970  -2.124  -4.148
  199    H    ASP 105           H        ASP 105 127.879  -5.080   3.349
  200    HA   ASP 105           HA       ASP 105 130.065  -6.039   4.894
  201   1HB   ASP 105          2HB       ASP 105 127.841  -4.608   5.482
  202   2HB   ASP 105          1HB       ASP 105 127.351  -6.196   6.065
  203    H    LYS 106           H        LYS 106 130.155  -7.977   6.151
  204    HA   LYS 106           HA       LYS 106 128.951 -10.251   4.758
  205   1HB   LYS 106          2HB       LYS 106 131.389 -10.258   5.038
  206   2HB   LYS 106          1HB       LYS 106 131.195 -10.154   6.782
  207   1HG   LYS 106          2HG       LYS 106 131.648 -12.404   6.367
  208   2HG   LYS 106          1HG       LYS 106 129.900 -12.340   6.606
  209   1HD   LYS 106          2HD       LYS 106 130.734 -11.950   3.827
  210   2HD   LYS 106          1HD       LYS 106 131.170 -13.526   4.489
  211   1HE   LYS 106          2HE       LYS 106 128.942 -14.082   4.941
  212   2HE   LYS 106          1HE       LYS 106 128.406 -12.407   4.811
  213   1HZ   LYS 106          1HZ       LYS 106 129.608 -13.538   2.423
  214   2HZ   LYS 106          2HZ       LYS 106 128.252 -12.540   2.584
  215   3HZ   LYS 106          3HZ       LYS 106 128.116 -14.201   2.871
  216    H    ASN 107           H        ASN 107 129.429  -9.014   8.054
  217    HA   ASN 107           HA       ASN 107 127.325 -10.838   8.990
  218   1HB   ASN 107          2HB       ASN 107 128.184 -10.365  11.258
  219   2HB   ASN 107          1HB       ASN 107 129.427 -11.029  10.201
  220   1HD2  ASN 107          1HD2      ASN 107 130.598  -9.987  12.137
  221   2HD2  ASN 107          2HD2      ASN 107 131.155  -8.372  11.880
  222    H    ALA 108           H        ALA 108 127.682  -7.699   7.978
  223    HA   ALA 108           HA       ALA 108 126.374  -5.844   8.111
  224   1HB   ALA 108          1HB       ALA 108 124.276  -7.268   9.668
  225   2HB   ALA 108          2HB       ALA 108 124.617  -7.809   8.025
  226   3HB   ALA 108          3HB       ALA 108 124.116  -6.144   8.319
  227    H    ASP 109           H        ASP 109 128.181  -5.318   9.698
  228    HA   ASP 109           HA       ASP 109 127.102  -4.932  12.408
  229   1HB   ASP 109          2HB       ASP 109 129.431  -4.713  13.150
  230   2HB   ASP 109          1HB       ASP 109 129.168  -6.250  12.333
  231    H    GLY 110           H        GLY 110 128.352  -3.334   9.588
  232   1HA   GLY 110          2HA       GLY 110 127.443  -1.005   9.384
  233   2HA   GLY 110          1HA       GLY 110 128.108  -0.744  10.989
  234    H    TYR 111           H        TYR 111 130.463  -2.503  10.115
  235    HA   TYR 111           HA       TYR 111 131.808  -0.532   8.395
  236   1HB   TYR 111          2HB       TYR 111 133.051  -1.864  10.810
  237   2HB   TYR 111          1HB       TYR 111 133.817  -0.680   9.754
  238    HD1  TYR 111           HD1      TYR 111 130.876  -1.070  12.016
  239    HD2  TYR 111           HD2      TYR 111 133.760   1.566  10.334
  240    HE1  TYR 111           HE1      TYR 111 130.054   0.741  13.460
  241    HE2  TYR 111           HE2      TYR 111 132.947   3.384  11.775
  242    HH   TYR 111           HH       TYR 111 130.035   3.152  13.561
  243    H    ILE 112           H        ILE 112 133.533  -1.336   7.121
  244    HA   ILE 112           HA       ILE 112 133.674  -4.270   6.927
  245    HB   ILE 112           HB       ILE 112 133.668  -2.428   4.538
  246   1HG1  ILE 112          2HG1      ILE 112 131.423  -4.165   5.590
  247   2HG1  ILE 112          1HG1      ILE 112 131.471  -2.407   5.673
  248   1HG2  ILE 112          1HG2      ILE 112 134.854  -4.466   4.122
  249   2HG2  ILE 112          2HG2      ILE 112 133.291  -4.562   3.313
  250   3HG2  ILE 112          3HG2      ILE 112 133.554  -5.425   4.829
  251   1HD1  ILE 112          1HD1      ILE 112 130.930  -2.157   3.498
  252   2HD1  ILE 112          2HD1      ILE 112 130.201  -3.742   3.754
  253   3HD1  ILE 112          3HD1      ILE 112 131.790  -3.612   2.999
  254    H    ASP 113           H        ASP 113 135.645  -5.130   6.199
  255    HA   ASP 113           HA       ASP 113 137.875  -3.235   5.943
  256   1HB   ASP 113          2HB       ASP 113 139.267  -4.777   7.341
  257   2HB   ASP 113          1HB       ASP 113 137.971  -3.983   8.231
  258    H    LEU 114           H        LEU 114 139.956  -4.711   5.428
  259    HA   LEU 114           HA       LEU 114 139.574  -5.679   2.832
  260   1HB   LEU 114          2HB       LEU 114 141.840  -6.213   4.754
  261   2HB   LEU 114          1HB       LEU 114 141.882  -6.560   3.036
  262    HG   LEU 114           HG       LEU 114 141.297  -3.767   3.900
  263   1HD1  LEU 114          1HD1      LEU 114 144.140  -4.445   3.510
  264   2HD1  LEU 114          2HD1      LEU 114 143.423  -4.949   5.040
  265   3HD1  LEU 114          3HD1      LEU 114 143.388  -3.251   4.569
  266   1HD2  LEU 114          1HD2      LEU 114 142.990  -4.797   1.639
  267   2HD2  LEU 114          2HD2      LEU 114 142.268  -3.200   1.824
  268   3HD2  LEU 114          3HD2      LEU 114 141.243  -4.600   1.513
  269    H    GLU 115           H        GLU 115 139.487  -7.289   5.929
  270    HA   GLU 115           HA       GLU 115 139.685  -9.948   4.960
  271   1HB   GLU 115          2HB       GLU 115 139.940  -9.011   7.380
  272   2HB   GLU 115          1HB       GLU 115 138.198  -9.235   7.464
  273   1HG   GLU 115          2HG       GLU 115 138.573 -11.622   6.799
  274   2HG   GLU 115          1HG       GLU 115 140.299 -11.333   7.003
  275    H    GLU 116           H        GLU 116 136.860  -8.092   6.105
  276    HA   GLU 116           HA       GLU 116 134.946 -10.003   5.332
  277   1HB   GLU 116          2HB       GLU 116 134.914  -7.166   6.181
  278   2HB   GLU 116          1HB       GLU 116 133.515  -7.712   5.266
  279   1HG   GLU 116          2HG       GLU 116 133.040  -9.414   6.870
  280   2HG   GLU 116          1HG       GLU 116 134.551  -9.102   7.722
  281    H    LEU 117           H        LEU 117 136.484  -7.375   3.601
  282    HA   LEU 117           HA       LEU 117 134.705  -7.395   1.373
  283   1HB   LEU 117          2HB       LEU 117 136.455  -5.604   2.202
  284   2HB   LEU 117          1HB       LEU 117 137.533  -6.476   1.130
  285    HG   LEU 117           HG       LEU 117 135.896  -6.084  -0.725
  286   1HD1  LEU 117          1HD1      LEU 117 133.908  -5.719   0.636
  287   2HD1  LEU 117          2HD1      LEU 117 134.214  -4.340  -0.420
  288   3HD1  LEU 117          3HD1      LEU 117 134.618  -4.245   1.293
  289   1HD2  LEU 117          1HD2      LEU 117 136.786  -3.490   0.495
  290   2HD2  LEU 117          2HD2      LEU 117 136.705  -3.939  -1.209
  291   3HD2  LEU 117          3HD2      LEU 117 137.936  -4.652  -0.166
  292    H    LYS 118           H        LYS 118 137.551  -9.194   2.257
  293    HA   LYS 118           HA       LYS 118 138.243 -10.154  -0.309
  294   1HB   LYS 118          2HB       LYS 118 139.562 -10.229   1.937
  295   2HB   LYS 118          1HB       LYS 118 138.704 -11.742   2.194
  296   1HG   LYS 118          2HG       LYS 118 140.474 -12.632   1.150
  297   2HG   LYS 118          1HG       LYS 118 139.629 -12.122  -0.314
  298   1HD   LYS 118          2HD       LYS 118 141.629 -11.141  -0.743
  299   2HD   LYS 118          1HD       LYS 118 140.932  -9.852   0.240
  300   1HE   LYS 118          2HE       LYS 118 142.716 -10.038   1.559
  301   2HE   LYS 118          1HE       LYS 118 142.062 -11.586   2.087
  302   1HZ   LYS 118          1HZ       LYS 118 143.530 -12.738   0.831
  303   2HZ   LYS 118          2HZ       LYS 118 144.467 -11.347   1.048
  304   3HZ   LYS 118          3HZ       LYS 118 143.604 -11.568  -0.390
  305    H    ILE 119           H        ILE 119 135.808 -11.086   1.985
  306    HA   ILE 119           HA       ILE 119 135.339 -13.703   0.960
  307    HB   ILE 119           HB       ILE 119 133.398 -11.964   2.484
  308   1HG1  ILE 119          2HG1      ILE 119 135.351 -13.972   3.620
  309   2HG1  ILE 119          1HG1      ILE 119 135.653 -12.239   3.587
  310   1HG2  ILE 119          1HG2      ILE 119 133.447 -14.886   2.836
  311   2HG2  ILE 119          2HG2      ILE 119 132.897 -14.315   1.260
  312   3HG2  ILE 119          3HG2      ILE 119 132.080 -13.775   2.728
  313   1HD1  ILE 119          1HD1      ILE 119 133.150 -13.259   4.835
  314   2HD1  ILE 119          2HD1      ILE 119 134.074 -11.798   5.190
  315   3HD1  ILE 119          3HD1      ILE 119 134.676 -13.372   5.713
  316    H    MET 120           H        MET 120 134.099 -10.505   0.213
  317    HA   MET 120           HA       MET 120 132.016 -11.509  -1.512
  318   1HB   MET 120          2HB       MET 120 131.593  -9.154  -2.024
  319   2HB   MET 120          1HB       MET 120 131.697  -9.414  -0.288
  320   1HG   MET 120          2HG       MET 120 133.658  -8.259  -0.090
  321   2HG   MET 120          1HG       MET 120 134.150  -8.590  -1.749
  322   1HE   MET 120          1HE       MET 120 134.232  -6.624  -3.444
  323   2HE   MET 120          2HE       MET 120 132.698  -5.847  -3.839
  324   3HE   MET 120          3HE       MET 120 132.814  -7.606  -3.816
  325    H    LEU 121           H        LEU 121 135.307 -10.412  -1.833
  326    HA   LEU 121           HA       LEU 121 135.211 -10.054  -4.673
  327   1HB   LEU 121          2HB       LEU 121 137.586 -10.413  -2.843
  328   2HB   LEU 121          1HB       LEU 121 137.656  -9.882  -4.513
  329    HG   LEU 121           HG       LEU 121 135.973  -8.292  -2.650
  330   1HD1  LEU 121          1HD1      LEU 121 138.728  -7.382  -2.667
  331   2HD1  LEU 121          2HD1      LEU 121 138.536  -8.939  -1.862
  332   3HD1  LEU 121          3HD1      LEU 121 137.598  -7.547  -1.324
  333   1HD2  LEU 121          1HD2      LEU 121 136.581  -6.500  -4.058
  334   2HD2  LEU 121          2HD2      LEU 121 136.278  -7.870  -5.127
  335   3HD2  LEU 121          3HD2      LEU 121 137.935  -7.398  -4.746
  336    H    GLN 122           H        GLN 122 136.242 -12.635  -2.491
  337    HA   GLN 122           HA       GLN 122 137.381 -14.327  -4.421
  338   1HB   GLN 122          2HB       GLN 122 137.027 -16.128  -2.759
  339   2HB   GLN 122          1HB       GLN 122 137.771 -14.694  -2.064
  340   1HG   GLN 122          2HG       GLN 122 135.576 -14.006  -1.199
  341   2HG   GLN 122          1HG       GLN 122 134.879 -15.491  -1.845
  342   1HE2  GLN 122          1HE2      GLN 122 137.839 -14.726  -0.041
  343   2HE2  GLN 122          2HE2      GLN 122 137.577 -15.882   1.215
  344    H    ALA 123           H        ALA 123 134.084 -14.173  -3.120
  345    HA   ALA 123           HA       ALA 123 133.014 -16.352  -4.496
  346   1HB   ALA 123          1HB       ALA 123 130.820 -15.033  -4.246
  347   2HB   ALA 123          2HB       ALA 123 131.800 -13.844  -3.390
  348   3HB   ALA 123          3HB       ALA 123 131.687 -15.495  -2.782
  349    H    THR 124           H        THR 124 133.526 -13.025  -5.509
  350    HA   THR 124           HA       THR 124 132.054 -13.288  -7.955
  351    HB   THR 124           HB       THR 124 133.481 -11.128  -8.467
  352    HG1  THR 124           HG1      THR 124 134.143 -10.126  -6.546
  353   1HG2  THR 124          1HG2      THR 124 131.212 -10.775  -8.137
  354   2HG2  THR 124          2HG2      THR 124 131.976  -9.807  -6.876
  355   3HG2  THR 124          3HG2      THR 124 131.263 -11.368  -6.478
  356    H    GLY 125           H        GLY 125 132.875 -13.429 -10.063
  357   1HA   GLY 125          2HA       GLY 125 135.443 -14.828 -10.216
  358   2HA   GLY 125          1HA       GLY 125 134.192 -14.829 -11.450
  359    H    GLU 126           H        GLU 126 135.382 -11.932  -9.869
  360    HA   GLU 126           HA       GLU 126 136.104 -10.824 -12.443
  361   1HB   GLU 126          2HB       GLU 126 136.039  -9.688  -9.650
  362   2HB   GLU 126          1HB       GLU 126 136.639  -8.778 -11.029
  363   1HG   GLU 126          2HG       GLU 126 134.538  -8.691 -12.038
  364   2HG   GLU 126          1HG       GLU 126 133.907 -10.002 -11.043
  365    H    THR 127           H        THR 127 138.186  -9.442 -12.463
  366    HA   THR 127           HA       THR 127 140.379 -11.190 -11.596
  367    HB   THR 127           HB       THR 127 141.702 -10.206 -13.351
  368    HG1  THR 127           HG1      THR 127 139.505  -8.506 -13.906
  369   1HG2  THR 127          1HG2      THR 127 140.000 -10.421 -15.348
  370   2HG2  THR 127          2HG2      THR 127 138.986 -11.131 -14.093
  371   3HG2  THR 127          3HG2      THR 127 140.563 -11.832 -14.454
  372    H    ILE 128           H        ILE 128 140.053 -10.208  -9.413
  373    HA   ILE 128           HA       ILE 128 141.378  -7.583  -9.204
  374    HB   ILE 128           HB       ILE 128 139.653  -8.903  -7.109
  375   1HG1  ILE 128          2HG1      ILE 128 138.625  -6.498  -8.445
  376   2HG1  ILE 128          1HG1      ILE 128 138.741  -7.902  -9.500
  377   1HG2  ILE 128          1HG2      ILE 128 139.723  -6.827  -5.963
  378   2HG2  ILE 128          2HG2      ILE 128 140.497  -6.024  -7.328
  379   3HG2  ILE 128          3HG2      ILE 128 141.386  -7.226  -6.394
  380   1HD1  ILE 128          1HD1      ILE 128 137.464  -9.175  -7.741
  381   2HD1  ILE 128          2HD1      ILE 128 136.569  -7.917  -8.595
  382   3HD1  ILE 128          3HD1      ILE 128 137.166  -7.621  -6.962
  383    H    THR 129           H        THR 129 143.392  -7.603  -8.475
  384    HA   THR 129           HA       THR 129 144.528  -9.993  -7.333
  385    HB   THR 129           HB       THR 129 146.080  -7.468  -7.325
  386    HG1  THR 129           HG1      THR 129 145.285  -7.044  -9.254
  387   1HG2  THR 129          1HG2      THR 129 147.826  -8.817  -7.503
  388   2HG2  THR 129          2HG2      THR 129 147.118  -9.675  -8.872
  389   3HG2  THR 129          3HG2      THR 129 146.707 -10.152  -7.225
  390    H    GLU 130           H        GLU 130 145.939  -9.809  -5.355
  391    HA   GLU 130           HA       GLU 130 144.394  -9.138  -3.125
  392   1HB   GLU 130          2HB       GLU 130 146.515 -10.684  -3.416
  393   2HB   GLU 130          1HB       GLU 130 147.373  -9.236  -2.905
  394   1HG   GLU 130          2HG       GLU 130 146.056  -9.165  -0.858
  395   2HG   GLU 130          1HG       GLU 130 145.171 -10.600  -1.371
  396    H    ASP 131           H        ASP 131 146.953  -7.361  -4.779
  397    HA   ASP 131           HA       ASP 131 147.080  -5.245  -2.871
  398   1HB   ASP 131          2HB       ASP 131 148.704  -6.037  -4.886
  399   2HB   ASP 131          1HB       ASP 131 147.886  -4.684  -5.663
  400    H    ASP 132           H        ASP 132 145.182  -5.878  -5.731
  401    HA   ASP 132           HA       ASP 132 144.250  -3.270  -6.220
  402   1HB   ASP 132          2HB       ASP 132 143.318  -6.017  -6.926
  403   2HB   ASP 132          1HB       ASP 132 142.207  -4.672  -7.166
  404    H    ILE 133           H        ILE 133 143.291  -5.707  -3.916
  405    HA   ILE 133           HA       ILE 133 140.766  -4.598  -3.241
  406    HB   ILE 133           HB       ILE 133 142.525  -6.280  -1.456
  407   1HG1  ILE 133          2HG1      ILE 133 140.508  -7.161  -3.535
  408   2HG1  ILE 133          1HG1      ILE 133 142.253  -7.362  -3.647
  409   1HG2  ILE 133          1HG2      ILE 133 139.765  -5.293  -1.327
  410   2HG2  ILE 133          2HG2      ILE 133 140.850  -5.811  -0.037
  411   3HG2  ILE 133          3HG2      ILE 133 139.956  -7.010  -0.972
  412   1HD1  ILE 133          1HD1      ILE 133 141.106  -9.423  -2.994
  413   2HD1  ILE 133          2HD1      ILE 133 140.498  -8.615  -1.550
  414   3HD1  ILE 133          3HD1      ILE 133 142.230  -8.866  -1.757
  415    H    GLU 134           H        GLU 134 144.044  -4.088  -2.077
  416    HA   GLU 134           HA       GLU 134 143.372  -2.583   0.222
  417   1HB   GLU 134          2HB       GLU 134 145.883  -2.649  -1.455
  418   2HB   GLU 134          1HB       GLU 134 145.744  -1.770   0.062
  419   1HG   GLU 134          2HG       GLU 134 145.155  -3.940   1.160
  420   2HG   GLU 134          1HG       GLU 134 145.565  -4.739  -0.357
  421    H    GLU 135           H        GLU 135 143.888  -1.731  -3.146
  422    HA   GLU 135           HA       GLU 135 144.039   1.062  -2.824
  423   1HB   GLU 135          2HB       GLU 135 142.994  -0.494  -5.196
  424   2HB   GLU 135          1HB       GLU 135 143.519   1.183  -5.211
  425   1HG   GLU 135          2HG       GLU 135 145.222  -1.248  -4.730
  426   2HG   GLU 135          1HG       GLU 135 145.248  -0.186  -6.138
  427    H    LEU 136           H        LEU 136 141.338  -1.152  -3.001
  428    HA   LEU 136           HA       LEU 136 139.286   0.674  -3.549
  429   1HB   LEU 136          2HB       LEU 136 139.498  -2.053  -2.482
  430   2HB   LEU 136          1HB       LEU 136 138.083  -1.178  -1.928
  431    HG   LEU 136           HG       LEU 136 137.778  -0.654  -4.487
  432   1HD1  LEU 136          1HD1      LEU 136 139.807  -2.799  -4.423
  433   2HD1  LEU 136          2HD1      LEU 136 139.502  -1.556  -5.637
  434   3HD1  LEU 136          3HD1      LEU 136 138.483  -2.994  -5.572
  435   1HD2  LEU 136          1HD2      LEU 136 136.497  -2.212  -2.759
  436   2HD2  LEU 136          2HD2      LEU 136 137.135  -3.470  -3.817
  437   3HD2  LEU 136          3HD2      LEU 136 136.108  -2.197  -4.479
  438    H    MET 137           H        MET 137 140.520  -0.508  -0.425
  439    HA   MET 137           HA       MET 137 138.812   1.107   1.153
  440   1HB   MET 137          2HB       MET 137 141.465  -0.166   1.842
  441   2HB   MET 137          1HB       MET 137 140.352   0.535   3.006
  442   1HG   MET 137          2HG       MET 137 138.796  -1.253   1.577
  443   2HG   MET 137          1HG       MET 137 140.342  -2.078   1.770
  444   1HE   MET 137          1HE       MET 137 137.155  -1.231   2.870
  445   2HE   MET 137          2HE       MET 137 137.045  -1.322   4.629
  446   3HE   MET 137          3HE       MET 137 137.149  -2.802   3.673
  447    H    LYS 138           H        LYS 138 141.851   1.687  -0.424
  448    HA   LYS 138           HA       LYS 138 142.835   3.827   1.058
  449   1HB   LYS 138          2HB       LYS 138 144.096   2.716  -0.734
  450   2HB   LYS 138          1HB       LYS 138 143.002   3.399  -1.931
  451   1HG   LYS 138          2HG       LYS 138 143.716   5.673  -1.100
  452   2HG   LYS 138          1HG       LYS 138 144.984   4.843  -0.199
  453   1HD   LYS 138          2HD       LYS 138 146.194   4.405  -2.054
  454   2HD   LYS 138          1HD       LYS 138 144.761   4.101  -3.038
  455   1HE   LYS 138          2HE       LYS 138 145.827   6.055  -3.897
  456   2HE   LYS 138          1HE       LYS 138 144.358   6.568  -3.067
  457   1HZ   LYS 138          1HZ       LYS 138 146.780   6.514  -1.462
  458   2HZ   LYS 138          2HZ       LYS 138 145.522   7.645  -1.487
  459   3HZ   LYS 138          3HZ       LYS 138 146.726   7.695  -2.673
  460    H    ASP 139           H        ASP 139 141.000   4.085  -1.995
  461    HA   ASP 139           HA       ASP 139 140.430   6.852  -1.539
  462   1HB   ASP 139          2HB       ASP 139 139.297   6.809  -3.637
  463   2HB   ASP 139          1HB       ASP 139 140.715   5.781  -3.805
  464    H    GLY 140           H        GLY 140 138.935   3.913  -0.612
  465   1HA   GLY 140          2HA       GLY 140 136.265   4.968  -0.376
  466   2HA   GLY 140          1HA       GLY 140 136.837   3.423   0.237
  467    H    ASP 141           H        ASP 141 139.076   4.777   1.670
  468    HA   ASP 141           HA       ASP 141 137.555   5.447   4.057
  469   1HB   ASP 141          2HB       ASP 141 139.566   3.862   4.006
  470   2HB   ASP 141          1HB       ASP 141 140.559   5.306   3.833
  471    H    LYS 142           H        LYS 142 137.940   7.342   5.301
  472    HA   LYS 142           HA       LYS 142 139.091   9.581   3.769
  473   1HB   LYS 142          2HB       LYS 142 136.582   9.539   5.447
  474   2HB   LYS 142          1HB       LYS 142 137.351  11.020   4.893
  475   1HG   LYS 142          2HG       LYS 142 136.332   8.842   3.082
  476   2HG   LYS 142          1HG       LYS 142 135.449  10.314   3.491
  477   1HD   LYS 142          2HD       LYS 142 138.137  10.203   2.125
  478   2HD   LYS 142          1HD       LYS 142 136.592  10.496   1.324
  479   1HE   LYS 142          2HE       LYS 142 136.310  12.478   2.861
  480   2HE   LYS 142          1HE       LYS 142 137.988  12.237   3.346
  481   1HZ   LYS 142          1HZ       LYS 142 138.635  12.509   1.015
  482   2HZ   LYS 142          2HZ       LYS 142 137.850  13.882   1.611
  483   3HZ   LYS 142          3HZ       LYS 142 137.023  12.811   0.596
  484    H    ASN 143           H        ASN 143 138.342   8.289   6.975
  485    HA   ASN 143           HA       ASN 143 140.089  10.248   8.236
  486   1HB   ASN 143          2HB       ASN 143 139.347   9.096  10.357
  487   2HB   ASN 143          1HB       ASN 143 138.058   9.848   9.421
  488   1HD2  ASN 143          1HD2      ASN 143 136.360   8.620   9.941
  489   2HD2  ASN 143          2HD2      ASN 143 136.256   6.915   9.680
  490    H    ASN 144           H        ASN 144 140.575   7.409   6.671
  491    HA   ASN 144           HA       ASN 144 142.264   5.894   6.604
  492   1HB   ASN 144          2HB       ASN 144 143.575   8.010   8.312
  493   2HB   ASN 144          1HB       ASN 144 144.421   6.573   7.749
  494   1HD2  ASN 144          1HD2      ASN 144 145.824   7.387   6.327
  495   2HD2  ASN 144          2HD2      ASN 144 145.397   8.322   4.938
  496    H    ASP 145           H        ASP 145 140.198   5.528   8.532
  497    HA   ASP 145           HA       ASP 145 141.349   4.673  11.012
  498   1HB   ASP 145          2HB       ASP 145 139.106   3.786  11.497
  499   2HB   ASP 145          1HB       ASP 145 139.024   5.442  10.901
  500    H    GLY 146           H        GLY 146 140.604   3.185   7.946
  501   1HA   GLY 146          2HA       GLY 146 141.904   1.231   7.311
  502   2HA   GLY 146          1HA       GLY 146 141.755   0.668   8.969
  503    H    ARG 147           H        ARG 147 138.875   2.031   7.830
  504    HA   ARG 147           HA       ARG 147 137.850  -0.371   6.595
  505   1HB   ARG 147          2HB       ARG 147 136.742   0.563   9.250
  506   2HB   ARG 147          1HB       ARG 147 136.058  -0.706   8.246
  507   1HG   ARG 147          2HG       ARG 147 138.325  -1.867   8.492
  508   2HG   ARG 147          1HG       ARG 147 138.613  -0.727   9.808
  509   1HD   ARG 147          2HD       ARG 147 136.771  -1.547  11.046
  510   2HD   ARG 147          1HD       ARG 147 136.156  -2.453   9.664
  511    HE   ARG 147           HE       ARG 147 137.591  -4.155  10.189
  512   1HH1  ARG 147          1HH1      ARG 147 138.595  -1.276  11.886
  513   2HH1  ARG 147          2HH1      ARG 147 139.787  -2.100  12.834
  514   1HH2  ARG 147          1HH2      ARG 147 139.159  -5.240  11.435
  515   2HH2  ARG 147          2HH2      ARG 147 140.107  -4.351  12.578
  516    H    ILE 148           H        ILE 148 135.330  -0.061   6.344
  517    HA   ILE 148           HA       ILE 148 134.811   2.765   5.693
  518    HB   ILE 148           HB       ILE 148 133.924   0.425   4.004
  519   1HG1  ILE 148          2HG1      ILE 148 136.140   2.416   3.473
  520   2HG1  ILE 148          1HG1      ILE 148 136.382   0.737   3.937
  521   1HG2  ILE 148          1HG2      ILE 148 133.800   3.404   3.557
  522   2HG2  ILE 148          2HG2      ILE 148 132.437   2.329   3.870
  523   3HG2  ILE 148          3HG2      ILE 148 133.354   2.179   2.370
  524   1HD1  ILE 148          1HD1      ILE 148 136.455   0.283   1.770
  525   2HD1  ILE 148          2HD1      ILE 148 135.849   1.883   1.343
  526   3HD1  ILE 148          3HD1      ILE 148 134.718   0.588   1.737
  527    H    ASP 149           H        ASP 149 132.794   3.531   6.136
  528    HA   ASP 149           HA       ASP 149 130.776   1.623   7.089
  529   1HB   ASP 149          2HB       ASP 149 130.226   3.134   8.963
  530   2HB   ASP 149          1HB       ASP 149 131.874   2.524   9.075
  531    H    TYR 150           H        TYR 150 128.727   3.229   7.698
  532    HA   TYR 150           HA       TYR 150 127.614   3.912   5.252
  533   1HB   TYR 150          2HB       TYR 150 126.342   3.490   7.352
  534   2HB   TYR 150          1HB       TYR 150 126.852   5.070   7.939
  535    HD1  TYR 150           HD1      TYR 150 125.220   3.582   4.919
  536    HD2  TYR 150           HD2      TYR 150 125.372   6.816   7.679
  537    HE1  TYR 150           HE1      TYR 150 123.282   4.613   3.810
  538    HE2  TYR 150           HE2      TYR 150 123.435   7.856   6.578
  539    HH   TYR 150           HH       TYR 150 121.410   6.885   5.112
  540    H    ASP 151           H        ASP 151 129.275   5.964   7.606
  541    HA   ASP 151           HA       ASP 151 128.763   8.434   6.377
  542   1HB   ASP 151          2HB       ASP 151 130.919   7.453   8.226
  543   2HB   ASP 151          1HB       ASP 151 130.972   9.087   7.572
  544    H    GLU 152           H        GLU 152 131.588   6.284   6.096
  545    HA   GLU 152           HA       GLU 152 132.894   7.861   4.136
  546   1HB   GLU 152          2HB       GLU 152 133.241   4.919   4.740
  547   2HB   GLU 152          1HB       GLU 152 134.364   5.927   3.839
  548   1HG   GLU 152          2HG       GLU 152 134.903   7.198   5.775
  549   2HG   GLU 152          1HG       GLU 152 133.603   6.448   6.700
  550    H    PHE 153           H        PHE 153 130.753   5.054   3.958
  551    HA   PHE 153           HA       PHE 153 130.987   4.535   1.221
  552   1HB   PHE 153          2HB       PHE 153 129.820   3.133   3.016
  553   2HB   PHE 153          1HB       PHE 153 128.430   4.189   2.782
  554    HD1  PHE 153           HD1      PHE 153 130.820   2.194   0.721
  555    HD2  PHE 153           HD2      PHE 153 126.808   3.471   1.337
  556    HE1  PHE 153           HE1      PHE 153 130.091   0.803  -1.175
  557    HE2  PHE 153           HE2      PHE 153 126.071   2.083  -0.556
  558    HZ   PHE 153           HZ       PHE 153 127.714   0.746  -1.814
  559    H    LEU 154           H        LEU 154 129.048   6.875   2.971
  560    HA   LEU 154           HA       LEU 154 127.468   7.648   0.713
  561   1HB   LEU 154          2HB       LEU 154 127.736   8.427   3.525
  562   2HB   LEU 154          1HB       LEU 154 127.365   9.770   2.461
  563    HG   LEU 154           HG       LEU 154 125.351   8.674   1.690
  564   1HD1  LEU 154          1HD1      LEU 154 124.638   6.537   2.789
  565   2HD1  LEU 154          2HD1      LEU 154 126.285   6.381   3.401
  566   3HD1  LEU 154          3HD1      LEU 154 125.986   6.384   1.663
  567   1HD2  LEU 154          1HD2      LEU 154 124.051   8.849   3.655
  568   2HD2  LEU 154          2HD2      LEU 154 125.395   9.973   3.858
  569   3HD2  LEU 154          3HD2      LEU 154 125.414   8.415   4.685
  570    H    GLU 155           H        GLU 155 130.192   9.147   2.448
  571    HA   GLU 155           HA       GLU 155 130.454  11.379   0.762
  572   1HB   GLU 155          2HB       GLU 155 132.537   9.977   2.447
  573   2HB   GLU 155          1HB       GLU 155 132.744  11.560   1.710
  574   1HG   GLU 155          2HG       GLU 155 130.370  11.183   3.431
  575   2HG   GLU 155          1HG       GLU 155 131.944  11.221   4.225
  576    H    PHE 156           H        PHE 156 132.007   8.196   0.692
  577    HA   PHE 156           HA       PHE 156 133.775   8.667  -1.423
  578   1HB   PHE 156          2HB       PHE 156 133.844   6.679   0.066
  579   2HB   PHE 156          1HB       PHE 156 132.397   6.065  -0.727
  580    HD1  PHE 156           HD1      PHE 156 132.978   4.200  -1.936
  581    HD2  PHE 156           HD2      PHE 156 135.500   7.625  -2.084
  582    HE1  PHE 156           HE1      PHE 156 134.377   3.092  -3.628
  583    HE2  PHE 156           HE2      PHE 156 136.905   6.523  -3.777
  584    HZ   PHE 156           HZ       PHE 156 136.340   4.253  -4.552
  585    H    MET 157           H        MET 157 130.377   7.794  -1.398
  586    HA   MET 157           HA       MET 157 130.307   7.459  -4.279
  587   1HB   MET 157          2HB       MET 157 128.753   6.520  -2.147
  588   2HB   MET 157          1HB       MET 157 127.704   7.631  -3.018
  589   1HG   MET 157          2HG       MET 157 127.351   5.474  -3.919
  590   2HG   MET 157          1HG       MET 157 128.271   6.391  -5.112
  591   1HE   MET 157          1HE       MET 157 128.985   4.534  -1.848
  592   2HE   MET 157          2HE       MET 157 130.082   3.230  -2.307
  593   3HE   MET 157          3HE       MET 157 128.375   3.143  -2.742
  594    H    LYS 158           H        LYS 158 129.776   9.941  -1.946
  595    HA   LYS 158           HA       LYS 158 128.152  11.585  -3.677
  596   1HB   LYS 158          2HB       LYS 158 128.179  11.509  -1.071
  597   2HB   LYS 158          1HB       LYS 158 129.557  12.591  -1.223
  598   1HG   LYS 158          2HG       LYS 158 128.190  14.192  -2.441
  599   2HG   LYS 158          1HG       LYS 158 126.808  13.098  -2.343
  600   1HD   LYS 158          2HD       LYS 158 126.427  14.579  -0.593
  601   2HD   LYS 158          1HD       LYS 158 127.195  13.208   0.209
  602   1HE   LYS 158          2HE       LYS 158 129.247  14.952  -0.676
  603   2HE   LYS 158          1HE       LYS 158 128.027  15.932   0.132
  604   1HZ   LYS 158          1HZ       LYS 158 129.166  15.312   1.951
  605   2HZ   LYS 158          2HZ       LYS 158 129.814  13.927   1.228
  606   3HZ   LYS 158          3HZ       LYS 158 128.237  13.903   1.837
  607    H    GLY 159           H        GLY 159 130.139  11.108  -5.260
  608   1HA   GLY 159          2HA       GLY 159 131.308  12.661  -6.668
  609   2HA   GLY 159          1HA       GLY 159 131.715  13.593  -5.235
  610    H    VAL 160           H        VAL 160 132.350  10.566  -6.940
  611    HA   VAL 160           HA       VAL 160 134.619   9.886  -5.327
  612    HB   VAL 160           HB       VAL 160 134.013   8.810  -8.075
  613   1HG1  VAL 160          1HG1      VAL 160 136.163   8.369  -6.508
  614   2HG1  VAL 160          2HG1      VAL 160 135.511   7.185  -7.641
  615   3HG1  VAL 160          3HG1      VAL 160 135.084   7.098  -5.933
  616   1HG2  VAL 160          1HG2      VAL 160 133.056   7.075  -6.030
  617   2HG2  VAL 160          2HG2      VAL 160 132.155   7.843  -7.336
  618   3HG2  VAL 160          3HG2      VAL 160 132.342   8.669  -5.790
  619    H    GLU 161           H        GLU 161 134.089  11.617  -8.322
  620    HA   GLU 161           HA       GLU 161 136.903  11.722  -8.977
  621   1HB   GLU 161          2HB       GLU 161 134.640  13.298 -10.210
  622   2HB   GLU 161          1HB       GLU 161 136.233  13.013 -10.898
  623   1HG   GLU 161          2HG       GLU 161 135.718  10.609 -11.032
  624   2HG   GLU 161          1HG       GLU 161 134.100  10.945 -10.415
  Start of MODEL   12
    1   1H    MET  81          1HT       MET  81  93.745  11.777   7.259
    2   2H    MET  81          2HT       MET  81  92.372  12.750   7.600
    3   3H    MET  81          3HT       MET  81  93.892  13.135   8.296
    4    HA   MET  81           HA       MET  81  93.165  14.518   6.388
    5   1HB   MET  81          2HB       MET  81  95.527  14.082   7.336
    6   2HB   MET  81          1HB       MET  81  95.756  13.056   5.927
    7   1HG   MET  81          2HG       MET  81  95.057  15.094   4.555
    8   2HG   MET  81          1HG       MET  81  95.315  16.016   6.034
    9   1HE   MET  81          1HE       MET  81  96.689  17.249   4.121
   10   2HE   MET  81          2HE       MET  81  98.442  17.060   4.107
   11   3HE   MET  81          3HE       MET  81  97.617  17.523   5.595
   12    H    VAL  82           H        VAL  82  92.899  14.675   4.159
   13    HA   VAL  82           HA       VAL  82  91.877  12.345   2.874
   14    HB   VAL  82           HB       VAL  82  91.577  13.808   0.902
   15   1HG1  VAL  82          1HG1      VAL  82  90.155  13.803   3.169
   16   2HG1  VAL  82          2HG1      VAL  82  89.738  14.800   1.776
   17   3HG1  VAL  82          3HG1      VAL  82  90.623  15.503   3.129
   18   1HG2  VAL  82          1HG2      VAL  82  93.134  15.412   0.684
   19   2HG2  VAL  82          2HG2      VAL  82  93.436  15.496   2.419
   20   3HG2  VAL  82          3HG2      VAL  82  92.062  16.353   1.721
   21    H    ARG  83           H        ARG  83  92.585  12.072   0.427
   22    HA   ARG  83           HA       ARG  83  95.255  11.060   0.516
   23   1HB   ARG  83          2HB       ARG  83  94.800  10.503  -1.910
   24   2HB   ARG  83          1HB       ARG  83  93.690   9.799  -0.742
   25   1HG   ARG  83          2HG       ARG  83  92.668  12.327  -1.573
   26   2HG   ARG  83          1HG       ARG  83  93.089  11.376  -2.999
   27   1HD   ARG  83          2HD       ARG  83  91.722   9.544  -2.239
   28   2HD   ARG  83          1HD       ARG  83  91.400  10.369  -0.713
   29    HE   ARG  83           HE       ARG  83  89.797  11.621  -1.766
   30   1HH1  ARG  83          1HH1      ARG  83  91.782  10.062  -4.178
   31   2HH1  ARG  83          2HH1      ARG  83  90.761  10.527  -5.497
   32   1HH2  ARG  83          1HH2      ARG  83  88.453  12.233  -3.500
   33   2HH2  ARG  83          2HH2      ARG  83  88.871  11.759  -5.113
   34    H    CYS  84           H        CYS  84  96.407  13.041   0.944
   35    HA   CYS  84           HA       CYS  84  96.907  14.579  -1.516
   36   1HB   CYS  84          2HB       CYS  84  96.415  15.539   1.268
   37   2HB   CYS  84          1HB       CYS  84  97.559  16.429   0.270
   38    HG   CYS  84           HG       CYS  84  95.357  16.468  -1.464
   39    H    MET  85           H        MET  85  99.059  15.973  -1.003
   40    HA   MET  85           HA       MET  85 101.327  15.892  -0.852
   41   1HB   MET  85          2HB       MET  85 100.332  14.953   1.602
   42   2HB   MET  85          1HB       MET  85 101.625  13.844   1.165
   43   1HG   MET  85          2HG       MET  85 102.357  16.620   0.746
   44   2HG   MET  85          1HG       MET  85 101.904  16.280   2.415
   45   1HE   MET  85          1HE       MET  85 104.643  14.415   3.922
   46   2HE   MET  85          2HE       MET  85 102.986  15.017   3.985
   47   3HE   MET  85          3HE       MET  85 104.334  16.150   3.869
   48    H    LYS  86           H        LYS  86 103.238  14.134  -0.641
   49    HA   LYS  86           HA       LYS  86 102.525  11.989  -2.531
   50   1HB   LYS  86          2HB       LYS  86 105.200  13.353  -2.168
   51   2HB   LYS  86          1HB       LYS  86 104.828  12.105  -3.350
   52   1HG   LYS  86          2HG       LYS  86 102.933  13.926  -3.957
   53   2HG   LYS  86          1HG       LYS  86 104.224  14.981  -3.378
   54   1HD   LYS  86          2HD       LYS  86 105.737  13.553  -4.934
   55   2HD   LYS  86          1HD       LYS  86 104.216  13.095  -5.704
   56   1HE   LYS  86          2HE       LYS  86 103.726  15.570  -5.899
   57   2HE   LYS  86          1HE       LYS  86 105.400  15.848  -5.422
   58   1HZ   LYS  86          1HZ       LYS  86 106.160  14.683  -7.344
   59   2HZ   LYS  86          2HZ       LYS  86 105.032  15.834  -7.856
   60   3HZ   LYS  86          3HZ       LYS  86 104.590  14.205  -7.758
   61    H    ASP  87           H        ASP  87 102.241  10.207  -1.323
   62    HA   ASP  87           HA       ASP  87 103.679   9.646   1.059
   63   1HB   ASP  87          2HB       ASP  87 102.631   7.395   0.879
   64   2HB   ASP  87          1HB       ASP  87 101.470   8.710   0.730
   65    H    ASP  88           H        ASP  88 103.933   8.433  -2.265
   66    HA   ASP  88           HA       ASP  88 106.335   6.935  -1.562
   67   1HB   ASP  88          2HB       ASP  88 104.296   6.326  -3.248
   68   2HB   ASP  88          1HB       ASP  88 105.455   7.013  -4.383
   69    H    SER  89           H        SER  89 106.865   9.525  -1.207
   70    HA   SER  89           HA       SER  89 108.137  10.526  -3.647
   71   1HB   SER  89          2HB       SER  89 106.772  12.147  -2.461
   72   2HB   SER  89          1HB       SER  89 107.656  11.844  -0.966
   73    HG   SER  89           HG       SER  89 108.858  12.822  -3.340
   74    H    LYS  90           H        LYS  90 109.226   8.227  -2.317
   75    HA   LYS  90           HA       LYS  90 111.785   9.329  -1.356
   76   1HB   LYS  90          2HB       LYS  90 110.606   6.619  -0.719
   77   2HB   LYS  90          1HB       LYS  90 112.097   7.289  -0.070
   78   1HG   LYS  90          2HG       LYS  90 110.246   9.203   0.586
   79   2HG   LYS  90          1HG       LYS  90 109.337   7.701   0.763
   80   1HD   LYS  90          2HD       LYS  90 111.120   6.815   2.209
   81   2HD   LYS  90          1HD       LYS  90 111.987   8.344   2.057
   82   1HE   LYS  90          2HE       LYS  90 110.893   8.908   3.931
   83   2HE   LYS  90          1HE       LYS  90 109.530   9.196   2.850
   84   1HZ   LYS  90          1HZ       LYS  90 109.262   6.590   3.301
   85   2HZ   LYS  90          2HZ       LYS  90 108.514   7.777   4.247
   86   3HZ   LYS  90          3HZ       LYS  90 109.954   7.061   4.770
   87    H    GLY  91           H        GLY  91 112.405   9.484  -3.623
   88   1HA   GLY  91          2HA       GLY  91 112.607   7.121  -5.229
   89   2HA   GLY  91          1HA       GLY  91 113.326   8.685  -5.583
   90    H    LYS  92           H        LYS  92 115.462   8.696  -5.647
   91    HA   LYS  92           HA       LYS  92 116.917   6.585  -4.215
   92   1HB   LYS  92          2HB       LYS  92 117.214   6.717  -6.677
   93   2HB   LYS  92          1HB       LYS  92 117.868   8.338  -6.487
   94   1HG   LYS  92          2HG       LYS  92 119.411   6.860  -4.767
   95   2HG   LYS  92          1HG       LYS  92 119.141   5.748  -6.109
   96   1HD   LYS  92          2HD       LYS  92 119.699   8.152  -7.356
   97   2HD   LYS  92          1HD       LYS  92 120.791   8.141  -5.970
   98   1HE   LYS  92          2HE       LYS  92 122.140   6.867  -7.205
   99   2HE   LYS  92          1HE       LYS  92 120.970   5.568  -6.971
  100   1HZ   LYS  92          1HZ       LYS  92 121.510   7.175  -9.326
  101   2HZ   LYS  92          2HZ       LYS  92 119.875   6.867  -9.020
  102   3HZ   LYS  92          3HZ       LYS  92 120.956   5.581  -9.204
  103    H    THR  93           H        THR  93 116.439   8.071  -2.300
  104    HA   THR  93           HA       THR  93 118.124  10.423  -2.124
  105    HB   THR  93           HB       THR  93 115.898  10.433  -1.089
  106    HG1  THR  93           HG1      THR  93 117.302  11.783  -0.084
  107   1HG2  THR  93          1HG2      THR  93 116.736   7.924   0.016
  108   2HG2  THR  93          2HG2      THR  93 115.138   8.668  -0.003
  109   3HG2  THR  93          3HG2      THR  93 116.271   9.043   1.296
  110    H    GLU  94           H        GLU  94 119.019  10.393   0.452
  111    HA   GLU  94           HA       GLU  94 121.384   8.865   0.252
  112   1HB   GLU  94          2HB       GLU  94 120.148  10.560   2.388
  113   2HB   GLU  94          1HB       GLU  94 121.548   9.567   2.772
  114   1HG   GLU  94          2HG       GLU  94 122.858  10.684   1.087
  115   2HG   GLU  94          1HG       GLU  94 121.450  11.608   0.562
  116    H    GLU  95           H        GLU  95 118.268   8.055   1.375
  117    HA   GLU  95           HA       GLU  95 118.954   6.148   3.354
  118   1HB   GLU  95          2HB       GLU  95 116.521   6.844   1.801
  119   2HB   GLU  95          1HB       GLU  95 116.573   5.241   2.521
  120   1HG   GLU  95          2HG       GLU  95 116.595   6.061   4.675
  121   2HG   GLU  95          1HG       GLU  95 117.213   7.636   4.180
  122    H    GLU  96           H        GLU  96 118.084   5.784  -0.083
  123    HA   GLU  96           HA       GLU  96 118.325   3.013  -0.233
  124   1HB   GLU  96          2HB       GLU  96 118.437   3.271  -2.610
  125   2HB   GLU  96          1HB       GLU  96 117.350   4.505  -1.989
  126   1HG   GLU  96          2HG       GLU  96 118.515   5.950  -3.202
  127   2HG   GLU  96          1HG       GLU  96 119.795   5.769  -2.001
  128    H    LEU  97           H        LEU  97 120.772   5.494  -0.220
  129    HA   LEU  97           HA       LEU  97 122.921   4.084  -1.314
  130   1HB   LEU  97          2HB       LEU  97 122.666   6.358   0.601
  131   2HB   LEU  97          1HB       LEU  97 124.238   5.611   0.386
  132    HG   LEU  97           HG       LEU  97 122.616   6.690  -1.913
  133   1HD1  LEU  97          1HD1      LEU  97 124.320   8.077   0.055
  134   2HD1  LEU  97          2HD1      LEU  97 122.991   8.688  -0.931
  135   3HD1  LEU  97          3HD1      LEU  97 124.593   8.480  -1.639
  136   1HD2  LEU  97          1HD2      LEU  97 125.583   6.276  -1.764
  137   2HD2  LEU  97          2HD2      LEU  97 124.559   6.455  -3.189
  138   3HD2  LEU  97          3HD2      LEU  97 124.491   4.975  -2.234
  139    H    SER  98           H        SER  98 121.444   3.918   1.841
  140    HA   SER  98           HA       SER  98 123.528   2.644   3.234
  141   1HB   SER  98          2HB       SER  98 121.262   3.666   4.078
  142   2HB   SER  98          1HB       SER  98 120.656   2.027   3.832
  143    HG   SER  98           HG       SER  98 122.954   2.653   5.371
  144    H    ASP  99           H        ASP  99 121.109   1.442   1.024
  145    HA   ASP  99           HA       ASP  99 121.307  -1.301   1.660
  146   1HB   ASP  99          2HB       ASP  99 120.575  -0.015  -0.978
  147   2HB   ASP  99          1HB       ASP  99 120.261  -1.688  -0.527
  148    H    LEU 100           H        LEU 100 123.000   0.721  -0.706
  149    HA   LEU 100           HA       LEU 100 124.463  -1.302  -1.967
  150   1HB   LEU 100          2HB       LEU 100 125.003   1.626  -1.549
  151   2HB   LEU 100          1HB       LEU 100 126.110   0.601  -2.442
  152    HG   LEU 100           HG       LEU 100 123.769   0.035  -3.705
  153   1HD1  LEU 100          1HD1      LEU 100 123.508   2.959  -3.591
  154   2HD1  LEU 100          2HD1      LEU 100 122.988   2.100  -2.141
  155   3HD1  LEU 100          3HD1      LEU 100 122.270   1.708  -3.704
  156   1HD2  LEU 100          1HD2      LEU 100 125.332   2.438  -4.545
  157   2HD2  LEU 100          2HD2      LEU 100 124.687   1.119  -5.524
  158   3HD2  LEU 100          3HD2      LEU 100 126.105   0.853  -4.507
  159    H    PHE 101           H        PHE 101 125.063   0.486   0.997
  160    HA   PHE 101           HA       PHE 101 127.729  -0.453   1.361
  161   1HB   PHE 101          2HB       PHE 101 126.960   1.606   2.423
  162   2HB   PHE 101          1HB       PHE 101 125.761   0.706   3.346
  163    HD1  PHE 101           HD1      PHE 101 126.515  -0.895   5.098
  164    HD2  PHE 101           HD2      PHE 101 129.197   1.772   3.145
  165    HE1  PHE 101           HE1      PHE 101 128.153  -1.228   6.902
  166    HE2  PHE 101           HE2      PHE 101 130.840   1.444   4.947
  167    HZ   PHE 101           HZ       PHE 101 130.320  -0.057   6.828
  168    H    ARG 102           H        ARG 102 124.575  -1.699   2.128
  169    HA   ARG 102           HA       ARG 102 125.298  -3.507   4.161
  170   1HB   ARG 102          2HB       ARG 102 122.975  -2.884   3.723
  171   2HB   ARG 102          1HB       ARG 102 123.044  -3.673   2.153
  172   1HG   ARG 102          2HG       ARG 102 122.716  -5.710   3.023
  173   2HG   ARG 102          1HG       ARG 102 123.770  -5.400   4.405
  174   1HD   ARG 102          2HD       ARG 102 121.465  -3.765   4.676
  175   2HD   ARG 102          1HD       ARG 102 120.928  -5.400   4.297
  176    HE   ARG 102           HE       ARG 102 122.930  -5.276   6.359
  177   1HH1  ARG 102          1HH1      ARG 102 119.510  -5.150   5.667
  178   2HH1  ARG 102          2HH1      ARG 102 119.045  -5.639   7.261
  179   1HH2  ARG 102          1HH2      ARG 102 122.317  -5.916   8.456
  180   2HH2  ARG 102          2HH2      ARG 102 120.637  -6.073   8.845
  181    H    MET 103           H        MET 103 124.872  -4.031   0.657
  182    HA   MET 103           HA       MET 103 125.495  -6.728   0.571
  183   1HB   MET 103          2HB       MET 103 126.320  -6.203  -1.794
  184   2HB   MET 103          1HB       MET 103 124.655  -5.796  -1.410
  185   1HG   MET 103          2HG       MET 103 125.155  -3.494  -1.250
  186   2HG   MET 103          1HG       MET 103 126.890  -3.801  -1.258
  187   1HE   MET 103          1HE       MET 103 127.856  -5.383  -3.333
  188   2HE   MET 103          2HE       MET 103 128.328  -3.686  -3.431
  189   3HE   MET 103          3HE       MET 103 127.770  -4.532  -4.875
  190    H    PHE 104           H        PHE 104 127.669  -3.944   0.475
  191    HA   PHE 104           HA       PHE 104 130.053  -5.316  -0.023
  192   1HB   PHE 104          2HB       PHE 104 129.308  -2.666   1.054
  193   2HB   PHE 104          1HB       PHE 104 130.913  -3.242   1.496
  194    HD1  PHE 104           HD1      PHE 104 129.203  -1.330  -0.794
  195    HD2  PHE 104           HD2      PHE 104 132.184  -4.361  -0.620
  196    HE1  PHE 104           HE1      PHE 104 130.059  -0.608  -2.986
  197    HE2  PHE 104           HE2      PHE 104 133.045  -3.646  -2.809
  198    HZ   PHE 104           HZ       PHE 104 131.983  -1.766  -3.996
  199    H    ASP 105           H        ASP 105 128.207  -4.904   2.905
  200    HA   ASP 105           HA       ASP 105 130.314  -5.843   4.634
  201   1HB   ASP 105          2HB       ASP 105 127.528  -4.890   4.964
  202   2HB   ASP 105          1HB       ASP 105 128.097  -6.042   6.170
  203    H    LYS 106           H        LYS 106 130.601  -7.860   5.444
  204    HA   LYS 106           HA       LYS 106 129.250 -10.024   4.079
  205   1HB   LYS 106          2HB       LYS 106 131.776  -9.835   4.695
  206   2HB   LYS 106          1HB       LYS 106 131.257 -10.407   6.274
  207   1HG   LYS 106          2HG       LYS 106 131.903 -12.337   5.150
  208   2HG   LYS 106          1HG       LYS 106 130.144 -12.330   5.010
  209   1HD   LYS 106          2HD       LYS 106 130.645 -11.044   2.776
  210   2HD   LYS 106          1HD       LYS 106 132.221 -11.823   2.929
  211   1HE   LYS 106          2HE       LYS 106 131.248 -13.535   1.857
  212   2HE   LYS 106          1HE       LYS 106 130.537 -13.901   3.429
  213   1HZ   LYS 106          1HZ       LYS 106 129.287 -12.354   1.226
  214   2HZ   LYS 106          2HZ       LYS 106 128.618 -12.507   2.772
  215   3HZ   LYS 106          3HZ       LYS 106 128.816 -13.876   1.798
  216    H    ASN 107           H        ASN 107 129.780  -9.081   7.475
  217    HA   ASN 107           HA       ASN 107 127.598 -10.858   8.274
  218   1HB   ASN 107          2HB       ASN 107 128.394 -10.365  10.598
  219   2HB   ASN 107          1HB       ASN 107 129.602 -11.135   9.572
  220   1HD2  ASN 107          1HD2      ASN 107 130.381  -9.848  11.821
  221   2HD2  ASN 107          2HD2      ASN 107 131.221  -8.393  11.418
  222    H    ALA 108           H        ALA 108 128.090  -7.625   7.499
  223    HA   ALA 108           HA       ALA 108 126.774  -5.777   7.640
  224   1HB   ALA 108          1HB       ALA 108 124.595  -7.381   8.918
  225   2HB   ALA 108          2HB       ALA 108 125.002  -7.617   7.219
  226   3HB   ALA 108          3HB       ALA 108 124.474  -6.032   7.787
  227    H    ASP 109           H        ASP 109 128.524  -5.527   9.424
  228    HA   ASP 109           HA       ASP 109 127.280  -5.299  12.071
  229   1HB   ASP 109          2HB       ASP 109 129.618  -4.975  12.882
  230   2HB   ASP 109          1HB       ASP 109 129.361  -6.522  12.083
  231    H    GLY 110           H        GLY 110 128.418  -3.425   9.410
  232   1HA   GLY 110          2HA       GLY 110 127.430  -1.121   9.447
  233   2HA   GLY 110          1HA       GLY 110 128.156  -0.972  11.039
  234    H    TYR 111           H        TYR 111 130.512  -2.588   9.874
  235    HA   TYR 111           HA       TYR 111 131.723  -0.411   8.312
  236   1HB   TYR 111          2HB       TYR 111 133.106  -1.953  10.516
  237   2HB   TYR 111          1HB       TYR 111 133.810  -0.666   9.542
  238    HD1  TYR 111           HD1      TYR 111 133.433   1.624  10.073
  239    HD2  TYR 111           HD2      TYR 111 131.313  -1.419  12.159
  240    HE1  TYR 111           HE1      TYR 111 132.673   3.288  11.716
  241    HE2  TYR 111           HE2      TYR 111 130.546   0.238  13.806
  242    HH   TYR 111           HH       TYR 111 130.177   2.859  13.746
  243    H    ILE 112           H        ILE 112 133.588  -1.071   7.027
  244    HA   ILE 112           HA       ILE 112 133.607  -3.949   6.399
  245    HB   ILE 112           HB       ILE 112 133.781  -1.765   4.321
  246   1HG1  ILE 112          2HG1      ILE 112 131.439  -3.617   4.596
  247   2HG1  ILE 112          1HG1      ILE 112 131.514  -2.160   5.582
  248   1HG2  ILE 112          1HG2      ILE 112 134.056  -4.698   4.304
  249   2HG2  ILE 112          2HG2      ILE 112 134.759  -3.481   3.238
  250   3HG2  ILE 112          3HG2      ILE 112 133.092  -4.007   2.999
  251   1HD1  ILE 112          1HD1      ILE 112 131.274  -0.767   3.778
  252   2HD1  ILE 112          2HD1      ILE 112 130.289  -2.146   3.289
  253   3HD1  ILE 112          3HD1      ILE 112 131.917  -1.952   2.641
  254    H    ASP 113           H        ASP 113 135.573  -4.833   5.856
  255    HA   ASP 113           HA       ASP 113 137.892  -3.044   5.729
  256   1HB   ASP 113          2HB       ASP 113 139.146  -4.531   7.260
  257   2HB   ASP 113          1HB       ASP 113 137.768  -3.770   8.049
  258    H    LEU 114           H        LEU 114 139.928  -4.436   5.211
  259    HA   LEU 114           HA       LEU 114 139.571  -5.571   2.685
  260   1HB   LEU 114          2HB       LEU 114 141.784  -5.294   4.607
  261   2HB   LEU 114          1HB       LEU 114 141.951  -6.626   3.479
  262    HG   LEU 114           HG       LEU 114 143.077  -4.590   2.690
  263   1HD1  LEU 114          1HD1      LEU 114 141.545  -6.310   1.240
  264   2HD1  LEU 114          2HD1      LEU 114 142.615  -5.086   0.557
  265   3HD1  LEU 114          3HD1      LEU 114 140.893  -4.747   0.747
  266   1HD2  LEU 114          1HD2      LEU 114 142.017  -2.700   3.330
  267   2HD2  LEU 114          2HD2      LEU 114 140.416  -3.434   3.230
  268   3HD2  LEU 114          3HD2      LEU 114 141.225  -2.880   1.765
  269    H    GLU 115           H        GLU 115 139.553  -7.006   5.868
  270    HA   GLU 115           HA       GLU 115 139.849  -9.706   5.054
  271   1HB   GLU 115          2HB       GLU 115 139.958  -8.508   7.436
  272   2HB   GLU 115          1HB       GLU 115 138.287  -9.052   7.500
  273   1HG   GLU 115          2HG       GLU 115 139.195 -11.354   6.882
  274   2HG   GLU 115          1HG       GLU 115 140.783 -10.697   7.280
  275    H    GLU 116           H        GLU 116 136.970  -7.818   5.971
  276    HA   GLU 116           HA       GLU 116 135.148  -9.897   5.281
  277   1HB   GLU 116          2HB       GLU 116 134.983  -7.119   6.243
  278   2HB   GLU 116          1HB       GLU 116 133.625  -7.634   5.253
  279   1HG   GLU 116          2HG       GLU 116 132.943  -9.221   6.765
  280   2HG   GLU 116          1HG       GLU 116 134.546  -9.379   7.484
  281    H    LEU 117           H        LEU 117 136.650  -7.302   3.528
  282    HA   LEU 117           HA       LEU 117 134.791  -7.324   1.343
  283   1HB   LEU 117          2HB       LEU 117 136.390  -5.430   2.128
  284   2HB   LEU 117          1HB       LEU 117 137.590  -6.267   1.161
  285    HG   LEU 117           HG       LEU 117 136.068  -6.037  -0.813
  286   1HD1  LEU 117          1HD1      LEU 117 134.040  -5.085  -0.706
  287   2HD1  LEU 117          2HD1      LEU 117 134.563  -3.859   0.450
  288   3HD1  LEU 117          3HD1      LEU 117 134.134  -5.476   1.012
  289   1HD2  LEU 117          1HD2      LEU 117 137.459  -3.870   0.600
  290   2HD2  LEU 117          2HD2      LEU 117 136.315  -3.343  -0.637
  291   3HD2  LEU 117          3HD2      LEU 117 137.628  -4.441  -1.061
  292    H    LYS 118           H        LYS 118 137.892  -8.837   2.042
  293    HA   LYS 118           HA       LYS 118 138.391  -9.814  -0.562
  294   1HB   LYS 118          2HB       LYS 118 140.039 -11.263   0.479
  295   2HB   LYS 118          1HB       LYS 118 140.128  -9.653   1.179
  296   1HG   LYS 118          2HG       LYS 118 139.429 -10.346   3.218
  297   2HG   LYS 118          1HG       LYS 118 138.407 -11.625   2.556
  298   1HD   LYS 118          2HD       LYS 118 140.857 -12.525   1.846
  299   2HD   LYS 118          1HD       LYS 118 141.243 -11.682   3.347
  300   1HE   LYS 118          2HE       LYS 118 139.157 -12.978   4.253
  301   2HE   LYS 118          1HE       LYS 118 139.485 -14.051   2.893
  302   1HZ   LYS 118          1HZ       LYS 118 140.582 -14.433   5.228
  303   2HZ   LYS 118          2HZ       LYS 118 141.714 -13.320   4.645
  304   3HZ   LYS 118          3HZ       LYS 118 141.432 -14.759   3.801
  305    H    ILE 119           H        ILE 119 136.386 -10.949   2.041
  306    HA   ILE 119           HA       ILE 119 136.108 -13.631   1.107
  307    HB   ILE 119           HB       ILE 119 134.206 -12.091   2.879
  308   1HG1  ILE 119          2HG1      ILE 119 136.259 -13.969   3.959
  309   2HG1  ILE 119          1HG1      ILE 119 136.777 -12.353   3.492
  310   1HG2  ILE 119          1HG2      ILE 119 133.806 -14.507   1.731
  311   2HG2  ILE 119          2HG2      ILE 119 133.123 -14.021   3.283
  312   3HG2  ILE 119          3HG2      ILE 119 134.599 -14.983   3.234
  313   1HD1  ILE 119          1HD1      ILE 119 134.589 -11.778   4.971
  314   2HD1  ILE 119          2HD1      ILE 119 136.235 -11.843   5.602
  315   3HD1  ILE 119          3HD1      ILE 119 135.169 -13.238   5.774
  316    H    MET 120           H        MET 120 134.082 -10.718   0.848
  317    HA   MET 120           HA       MET 120 132.039 -11.963  -0.674
  318   1HB   MET 120          2HB       MET 120 131.283  -9.659  -1.143
  319   2HB   MET 120          1HB       MET 120 131.597  -9.926   0.567
  320   1HG   MET 120          2HG       MET 120 133.386  -8.524   0.603
  321   2HG   MET 120          1HG       MET 120 133.798  -8.824  -1.084
  322   1HE   MET 120          1HE       MET 120 131.202  -6.813  -3.025
  323   2HE   MET 120          2HE       MET 120 132.059  -8.350  -2.896
  324   3HE   MET 120          3HE       MET 120 132.965  -6.850  -3.092
  325    H    LEU 121           H        LEU 121 135.060 -10.418  -1.500
  326    HA   LEU 121           HA       LEU 121 134.477 -10.160  -4.293
  327   1HB   LEU 121          2HB       LEU 121 136.457  -9.234  -2.546
  328   2HB   LEU 121          1HB       LEU 121 137.302 -10.266  -3.683
  329    HG   LEU 121           HG       LEU 121 135.764  -8.781  -5.374
  330   1HD1  LEU 121          1HD1      LEU 121 135.915  -6.459  -4.681
  331   2HD1  LEU 121          2HD1      LEU 121 136.605  -6.948  -3.134
  332   3HD1  LEU 121          3HD1      LEU 121 134.945  -7.384  -3.537
  333   1HD2  LEU 121          1HD2      LEU 121 138.329  -9.303  -5.178
  334   2HD2  LEU 121          2HD2      LEU 121 138.391  -7.673  -4.508
  335   3HD2  LEU 121          3HD2      LEU 121 137.756  -7.935  -6.131
  336    H    GLN 122           H        GLN 122 135.871 -12.613  -2.244
  337    HA   GLN 122           HA       GLN 122 137.206 -14.149  -4.157
  338   1HB   GLN 122          2HB       GLN 122 136.118 -14.593  -1.450
  339   2HB   GLN 122          1HB       GLN 122 136.312 -16.043  -2.426
  340   1HG   GLN 122          2HG       GLN 122 138.552 -14.083  -2.166
  341   2HG   GLN 122          1HG       GLN 122 138.241 -15.270  -0.899
  342   1HE2  GLN 122          1HE2      GLN 122 140.508 -14.948  -2.761
  343   2HE2  GLN 122          2HE2      GLN 122 140.658 -16.466  -3.571
  344    H    ALA 123           H        ALA 123 133.814 -13.860  -3.408
  345    HA   ALA 123           HA       ALA 123 132.924 -16.217  -4.695
  346   1HB   ALA 123          1HB       ALA 123 131.292 -13.709  -4.435
  347   2HB   ALA 123          2HB       ALA 123 131.650 -14.742  -3.049
  348   3HB   ALA 123          3HB       ALA 123 130.747 -15.387  -4.420
  349    H    THR 124           H        THR 124 133.722 -13.016  -5.838
  350    HA   THR 124           HA       THR 124 132.417 -13.037  -8.308
  351    HB   THR 124           HB       THR 124 133.886 -11.276  -8.959
  352    HG1  THR 124           HG1      THR 124 135.885 -12.099  -8.563
  353   1HG2  THR 124          1HG2      THR 124 133.808  -9.745  -7.175
  354   2HG2  THR 124          2HG2      THR 124 133.834 -11.032  -5.969
  355   3HG2  THR 124          3HG2      THR 124 132.407 -10.799  -6.979
  356    H    GLY 125           H        GLY 125 133.927 -12.890 -10.412
  357   1HA   GLY 125          2HA       GLY 125 135.216 -15.534 -10.565
  358   2HA   GLY 125          1HA       GLY 125 134.498 -14.678 -11.920
  359    H    GLU 126           H        GLU 126 135.748 -12.126 -11.141
  360    HA   GLU 126           HA       GLU 126 138.106 -12.342 -12.668
  361   1HB   GLU 126          2HB       GLU 126 136.996 -10.173 -10.898
  362   2HB   GLU 126          1HB       GLU 126 138.540  -9.991 -11.722
  363   1HG   GLU 126          2HG       GLU 126 136.753 -10.852 -13.684
  364   2HG   GLU 126          1HG       GLU 126 135.871  -9.658 -12.733
  365    H    THR 127           H        THR 127 140.230 -12.506 -12.129
  366    HA   THR 127           HA       THR 127 140.845 -13.554  -9.521
  367    HB   THR 127           HB       THR 127 143.089 -13.898 -10.405
  368    HG1  THR 127           HG1      THR 127 143.749 -13.025 -12.280
  369   1HG2  THR 127          1HG2      THR 127 142.378 -14.951 -12.729
  370   2HG2  THR 127          2HG2      THR 127 140.769 -14.721 -12.041
  371   3HG2  THR 127          3HG2      THR 127 141.964 -15.696 -11.186
  372    H    ILE 128           H        ILE 128 140.627 -11.934  -8.016
  373    HA   ILE 128           HA       ILE 128 142.291  -9.536  -8.369
  374    HB   ILE 128           HB       ILE 128 140.124  -9.951  -6.313
  375   1HG1  ILE 128          2HG1      ILE 128 139.127 -10.076  -8.530
  376   2HG1  ILE 128          1HG1      ILE 128 138.711  -8.540  -7.779
  377   1HG2  ILE 128          1HG2      ILE 128 141.677  -8.250  -5.667
  378   2HG2  ILE 128          2HG2      ILE 128 140.199  -7.462  -6.221
  379   3HG2  ILE 128          3HG2      ILE 128 141.617  -7.516  -7.270
  380   1HD1  ILE 128          1HD1      ILE 128 140.858  -8.966  -9.843
  381   2HD1  ILE 128          2HD1      ILE 128 140.426  -7.426  -9.100
  382   3HD1  ILE 128          3HD1      ILE 128 139.265  -8.266 -10.128
  383    H    THR 129           H        THR 129 143.951  -9.100  -7.025
  384    HA   THR 129           HA       THR 129 144.734 -11.178  -5.152
  385    HB   THR 129           HB       THR 129 146.261  -8.655  -5.772
  386    HG1  THR 129           HG1      THR 129 146.234  -9.410  -7.745
  387   1HG2  THR 129          1HG2      THR 129 147.374  -9.740  -4.058
  388   2HG2  THR 129          2HG2      THR 129 148.187 -10.329  -5.507
  389   3HG2  THR 129          3HG2      THR 129 146.995 -11.341  -4.690
  390    H    GLU 130           H        GLU 130 145.610 -10.553  -3.009
  391    HA   GLU 130           HA       GLU 130 143.682  -9.232  -1.469
  392   1HB   GLU 130          2HB       GLU 130 145.435  -9.309   0.344
  393   2HB   GLU 130          1HB       GLU 130 145.065 -10.854  -0.409
  394   1HG   GLU 130          2HG       GLU 130 147.247 -11.110  -0.687
  395   2HG   GLU 130          1HG       GLU 130 147.147  -9.865  -1.930
  396    H    ASP 131           H        ASP 131 146.690  -8.100  -2.891
  397    HA   ASP 131           HA       ASP 131 146.739  -5.595  -1.542
  398   1HB   ASP 131          2HB       ASP 131 148.634  -6.881  -2.828
  399   2HB   ASP 131          1HB       ASP 131 148.019  -5.997  -4.221
  400    H    ASP 132           H        ASP 132 145.294  -6.759  -4.507
  401    HA   ASP 132           HA       ASP 132 144.708  -4.250  -5.663
  402   1HB   ASP 132          2HB       ASP 132 143.591  -7.019  -6.023
  403   2HB   ASP 132          1HB       ASP 132 142.884  -5.642  -6.865
  404    H    ILE 133           H        ILE 133 143.125  -6.171  -3.222
  405    HA   ILE 133           HA       ILE 133 140.634  -4.759  -3.317
  406    HB   ILE 133           HB       ILE 133 141.704  -6.417  -1.035
  407   1HG1  ILE 133          2HG1      ILE 133 139.945  -7.395  -3.285
  408   2HG1  ILE 133          1HG1      ILE 133 141.697  -7.561  -3.316
  409   1HG2  ILE 133          1HG2      ILE 133 138.830  -6.088  -1.808
  410   2HG2  ILE 133          2HG2      ILE 133 139.639  -4.883  -0.804
  411   3HG2  ILE 133          3HG2      ILE 133 139.521  -6.555  -0.254
  412   1HD1  ILE 133          1HD1      ILE 133 141.706  -9.190  -1.745
  413   2HD1  ILE 133          2HD1      ILE 133 140.099  -9.469  -2.417
  414   3HD1  ILE 133          3HD1      ILE 133 140.283  -8.559  -0.918
  415    H    GLU 134           H        GLU 134 143.656  -4.390  -1.614
  416    HA   GLU 134           HA       GLU 134 142.798  -2.712   0.468
  417   1HB   GLU 134          2HB       GLU 134 145.333  -3.536  -0.703
  418   2HB   GLU 134          1HB       GLU 134 145.375  -1.872  -0.141
  419   1HG   GLU 134          2HG       GLU 134 144.242  -2.976   1.992
  420   2HG   GLU 134          1HG       GLU 134 145.107  -4.389   1.388
  421    H    GLU 135           H        GLU 135 143.714  -2.040  -2.862
  422    HA   GLU 135           HA       GLU 135 143.833   0.771  -2.643
  423   1HB   GLU 135          2HB       GLU 135 143.625  -1.190  -4.867
  424   2HB   GLU 135          1HB       GLU 135 143.184   0.475  -5.221
  425   1HG   GLU 135          2HG       GLU 135 145.505   0.907  -3.974
  426   2HG   GLU 135          1HG       GLU 135 145.820  -0.706  -4.611
  427    H    LEU 136           H        LEU 136 141.195  -1.471  -3.243
  428    HA   LEU 136           HA       LEU 136 139.258   0.374  -4.087
  429   1HB   LEU 136          2HB       LEU 136 139.361  -2.346  -3.674
  430   2HB   LEU 136          1HB       LEU 136 138.232  -1.817  -2.441
  431    HG   LEU 136           HG       LEU 136 137.674  -0.639  -5.054
  432   1HD1  LEU 136          1HD1      LEU 136 138.548  -2.741  -5.882
  433   2HD1  LEU 136          2HD1      LEU 136 136.794  -2.703  -6.054
  434   3HD1  LEU 136          3HD1      LEU 136 137.532  -3.634  -4.751
  435   1HD2  LEU 136          1HD2      LEU 136 135.435  -1.855  -4.405
  436   2HD2  LEU 136          2HD2      LEU 136 135.953  -0.391  -3.565
  437   3HD2  LEU 136          3HD2      LEU 136 136.216  -1.971  -2.827
  438    H    MET 137           H        MET 137 140.420  -0.491  -0.906
  439    HA   MET 137           HA       MET 137 138.315   1.003   0.428
  440   1HB   MET 137          2HB       MET 137 140.756  -0.361   1.580
  441   2HB   MET 137          1HB       MET 137 139.407   0.294   2.500
  442   1HG   MET 137          2HG       MET 137 139.302  -2.009   0.565
  443   2HG   MET 137          1HG       MET 137 139.231  -2.107   2.324
  444   1HE   MET 137          1HE       MET 137 137.156  -0.742   3.707
  445   2HE   MET 137          2HE       MET 137 137.173  -2.491   3.476
  446   3HE   MET 137          3HE       MET 137 135.681  -1.583   3.230
  447    H    LYS 138           H        LYS 138 141.563   1.475  -0.665
  448    HA   LYS 138           HA       LYS 138 142.474   3.480   1.018
  449   1HB   LYS 138          2HB       LYS 138 143.026   2.658  -1.775
  450   2HB   LYS 138          1HB       LYS 138 143.531   4.282  -1.330
  451   1HG   LYS 138          2HG       LYS 138 144.679   3.191   0.671
  452   2HG   LYS 138          1HG       LYS 138 144.429   1.664  -0.180
  453   1HD   LYS 138          2HD       LYS 138 145.585   2.704  -2.159
  454   2HD   LYS 138          1HD       LYS 138 146.007   4.057  -1.109
  455   1HE   LYS 138          2HE       LYS 138 147.227   2.575   0.365
  456   2HE   LYS 138          1HE       LYS 138 146.734   1.177  -0.589
  457   1HZ   LYS 138          1HZ       LYS 138 148.209   1.653  -2.224
  458   2HZ   LYS 138          2HZ       LYS 138 149.049   2.361  -0.939
  459   3HZ   LYS 138          3HZ       LYS 138 148.134   3.327  -1.983
  460    H    ASP 139           H        ASP 139 140.595   3.821  -1.988
  461    HA   ASP 139           HA       ASP 139 140.275   6.663  -1.545
  462   1HB   ASP 139          2HB       ASP 139 139.224   6.733  -3.684
  463   2HB   ASP 139          1HB       ASP 139 140.585   5.626  -3.824
  464    H    GLY 140           H        GLY 140 138.584   3.791  -0.747
  465   1HA   GLY 140          2HA       GLY 140 135.981   5.032  -0.559
  466   2HA   GLY 140          1HA       GLY 140 136.405   3.407  -0.043
  467    H    ASP 141           H        ASP 141 138.688   4.478   1.557
  468    HA   ASP 141           HA       ASP 141 137.102   5.226   3.900
  469   1HB   ASP 141          2HB       ASP 141 138.682   3.264   3.977
  470   2HB   ASP 141          1HB       ASP 141 140.011   4.409   3.811
  471    H    LYS 142           H        LYS 142 137.029   7.266   4.545
  472    HA   LYS 142           HA       LYS 142 139.163   9.096   3.673
  473   1HB   LYS 142          2HB       LYS 142 136.322   9.719   4.502
  474   2HB   LYS 142          1HB       LYS 142 137.517  10.903   3.994
  475   1HG   LYS 142          2HG       LYS 142 136.834   8.645   2.172
  476   2HG   LYS 142          1HG       LYS 142 135.735  10.020   2.314
  477   1HD   LYS 142          2HD       LYS 142 137.654  11.522   1.799
  478   2HD   LYS 142          1HD       LYS 142 138.638  10.087   1.502
  479   1HE   LYS 142          2HE       LYS 142 137.104   9.400  -0.273
  480   2HE   LYS 142          1HE       LYS 142 136.111  10.825   0.029
  481   1HZ   LYS 142          1HZ       LYS 142 138.953  11.212  -0.566
  482   2HZ   LYS 142          2HZ       LYS 142 137.632  12.203  -0.927
  483   3HZ   LYS 142          3HZ       LYS 142 137.918  10.811  -1.842
  484    H    ASN 143           H        ASN 143 138.867   7.293   6.165
  485    HA   ASN 143           HA       ASN 143 139.336   9.415   8.155
  486   1HB   ASN 143          2HB       ASN 143 137.940   6.786   8.341
  487   2HB   ASN 143          1HB       ASN 143 138.826   7.353   9.754
  488   1HD2  ASN 143          1HD2      ASN 143 137.994   8.955  10.975
  489   2HD2  ASN 143          2HD2      ASN 143 136.476   9.722  10.672
  490    H    ASN 144           H        ASN 144 140.720   6.813   6.450
  491    HA   ASN 144           HA       ASN 144 142.792   5.883   6.473
  492   1HB   ASN 144          2HB       ASN 144 143.147   8.417   7.923
  493   2HB   ASN 144          1HB       ASN 144 144.352   7.192   8.307
  494   1HD2  ASN 144          1HD2      ASN 144 146.066   7.154   7.059
  495   2HD2  ASN 144          2HD2      ASN 144 146.163   7.751   5.440
  496    H    ASP 145           H        ASP 145 140.687   5.010   8.303
  497    HA   ASP 145           HA       ASP 145 142.194   4.067  10.626
  498   1HB   ASP 145          2HB       ASP 145 140.020   3.303  11.479
  499   2HB   ASP 145          1HB       ASP 145 139.969   5.009  11.043
  500    H    GLY 146           H        GLY 146 140.946   2.985   7.587
  501   1HA   GLY 146          2HA       GLY 146 141.846   1.003   6.579
  502   2HA   GLY 146          1HA       GLY 146 141.979   0.295   8.182
  503    H    ARG 147           H        ARG 147 139.070   1.993   7.471
  504    HA   ARG 147           HA       ARG 147 137.655  -0.307   6.456
  505   1HB   ARG 147          2HB       ARG 147 136.922   0.751   9.191
  506   2HB   ARG 147          1HB       ARG 147 136.134  -0.559   8.323
  507   1HG   ARG 147          2HG       ARG 147 138.253  -1.845   8.448
  508   2HG   ARG 147          1HG       ARG 147 138.923  -0.555   9.452
  509   1HD   ARG 147          2HD       ARG 147 136.928  -0.921  10.983
  510   2HD   ARG 147          1HD       ARG 147 136.630  -2.399  10.070
  511    HE   ARG 147           HE       ARG 147 139.223  -2.640  10.788
  512   1HH1  ARG 147          1HH1      ARG 147 136.313  -1.945  12.586
  513   2HH1  ARG 147          2HH1      ARG 147 136.889  -2.680  14.043
  514   1HH2  ARG 147          1HH2      ARG 147 139.983  -3.606  12.707
  515   2HH2  ARG 147          2HH2      ARG 147 138.972  -3.621  14.113
  516    H    ILE 148           H        ILE 148 135.305   0.178   6.165
  517    HA   ILE 148           HA       ILE 148 134.867   3.070   5.785
  518    HB   ILE 148           HB       ILE 148 133.773   0.893   4.004
  519   1HG1  ILE 148          2HG1      ILE 148 136.111   2.757   3.535
  520   2HG1  ILE 148          1HG1      ILE 148 136.218   1.018   3.795
  521   1HG2  ILE 148          1HG2      ILE 148 133.840   3.892   3.698
  522   2HG2  ILE 148          2HG2      ILE 148 132.423   2.920   4.090
  523   3HG2  ILE 148          3HG2      ILE 148 133.202   2.747   2.517
  524   1HD1  ILE 148          1HD1      ILE 148 134.644   2.171   1.523
  525   2HD1  ILE 148          2HD1      ILE 148 135.280   0.537   1.715
  526   3HD1  ILE 148          3HD1      ILE 148 136.380   1.880   1.405
  527    H    ASP 149           H        ASP 149 132.801   3.869   6.169
  528    HA   ASP 149           HA       ASP 149 130.834   1.988   7.274
  529   1HB   ASP 149          2HB       ASP 149 130.349   3.539   9.117
  530   2HB   ASP 149          1HB       ASP 149 132.023   2.992   9.170
  531    H    TYR 150           H        TYR 150 128.786   3.563   7.882
  532    HA   TYR 150           HA       TYR 150 127.652   4.223   5.411
  533   1HB   TYR 150          2HB       TYR 150 126.358   3.643   7.447
  534   2HB   TYR 150          1HB       TYR 150 126.798   5.199   8.144
  535    HD1  TYR 150           HD1      TYR 150 125.566   7.143   7.637
  536    HD2  TYR 150           HD2      TYR 150 124.958   3.612   5.343
  537    HE1  TYR 150           HE1      TYR 150 123.607   8.179   6.571
  538    HE2  TYR 150           HE2      TYR 150 122.998   4.639   4.269
  539    HH   TYR 150           HH       TYR 150 122.065   6.810   3.830
  540    H    ASP 151           H        ASP 151 128.987   6.318   7.951
  541    HA   ASP 151           HA       ASP 151 128.428   8.775   6.744
  542   1HB   ASP 151          2HB       ASP 151 130.538   7.889   8.698
  543   2HB   ASP 151          1HB       ASP 151 130.478   9.549   8.114
  544    H    GLU 152           H        GLU 152 131.352   6.760   6.545
  545    HA   GLU 152           HA       GLU 152 132.712   8.500   4.755
  546   1HB   GLU 152          2HB       GLU 152 133.203   5.545   5.132
  547   2HB   GLU 152          1HB       GLU 152 134.344   6.750   4.549
  548   1HG   GLU 152          2HG       GLU 152 134.358   7.815   6.736
  549   2HG   GLU 152          1HG       GLU 152 133.185   6.638   7.326
  550    H    PHE 153           H        PHE 153 130.765   5.579   4.322
  551    HA   PHE 153           HA       PHE 153 131.180   5.261   1.564
  552   1HB   PHE 153          2HB       PHE 153 130.169   3.546   3.059
  553   2HB   PHE 153          1HB       PHE 153 128.709   4.525   3.144
  554    HD1  PHE 153           HD1      PHE 153 126.990   4.040   1.702
  555    HD2  PHE 153           HD2      PHE 153 130.964   2.983   0.606
  556    HE1  PHE 153           HE1      PHE 153 126.135   2.938  -0.325
  557    HE2  PHE 153           HE2      PHE 153 130.116   1.879  -1.423
  558    HZ   PHE 153           HZ       PHE 153 127.698   1.856  -1.891
  559    H    LEU 154           H        LEU 154 128.917   7.237   3.386
  560    HA   LEU 154           HA       LEU 154 127.221   7.970   1.271
  561   1HB   LEU 154          2HB       LEU 154 127.628   8.709   4.014
  562   2HB   LEU 154          1HB       LEU 154 127.411  10.157   3.049
  563    HG   LEU 154           HG       LEU 154 125.300   9.324   4.015
  564   1HD1  LEU 154          1HD1      LEU 154 124.027   9.250   1.836
  565   2HD1  LEU 154          2HD1      LEU 154 125.590   9.320   1.022
  566   3HD1  LEU 154          3HD1      LEU 154 125.080  10.645   2.068
  567   1HD2  LEU 154          1HD2      LEU 154 124.301   7.271   3.063
  568   2HD2  LEU 154          2HD2      LEU 154 125.743   6.954   4.029
  569   3HD2  LEU 154          3HD2      LEU 154 125.838   6.925   2.269
  570    H    GLU 155           H        GLU 155 130.220   9.397   2.480
  571    HA   GLU 155           HA       GLU 155 130.162  11.635   0.712
  572   1HB   GLU 155          2HB       GLU 155 132.498  10.415   2.195
  573   2HB   GLU 155          1HB       GLU 155 132.477  12.002   1.438
  574   1HG   GLU 155          2HG       GLU 155 130.625  12.634   2.979
  575   2HG   GLU 155          1HG       GLU 155 130.858  11.092   3.802
  576    H    PHE 156           H        PHE 156 131.787   8.489   0.666
  577    HA   PHE 156           HA       PHE 156 133.275   8.924  -1.690
  578   1HB   PHE 156          2HB       PHE 156 133.683   7.099  -0.014
  579   2HB   PHE 156          1HB       PHE 156 132.265   6.271  -0.648
  580    HD1  PHE 156           HD1      PHE 156 132.797   4.488  -1.974
  581    HD2  PHE 156           HD2      PHE 156 135.237   7.970  -2.144
  582    HE1  PHE 156           HE1      PHE 156 134.191   3.422  -3.698
  583    HE2  PHE 156           HE2      PHE 156 136.636   6.911  -3.869
  584    HZ   PHE 156           HZ       PHE 156 136.112   4.634  -4.648
  585    H    MET 157           H        MET 157 130.079   7.508  -1.124
  586    HA   MET 157           HA       MET 157 129.625   6.836  -3.856
  587   1HB   MET 157          2HB       MET 157 128.005   6.884  -1.361
  588   2HB   MET 157          1HB       MET 157 127.135   6.904  -2.888
  589   1HG   MET 157          2HG       MET 157 129.194   4.847  -2.126
  590   2HG   MET 157          1HG       MET 157 127.453   4.643  -1.940
  591   1HE   MET 157          1HE       MET 157 126.210   4.697  -5.640
  592   2HE   MET 157          2HE       MET 157 126.224   5.969  -4.417
  593   3HE   MET 157          3HE       MET 157 125.757   4.325  -3.977
  594    H    LYS 158           H        LYS 158 128.784   9.585  -1.808
  595    HA   LYS 158           HA       LYS 158 127.234  10.885  -3.852
  596   1HB   LYS 158          2HB       LYS 158 126.887  11.177  -1.372
  597   2HB   LYS 158          1HB       LYS 158 128.376  12.111  -1.339
  598   1HG   LYS 158          2HG       LYS 158 127.066  13.880  -1.671
  599   2HG   LYS 158          1HG       LYS 158 126.975  13.331  -3.345
  600   1HD   LYS 158          2HD       LYS 158 124.878  12.398  -3.063
  601   2HD   LYS 158          1HD       LYS 158 125.078  12.224  -1.318
  602   1HE   LYS 158          2HE       LYS 158 123.501  13.978  -1.710
  603   2HE   LYS 158          1HE       LYS 158 124.998  14.709  -1.134
  604   1HZ   LYS 158          1HZ       LYS 158 125.376  15.710  -3.107
  605   2HZ   LYS 158          2HZ       LYS 158 123.695  15.589  -3.255
  606   3HZ   LYS 158          3HZ       LYS 158 124.694  14.458  -4.019
  607    H    GLY 159           H        GLY 159 129.125  10.556  -5.405
  608   1HA   GLY 159          2HA       GLY 159 130.270  12.105  -6.837
  609   2HA   GLY 159          1HA       GLY 159 130.696  13.046  -5.415
  610    H    VAL 160           H        VAL 160 131.287   9.960  -7.046
  611    HA   VAL 160           HA       VAL 160 133.618   9.366  -5.486
  612    HB   VAL 160           HB       VAL 160 132.828   8.147  -8.133
  613   1HG1  VAL 160          1HG1      VAL 160 135.123   7.691  -7.376
  614   2HG1  VAL 160          2HG1      VAL 160 134.123   6.238  -7.384
  615   3HG1  VAL 160          3HG1      VAL 160 134.484   7.052  -5.862
  616   1HG2  VAL 160          1HG2      VAL 160 132.129   7.023  -5.438
  617   2HG2  VAL 160          2HG2      VAL 160 131.486   6.584  -7.021
  618   3HG2  VAL 160          3HG2      VAL 160 131.049   8.128  -6.289
  619    H    GLU 161           H        GLU 161 133.189  10.105  -8.954
  620    HA   GLU 161           HA       GLU 161 135.953  10.537  -9.412
  621   1HB   GLU 161          2HB       GLU 161 135.191  11.515 -11.576
  622   2HB   GLU 161          1HB       GLU 161 134.538   9.915 -11.252
  623   1HG   GLU 161          2HG       GLU 161 132.671  11.683 -10.189
  624   2HG   GLU 161          1HG       GLU 161 133.169  12.404 -11.717
  Start of MODEL   13
    1   1H    MET  81          1HT       MET  81  94.014  11.381  -7.502
    2   2H    MET  81          2HT       MET  81  93.304  12.932  -7.311
    3   3H    MET  81          3HT       MET  81  92.342  11.520  -7.157
    4    HA   MET  81           HA       MET  81  92.981  12.645  -5.063
    5   1HB   MET  81          2HB       MET  81  93.381   9.776  -5.790
    6   2HB   MET  81          1HB       MET  81  93.810  10.287  -4.164
    7   1HG   MET  81          2HG       MET  81  91.693  10.207  -3.543
    8   2HG   MET  81          1HG       MET  81  91.247  11.349  -4.807
    9   1HE   MET  81          1HE       MET  81  92.263   7.944  -3.943
   10   2HE   MET  81          2HE       MET  81  91.947   6.987  -5.390
   11   3HE   MET  81          3HE       MET  81  90.711   7.130  -4.141
   12    H    VAL  82           H        VAL  82  94.585  13.211  -3.644
   13    HA   VAL  82           HA       VAL  82  97.337  12.971  -4.660
   14    HB   VAL  82           HB       VAL  82  96.349  14.962  -2.620
   15   1HG1  VAL  82          1HG1      VAL  82  98.430  15.814  -2.597
   16   2HG1  VAL  82          2HG1      VAL  82  98.667  15.553  -4.325
   17   3HG1  VAL  82          3HG1      VAL  82  98.892  14.219  -3.195
   18   1HG2  VAL  82          1HG2      VAL  82  95.184  15.814  -4.358
   19   2HG2  VAL  82          2HG2      VAL  82  96.161  14.975  -5.563
   20   3HG2  VAL  82          3HG2      VAL  82  96.761  16.457  -4.821
   21    H    ARG  83           H        ARG  83  95.237  12.261  -1.993
   22    HA   ARG  83           HA       ARG  83  97.480  11.498  -0.281
   23   1HB   ARG  83          2HB       ARG  83  94.506  11.640   0.227
   24   2HB   ARG  83          1HB       ARG  83  95.673  11.062   1.409
   25   1HG   ARG  83          2HG       ARG  83  96.814  13.286   1.231
   26   2HG   ARG  83          1HG       ARG  83  95.447  13.829   0.254
   27   1HD   ARG  83          2HD       ARG  83  94.900  14.525   2.411
   28   2HD   ARG  83          1HD       ARG  83  93.990  13.030   2.206
   29    HE   ARG  83           HE       ARG  83  96.579  12.697   3.430
   30   1HH1  ARG  83          1HH1      ARG  83  93.187  13.312   3.981
   31   2HH1  ARG  83          2HH1      ARG  83  93.223  12.744   5.616
   32   1HH2  ARG  83          1HH2      ARG  83  96.627  11.953   5.581
   33   2HH2  ARG  83          2HH2      ARG  83  95.174  11.973   6.525
   34    H    CYS  84           H        CYS  84  97.213   9.962  -2.590
   35    HA   CYS  84           HA       CYS  84  96.695   7.350  -1.400
   36   1HB   CYS  84          2HB       CYS  84  95.170   8.531  -3.656
   37   2HB   CYS  84          1HB       CYS  84  95.648   6.845  -3.825
   38    HG   CYS  84           HG       CYS  84  94.284   6.341  -1.630
   39    H    MET  85           H        MET  85  97.723   9.058  -4.346
   40    HA   MET  85           HA       MET  85  99.430   6.913  -5.186
   41   1HB   MET  85          2HB       MET  85  98.666   9.580  -6.196
   42   2HB   MET  85          1HB       MET  85 100.283   9.047  -6.637
   43   1HG   MET  85          2HG       MET  85  98.670   6.840  -7.115
   44   2HG   MET  85          1HG       MET  85  97.716   8.217  -7.663
   45   1HE   MET  85          1HE       MET  85  99.547  10.293  -9.245
   46   2HE   MET  85          2HE       MET  85  97.999   9.504  -9.543
   47   3HE   MET  85          3HE       MET  85  99.273   9.436 -10.762
   48    H    LYS  86           H        LYS  86 101.772   7.910  -5.943
   49    HA   LYS  86           HA       LYS  86 103.242   8.072  -3.522
   50   1HB   LYS  86          2HB       LYS  86 104.160   8.613  -6.351
   51   2HB   LYS  86          1HB       LYS  86 105.208   8.328  -4.968
   52   1HG   LYS  86          2HG       LYS  86 104.675   6.078  -4.862
   53   2HG   LYS  86          1HG       LYS  86 103.177   6.287  -5.771
   54   1HD   LYS  86          2HD       LYS  86 105.631   7.041  -7.208
   55   2HD   LYS  86          1HD       LYS  86 105.483   5.326  -6.822
   56   1HE   LYS  86          2HE       LYS  86 103.593   5.060  -8.116
   57   2HE   LYS  86          1HE       LYS  86 103.153   6.764  -8.007
   58   1HZ   LYS  86          1HZ       LYS  86 104.938   7.316  -9.502
   59   2HZ   LYS  86          2HZ       LYS  86 103.960   6.134 -10.218
   60   3HZ   LYS  86          3HZ       LYS  86 105.457   5.705  -9.553
   61    H    ASP  87           H        ASP  87 102.695   9.871  -2.342
   62    HA   ASP  87           HA       ASP  87 102.520  12.486  -3.443
   63   1HB   ASP  87          2HB       ASP  87 102.586  13.203  -1.022
   64   2HB   ASP  87          1HB       ASP  87 101.322  12.045  -1.422
   65    H    ASP  88           H        ASP  88 105.098  10.620  -1.970
   66    HA   ASP  88           HA       ASP  88 106.906  12.913  -2.067
   67   1HB   ASP  88          2HB       ASP  88 106.789  10.408  -0.563
   68   2HB   ASP  88          1HB       ASP  88 108.396  10.750  -1.198
   69    H    SER  89           H        SER  89 108.657  13.052  -3.406
   70    HA   SER  89           HA       SER  89 108.570  11.498  -5.814
   71   1HB   SER  89          2HB       SER  89 109.621  14.012  -5.028
   72   2HB   SER  89          1HB       SER  89 110.972  13.055  -5.635
   73    HG   SER  89           HG       SER  89 109.607  12.621  -7.500
   74    H    LYS  90           H        LYS  90 109.524   9.608  -6.126
   75    HA   LYS  90           HA       LYS  90 111.307   8.472  -4.217
   76   1HB   LYS  90          2HB       LYS  90 109.893   7.605  -6.613
   77   2HB   LYS  90          1HB       LYS  90 111.508   6.917  -6.514
   78   1HG   LYS  90          2HG       LYS  90 111.041   5.754  -4.580
   79   2HG   LYS  90          1HG       LYS  90 109.711   6.825  -4.133
   80   1HD   LYS  90          2HD       LYS  90 108.614   4.900  -4.831
   81   2HD   LYS  90          1HD       LYS  90 108.574   5.919  -6.271
   82   1HE   LYS  90          2HE       LYS  90 109.876   4.516  -7.441
   83   2HE   LYS  90          1HE       LYS  90 110.960   4.239  -6.078
   84   1HZ   LYS  90          1HZ       LYS  90 108.447   2.842  -6.748
   85   2HZ   LYS  90          2HZ       LYS  90 109.057   2.816  -5.171
   86   3HZ   LYS  90          3HZ       LYS  90 109.977   2.186  -6.442
   87    H    GLY  91           H        GLY  91 112.963  10.145  -4.235
   88   1HA   GLY  91          2HA       GLY  91 114.702  10.101  -6.606
   89   2HA   GLY  91          1HA       GLY  91 114.738  11.313  -5.337
   90    H    LYS  92           H        LYS  92 117.102  10.343  -6.055
   91    HA   LYS  92           HA       LYS  92 117.858   8.028  -4.530
   92   1HB   LYS  92          2HB       LYS  92 119.388  10.066  -6.130
   93   2HB   LYS  92          1HB       LYS  92 120.210   8.841  -5.175
   94   1HG   LYS  92          2HG       LYS  92 119.896   7.303  -6.738
   95   2HG   LYS  92          1HG       LYS  92 118.167   7.650  -6.818
   96   1HD   LYS  92          2HD       LYS  92 119.901   9.671  -8.064
   97   2HD   LYS  92          1HD       LYS  92 119.922   8.088  -8.843
   98   1HE   LYS  92          2HE       LYS  92 117.431   8.162  -8.900
   99   2HE   LYS  92          1HE       LYS  92 117.513   9.814  -8.291
  100   1HZ   LYS  92          1HZ       LYS  92 117.390   9.300 -10.848
  101   2HZ   LYS  92          2HZ       LYS  92 119.066   9.157 -10.682
  102   3HZ   LYS  92          3HZ       LYS  92 118.296  10.602 -10.260
  103    H    THR  93           H        THR  93 117.448   8.405  -2.377
  104    HA   THR  93           HA       THR  93 118.725  10.728  -1.126
  105    HB   THR  93           HB       THR  93 117.357   9.488   0.889
  106    HG1  THR  93           HG1      THR  93 115.335   8.916  -0.058
  107   1HG2  THR  93          1HG2      THR  93 116.778  11.655   0.819
  108   2HG2  THR  93          2HG2      THR  93 115.381  11.032  -0.058
  109   3HG2  THR  93          3HG2      THR  93 116.750  11.705  -0.944
  110    H    GLU  94           H        GLU  94 119.233   9.955   1.375
  111    HA   GLU  94           HA       GLU  94 121.656   8.541   1.161
  112   1HB   GLU  94          2HB       GLU  94 120.180   9.926   3.215
  113   2HB   GLU  94          1HB       GLU  94 120.851   8.432   3.855
  114   1HG   GLU  94          2HG       GLU  94 122.835   9.380   4.033
  115   2HG   GLU  94          1HG       GLU  94 122.855   9.701   2.301
  116    H    GLU  95           H        GLU  95 118.408   7.540   2.033
  117    HA   GLU  95           HA       GLU  95 118.945   5.064   3.179
  118   1HB   GLU  95          2HB       GLU  95 116.651   4.430   2.279
  119   2HB   GLU  95          1HB       GLU  95 116.725   5.856   3.306
  120   1HG   GLU  95          2HG       GLU  95 117.095   6.803   0.709
  121   2HG   GLU  95          1HG       GLU  95 115.818   5.594   0.590
  122    H    GLU  96           H        GLU  96 119.177   6.080  -0.119
  123    HA   GLU  96           HA       GLU  96 118.996   3.534  -1.351
  124   1HB   GLU  96          2HB       GLU  96 120.532   5.923  -2.376
  125   2HB   GLU  96          1HB       GLU  96 119.861   4.599  -3.320
  126   1HG   GLU  96          2HG       GLU  96 117.953   6.152  -1.691
  127   2HG   GLU  96          1HG       GLU  96 118.679   6.980  -3.068
  128    H    LEU  97           H        LEU  97 121.845   5.570  -0.662
  129    HA   LEU  97           HA       LEU  97 123.770   3.666  -1.353
  130   1HB   LEU  97          2HB       LEU  97 123.839   6.038   0.496
  131   2HB   LEU  97          1HB       LEU  97 125.255   5.040   0.219
  132    HG   LEU  97           HG       LEU  97 123.759   6.431  -1.998
  133   1HD1  LEU  97          1HD1      LEU  97 125.982   7.377  -0.234
  134   2HD1  LEU  97          2HD1      LEU  97 124.543   8.237  -0.780
  135   3HD1  LEU  97          3HD1      LEU  97 125.866   7.930  -1.905
  136   1HD2  LEU  97          1HD2      LEU  97 126.619   5.641  -2.134
  137   2HD2  LEU  97          2HD2      LEU  97 125.400   5.711  -3.408
  138   3HD2  LEU  97          3HD2      LEU  97 125.403   4.370  -2.263
  139    H    SER  98           H        SER  98 121.927   4.100   1.576
  140    HA   SER  98           HA       SER  98 123.499   2.651   3.372
  141   1HB   SER  98          2HB       SER  98 121.615   2.590   4.779
  142   2HB   SER  98          1HB       SER  98 121.364   4.039   3.807
  143    HG   SER  98           HG       SER  98 119.465   2.975   3.703
  144    H    ASP  99           H        ASP  99 121.360   1.584   0.831
  145    HA   ASP  99           HA       ASP  99 121.235  -1.142   1.723
  146   1HB   ASP  99          2HB       ASP  99 120.274   0.391  -0.641
  147   2HB   ASP  99          1HB       ASP  99 120.466  -1.351  -0.829
  148    H    LEU 100           H        LEU 100 123.196   0.711  -0.525
  149    HA   LEU 100           HA       LEU 100 124.455  -1.476  -1.797
  150   1HB   LEU 100          2HB       LEU 100 125.285   1.394  -1.412
  151   2HB   LEU 100          1HB       LEU 100 126.237   0.248  -2.339
  152    HG   LEU 100           HG       LEU 100 123.360   0.829  -3.003
  153   1HD1  LEU 100          1HD1      LEU 100 125.839   2.315  -3.803
  154   2HD1  LEU 100          2HD1      LEU 100 124.310   2.955  -3.200
  155   3HD1  LEU 100          3HD1      LEU 100 124.405   2.282  -4.828
  156   1HD2  LEU 100          1HD2      LEU 100 125.649  -0.253  -4.642
  157   2HD2  LEU 100          2HD2      LEU 100 123.983  -0.041  -5.181
  158   3HD2  LEU 100          3HD2      LEU 100 124.360  -1.218  -3.922
  159    H    PHE 101           H        PHE 101 125.091   0.248   1.180
  160    HA   PHE 101           HA       PHE 101 127.701  -0.820   1.600
  161   1HB   PHE 101          2HB       PHE 101 126.991   1.258   2.675
  162   2HB   PHE 101          1HB       PHE 101 125.740   0.392   3.560
  163    HD1  PHE 101           HD1      PHE 101 129.411   0.654   3.122
  164    HD2  PHE 101           HD2      PHE 101 126.202  -0.598   5.620
  165    HE1  PHE 101           HE1      PHE 101 131.003   0.226   4.947
  166    HE2  PHE 101           HE2      PHE 101 127.789  -1.028   7.450
  167    HZ   PHE 101           HZ       PHE 101 130.193  -0.615   7.115
  168    H    ARG 102           H        ARG 102 124.462  -1.895   2.332
  169    HA   ARG 102           HA       ARG 102 125.073  -3.790   4.321
  170   1HB   ARG 102          2HB       ARG 102 122.780  -2.932   3.684
  171   2HB   ARG 102          1HB       ARG 102 122.843  -4.012   2.298
  172   1HG   ARG 102          2HG       ARG 102 123.366  -5.809   4.153
  173   2HG   ARG 102          1HG       ARG 102 122.541  -4.639   5.186
  174   1HD   ARG 102          2HD       ARG 102 120.591  -4.701   3.749
  175   2HD   ARG 102          1HD       ARG 102 121.419  -5.783   2.630
  176    HE   ARG 102           HE       ARG 102 120.859  -7.524   3.988
  177   1HH1  ARG 102          1HH1      ARG 102 120.656  -4.578   5.846
  178   2HH1  ARG 102          2HH1      ARG 102 120.005  -5.357   7.247
  179   1HH2  ARG 102          1HH2      ARG 102 120.002  -8.554   5.831
  180   2HH2  ARG 102          2HH2      ARG 102 119.634  -7.615   7.239
  181    H    MET 103           H        MET 103 124.476  -4.286   0.840
  182    HA   MET 103           HA       MET 103 125.159  -6.996   0.779
  183   1HB   MET 103          2HB       MET 103 125.580  -6.583  -1.681
  184   2HB   MET 103          1HB       MET 103 123.998  -6.102  -1.086
  185   1HG   MET 103          2HG       MET 103 124.379  -4.174  -2.116
  186   2HG   MET 103          1HG       MET 103 125.460  -3.815  -0.772
  187   1HE   MET 103          1HE       MET 103 125.601  -4.504  -4.867
  188   2HE   MET 103          2HE       MET 103 125.177  -5.885  -3.853
  189   3HE   MET 103          3HE       MET 103 126.753  -5.820  -4.645
  190    H    PHE 104           H        PHE 104 127.155  -4.118   0.230
  191    HA   PHE 104           HA       PHE 104 129.525  -5.425  -0.485
  192   1HB   PHE 104          2HB       PHE 104 128.717  -2.783  -0.076
  193   2HB   PHE 104          1HB       PHE 104 130.018  -3.030   1.085
  194    HD1  PHE 104           HD1      PHE 104 132.151  -2.574   0.388
  195    HD2  PHE 104           HD2      PHE 104 129.258  -3.768  -2.494
  196    HE1  PHE 104           HE1      PHE 104 133.808  -2.258  -1.402
  197    HE2  PHE 104           HE2      PHE 104 130.910  -3.456  -4.290
  198    HZ   PHE 104           HZ       PHE 104 133.190  -2.700  -3.745
  199    H    ASP 105           H        ASP 105 128.095  -4.777   2.645
  200    HA   ASP 105           HA       ASP 105 130.435  -5.531   4.134
  201   1HB   ASP 105          2HB       ASP 105 128.347  -4.015   4.797
  202   2HB   ASP 105          1HB       ASP 105 127.730  -5.555   5.387
  203    H    LYS 106           H        LYS 106 131.104  -7.546   4.410
  204    HA   LYS 106           HA       LYS 106 129.571  -9.803   3.635
  205   1HB   LYS 106          2HB       LYS 106 132.137  -9.520   3.708
  206   2HB   LYS 106          1HB       LYS 106 131.995  -9.943   5.410
  207   1HG   LYS 106          2HG       LYS 106 132.467 -11.969   4.405
  208   2HG   LYS 106          1HG       LYS 106 130.710 -12.009   4.562
  209   1HD   LYS 106          2HD       LYS 106 130.860 -10.901   2.149
  210   2HD   LYS 106          1HD       LYS 106 132.402 -11.759   2.135
  211   1HE   LYS 106          2HE       LYS 106 130.750 -13.682   3.093
  212   2HE   LYS 106          1HE       LYS 106 129.651 -12.797   2.036
  213   1HZ   LYS 106          1HZ       LYS 106 131.788 -13.020   0.464
  214   2HZ   LYS 106          2HZ       LYS 106 130.529 -14.148   0.488
  215   3HZ   LYS 106          3HZ       LYS 106 131.945 -14.444   1.366
  216    H    ASN 107           H        ASN 107 130.487  -8.471   6.791
  217    HA   ASN 107           HA       ASN 107 128.871 -10.476   8.154
  218   1HB   ASN 107          2HB       ASN 107 130.719  -8.303   9.138
  219   2HB   ASN 107          1HB       ASN 107 129.720  -9.262  10.225
  220   1HD2  ASN 107          1HD2      ASN 107 130.713 -10.917  11.093
  221   2HD2  ASN 107          2HD2      ASN 107 132.015 -11.813  10.396
  222    H    ALA 108           H        ALA 108 128.719  -7.151   7.181
  223    HA   ALA 108           HA       ALA 108 127.055  -5.602   7.269
  224   1HB   ALA 108          1HB       ALA 108 125.039  -7.439   8.396
  225   2HB   ALA 108          2HB       ALA 108 125.754  -7.918   6.857
  226   3HB   ALA 108          3HB       ALA 108 124.942  -6.358   7.006
  227    H    ASP 109           H        ASP 109 128.783  -5.821   9.466
  228    HA   ASP 109           HA       ASP 109 127.131  -5.532  11.848
  229   1HB   ASP 109          2HB       ASP 109 129.361  -5.244  12.993
  230   2HB   ASP 109          1HB       ASP 109 129.132  -6.793  12.188
  231    H    GLY 110           H        GLY 110 128.423  -3.559   9.407
  232   1HA   GLY 110          2HA       GLY 110 127.482  -1.239   9.544
  233   2HA   GLY 110          1HA       GLY 110 128.189  -1.184  11.149
  234    H    TYR 111           H        TYR 111 130.496  -2.823   9.831
  235    HA   TYR 111           HA       TYR 111 131.764  -0.641   8.345
  236   1HB   TYR 111          2HB       TYR 111 133.014  -2.046  10.715
  237   2HB   TYR 111          1HB       TYR 111 133.837  -0.900   9.663
  238    HD1  TYR 111           HD1      TYR 111 133.865   1.349  10.235
  239    HD2  TYR 111           HD2      TYR 111 130.860  -1.165  11.897
  240    HE1  TYR 111           HE1      TYR 111 133.108   3.205  11.659
  241    HE2  TYR 111           HE2      TYR 111 130.096   0.686  13.326
  242    HH   TYR 111           HH       TYR 111 130.486   3.622  12.900
  243    H    ILE 112           H        ILE 112 133.523  -1.292   7.014
  244    HA   ILE 112           HA       ILE 112 133.761  -4.200   6.617
  245    HB   ILE 112           HB       ILE 112 133.677  -2.192   4.365
  246   1HG1  ILE 112          2HG1      ILE 112 131.508  -4.152   5.129
  247   2HG1  ILE 112          1HG1      ILE 112 131.491  -2.460   5.618
  248   1HG2  ILE 112          1HG2      ILE 112 134.177  -5.088   4.577
  249   2HG2  ILE 112          2HG2      ILE 112 134.743  -3.920   3.382
  250   3HG2  ILE 112          3HG2      ILE 112 133.114  -4.583   3.263
  251   1HD1  ILE 112          1HD1      ILE 112 130.477  -1.973   3.719
  252   2HD1  ILE 112          2HD1      ILE 112 130.634  -3.641   3.168
  253   3HD1  ILE 112          3HD1      ILE 112 131.923  -2.479   2.845
  254    H    ASP 113           H        ASP 113 135.770  -4.958   5.977
  255    HA   ASP 113           HA       ASP 113 137.926  -2.974   5.755
  256   1HB   ASP 113          2HB       ASP 113 139.364  -4.396   7.176
  257   2HB   ASP 113          1HB       ASP 113 137.958  -3.799   8.050
  258    H    LEU 114           H        LEU 114 140.071  -4.438   5.308
  259    HA   LEU 114           HA       LEU 114 139.794  -5.332   2.669
  260   1HB   LEU 114          2HB       LEU 114 141.941  -5.389   4.718
  261   2HB   LEU 114          1HB       LEU 114 142.117  -6.474   3.350
  262    HG   LEU 114           HG       LEU 114 141.429  -3.747   2.553
  263   1HD1  LEU 114          1HD1      LEU 114 144.221  -4.008   3.534
  264   2HD1  LEU 114          2HD1      LEU 114 142.957  -3.619   4.700
  265   3HD1  LEU 114          3HD1      LEU 114 143.229  -2.568   3.309
  266   1HD2  LEU 114          1HD2      LEU 114 142.458  -5.902   1.334
  267   2HD2  LEU 114          2HD2      LEU 114 143.950  -5.056   1.743
  268   3HD2  LEU 114          3HD2      LEU 114 142.720  -4.253   0.767
  269    H    GLU 115           H        GLU 115 139.517  -7.009   5.704
  270    HA   GLU 115           HA       GLU 115 139.799  -9.644   4.641
  271   1HB   GLU 115          2HB       GLU 115 138.990  -8.456   7.244
  272   2HB   GLU 115          1HB       GLU 115 138.477 -10.105   6.916
  273   1HG   GLU 115          2HG       GLU 115 140.716 -10.849   6.696
  274   2HG   GLU 115          1HG       GLU 115 141.331  -9.197   6.690
  275    H    GLU 116           H        GLU 116 136.933  -8.041   6.034
  276    HA   GLU 116           HA       GLU 116 135.065  -9.877   5.079
  277   1HB   GLU 116          2HB       GLU 116 134.951  -7.087   6.100
  278   2HB   GLU 116          1HB       GLU 116 133.540  -7.689   5.243
  279   1HG   GLU 116          2HG       GLU 116 132.896  -8.917   6.975
  280   2HG   GLU 116          1HG       GLU 116 134.507  -9.601   7.186
  281    H    LEU 117           H        LEU 117 136.696  -7.303   3.445
  282    HA   LEU 117           HA       LEU 117 134.799  -7.077   1.298
  283   1HB   LEU 117          2HB       LEU 117 136.309  -5.231   2.037
  284   2HB   LEU 117          1HB       LEU 117 137.663  -6.138   1.391
  285    HG   LEU 117           HG       LEU 117 136.778  -5.951  -0.858
  286   1HD1  LEU 117          1HD1      LEU 117 134.778  -4.405  -1.181
  287   2HD1  LEU 117          2HD1      LEU 117 134.436  -4.687   0.526
  288   3HD1  LEU 117          3HD1      LEU 117 134.453  -6.040  -0.605
  289   1HD2  LEU 117          1HD2      LEU 117 136.451  -3.158   0.019
  290   2HD2  LEU 117          2HD2      LEU 117 137.546  -3.856  -1.175
  291   3HD2  LEU 117          3HD2      LEU 117 137.934  -3.957   0.542
  292    H    LYS 118           H        LYS 118 138.004  -8.562   1.696
  293    HA   LYS 118           HA       LYS 118 138.271  -9.514  -0.928
  294   1HB   LYS 118          2HB       LYS 118 139.985 -10.996  -0.050
  295   2HB   LYS 118          1HB       LYS 118 140.134  -9.401   0.675
  296   1HG   LYS 118          2HG       LYS 118 139.488 -10.130   2.747
  297   2HG   LYS 118          1HG       LYS 118 138.558 -11.484   2.103
  298   1HD   LYS 118          2HD       LYS 118 140.654 -12.612   1.490
  299   2HD   LYS 118          1HD       LYS 118 141.568 -11.265   2.172
  300   1HE   LYS 118          2HE       LYS 118 140.920 -11.778   4.356
  301   2HE   LYS 118          1HE       LYS 118 139.564 -12.767   3.818
  302   1HZ   LYS 118          1HZ       LYS 118 141.019 -14.399   4.346
  303   2HZ   LYS 118          2HZ       LYS 118 142.391 -13.455   4.045
  304   3HZ   LYS 118          3HZ       LYS 118 141.535 -14.141   2.756
  305    H    ILE 119           H        ILE 119 136.523 -10.775   1.818
  306    HA   ILE 119           HA       ILE 119 136.166 -13.414   0.841
  307    HB   ILE 119           HB       ILE 119 134.363 -11.905   2.735
  308   1HG1  ILE 119          2HG1      ILE 119 136.464 -13.807   3.670
  309   2HG1  ILE 119          1HG1      ILE 119 136.963 -12.186   3.201
  310   1HG2  ILE 119          1HG2      ILE 119 134.745 -14.791   3.061
  311   2HG2  ILE 119          2HG2      ILE 119 133.928 -14.326   1.570
  312   3HG2  ILE 119          3HG2      ILE 119 133.272 -13.825   3.129
  313   1HD1  ILE 119          1HD1      ILE 119 134.690 -11.964   4.884
  314   2HD1  ILE 119          2HD1      ILE 119 136.341 -11.418   5.173
  315   3HD1  ILE 119          3HD1      ILE 119 135.855 -13.046   5.647
  316    H    MET 120           H        MET 120 134.461 -10.397   0.353
  317    HA   MET 120           HA       MET 120 132.078 -11.421  -0.731
  318   1HB   MET 120          2HB       MET 120 132.507  -9.044  -0.003
  319   2HB   MET 120          1HB       MET 120 133.406  -8.818  -1.497
  320   1HG   MET 120          2HG       MET 120 131.249  -9.627  -2.652
  321   2HG   MET 120          1HG       MET 120 130.477  -9.264  -1.109
  322   1HE   MET 120          1HE       MET 120 132.452  -6.218  -3.942
  323   2HE   MET 120          2HE       MET 120 132.224  -7.936  -4.270
  324   3HE   MET 120          3HE       MET 120 133.422  -7.416  -3.084
  325    H    LEU 121           H        LEU 121 135.198 -10.674  -2.188
  326    HA   LEU 121           HA       LEU 121 134.314 -11.145  -4.874
  327   1HB   LEU 121          2HB       LEU 121 136.890 -10.545  -3.530
  328   2HB   LEU 121          1HB       LEU 121 136.978 -11.353  -5.084
  329    HG   LEU 121           HG       LEU 121 137.175  -8.896  -5.258
  330   1HD1  LEU 121          1HD1      LEU 121 134.588  -9.419  -6.569
  331   2HD1  LEU 121          2HD1      LEU 121 135.877 -10.574  -6.908
  332   3HD1  LEU 121          3HD1      LEU 121 136.116  -8.859  -7.247
  333   1HD2  LEU 121          1HD2      LEU 121 134.293  -8.514  -4.751
  334   2HD2  LEU 121          2HD2      LEU 121 135.653  -7.432  -4.455
  335   3HD2  LEU 121          3HD2      LEU 121 135.312  -8.748  -3.331
  336    H    GLN 122           H        GLN 122 135.671 -13.075  -2.309
  337    HA   GLN 122           HA       GLN 122 136.652 -15.245  -3.754
  338   1HB   GLN 122          2HB       GLN 122 135.416 -15.071  -1.009
  339   2HB   GLN 122          1HB       GLN 122 136.097 -16.562  -1.648
  340   1HG   GLN 122          2HG       GLN 122 137.681 -14.022  -1.495
  341   2HG   GLN 122          1HG       GLN 122 137.577 -15.153  -0.146
  342   1HE2  GLN 122          1HE2      GLN 122 139.721 -15.711  -0.177
  343   2HE2  GLN 122          2HE2      GLN 122 140.439 -16.633  -1.450
  344    H    ALA 123           H        ALA 123 133.378 -14.350  -2.940
  345    HA   ALA 123           HA       ALA 123 132.189 -16.868  -3.555
  346   1HB   ALA 123          1HB       ALA 123 130.082 -15.729  -3.383
  347   2HB   ALA 123          2HB       ALA 123 130.871 -14.157  -3.529
  348   3HB   ALA 123          3HB       ALA 123 131.142 -15.153  -2.098
  349    H    THR 124           H        THR 124 132.863 -13.932  -5.375
  350    HA   THR 124           HA       THR 124 131.410 -14.747  -7.703
  351    HB   THR 124           HB       THR 124 132.269 -12.782  -8.739
  352    HG1  THR 124           HG1      THR 124 134.117 -11.851  -8.192
  353   1HG2  THR 124          1HG2      THR 124 131.667 -11.057  -7.299
  354   2HG2  THR 124          2HG2      THR 124 132.199 -11.941  -5.869
  355   3HG2  THR 124          3HG2      THR 124 130.743 -12.445  -6.725
  356    H    GLY 125           H        GLY 125 132.624 -14.802  -9.874
  357   1HA   GLY 125          2HA       GLY 125 134.538 -16.964  -9.700
  358   2HA   GLY 125          1HA       GLY 125 133.848 -16.294 -11.171
  359    H    GLU 126           H        GLU 126 134.608 -13.540 -10.345
  360    HA   GLU 126           HA       GLU 126 137.052 -13.358 -11.691
  361   1HB   GLU 126          2HB       GLU 126 135.832 -11.378  -9.759
  362   2HB   GLU 126          1HB       GLU 126 137.102 -11.025 -10.922
  363   1HG   GLU 126          2HG       GLU 126 134.950 -12.196 -12.338
  364   2HG   GLU 126          1HG       GLU 126 134.287 -10.954 -11.276
  365    H    THR 127           H        THR 127 139.156 -13.177 -11.037
  366    HA   THR 127           HA       THR 127 139.692 -13.940  -8.252
  367    HB   THR 127           HB       THR 127 142.003 -14.499  -9.213
  368    HG1  THR 127           HG1      THR 127 140.571 -14.435 -11.655
  369   1HG2  THR 127          1HG2      THR 127 139.500 -15.987  -9.682
  370   2HG2  THR 127          2HG2      THR 127 140.960 -16.455  -8.809
  371   3HG2  THR 127          3HG2      THR 127 140.925 -16.521 -10.571
  372    H    ILE 128           H        ILE 128 139.811 -12.045  -7.151
  373    HA   ILE 128           HA       ILE 128 141.513  -9.907  -8.210
  374    HB   ILE 128           HB       ILE 128 139.759  -9.785  -5.760
  375   1HG1  ILE 128          2HG1      ILE 128 138.350 -10.301  -7.676
  376   2HG1  ILE 128          1HG1      ILE 128 138.115  -8.621  -7.204
  377   1HG2  ILE 128          1HG2      ILE 128 140.824  -7.564  -7.495
  378   2HG2  ILE 128          2HG2      ILE 128 141.599  -8.118  -6.011
  379   3HG2  ILE 128          3HG2      ILE 128 139.983  -7.414  -5.952
  380   1HD1  ILE 128          1HD1      ILE 128 139.984  -9.430  -9.407
  381   2HD1  ILE 128          2HD1      ILE 128 139.330  -7.830  -9.054
  382   3HD1  ILE 128          3HD1      ILE 128 138.273  -9.097  -9.676
  383    H    THR 129           H        THR 129 143.463  -9.481  -7.387
  384    HA   THR 129           HA       THR 129 144.580 -11.198  -5.391
  385    HB   THR 129           HB       THR 129 146.042 -10.494  -7.131
  386    HG1  THR 129           HG1      THR 129 147.146 -10.559  -5.219
  387   1HG2  THR 129          1HG2      THR 129 145.028  -7.767  -6.540
  388   2HG2  THR 129          2HG2      THR 129 145.318  -8.557  -8.089
  389   3HG2  THR 129          3HG2      THR 129 146.676  -7.956  -7.138
  390    H    GLU 130           H        GLU 130 145.679 -10.411  -3.442
  391    HA   GLU 130           HA       GLU 130 143.939  -8.950  -1.783
  392   1HB   GLU 130          2HB       GLU 130 146.034 -10.627  -1.352
  393   2HB   GLU 130          1HB       GLU 130 146.769  -9.079  -0.956
  394   1HG   GLU 130          2HG       GLU 130 145.693  -8.954   0.980
  395   2HG   GLU 130          1HG       GLU 130 144.148  -9.368   0.238
  396    H    ASP 131           H        ASP 131 146.735  -8.010  -3.668
  397    HA   ASP 131           HA       ASP 131 147.176  -5.487  -2.488
  398   1HB   ASP 131          2HB       ASP 131 148.532  -6.941  -4.295
  399   2HB   ASP 131          1HB       ASP 131 147.731  -5.815  -5.389
  400    H    ASP 132           H        ASP 132 144.931  -6.611  -4.913
  401    HA   ASP 132           HA       ASP 132 144.184  -4.006  -5.836
  402   1HB   ASP 132          2HB       ASP 132 143.298  -6.795  -6.314
  403   2HB   ASP 132          1HB       ASP 132 142.095  -5.537  -6.587
  404    H    ILE 133           H        ILE 133 143.136  -6.150  -3.295
  405    HA   ILE 133           HA       ILE 133 140.612  -5.009  -2.786
  406    HB   ILE 133           HB       ILE 133 142.428  -6.300  -0.750
  407   1HG1  ILE 133          2HG1      ILE 133 142.228  -7.783  -2.663
  408   2HG1  ILE 133          1HG1      ILE 133 141.252  -8.409  -1.339
  409   1HG2  ILE 133          1HG2      ILE 133 139.501  -6.645  -0.668
  410   2HG2  ILE 133          2HG2      ILE 133 140.103  -5.031  -0.294
  411   3HG2  ILE 133          3HG2      ILE 133 140.657  -6.416   0.645
  412   1HD1  ILE 133          1HD1      ILE 133 139.424  -6.913  -2.649
  413   2HD1  ILE 133          2HD1      ILE 133 139.695  -8.633  -2.927
  414   3HD1  ILE 133          3HD1      ILE 133 140.450  -7.440  -3.984
  415    H    GLU 134           H        GLU 134 143.856  -4.120  -1.806
  416    HA   GLU 134           HA       GLU 134 143.161  -2.331   0.265
  417   1HB   GLU 134          2HB       GLU 134 145.567  -2.942  -1.327
  418   2HB   GLU 134          1HB       GLU 134 145.496  -1.306  -0.688
  419   1HG   GLU 134          2HG       GLU 134 144.785  -2.795   1.485
  420   2HG   GLU 134          1HG       GLU 134 145.950  -3.844   0.679
  421    H    GLU 135           H        GLU 135 143.700  -1.860  -3.205
  422    HA   GLU 135           HA       GLU 135 143.479   0.929  -3.253
  423   1HB   GLU 135          2HB       GLU 135 143.074  -1.233  -5.283
  424   2HB   GLU 135          1HB       GLU 135 142.623   0.418  -5.682
  425   1HG   GLU 135          2HG       GLU 135 145.065   0.898  -4.765
  426   2HG   GLU 135          1HG       GLU 135 145.300  -0.774  -5.267
  427    H    LEU 136           H        LEU 136 141.052  -1.581  -3.146
  428    HA   LEU 136           HA       LEU 136 138.830  -0.015  -3.916
  429   1HB   LEU 136          2HB       LEU 136 139.290  -2.650  -2.709
  430   2HB   LEU 136          1HB       LEU 136 137.781  -1.901  -2.227
  431    HG   LEU 136           HG       LEU 136 138.428  -1.960  -5.131
  432   1HD1  LEU 136          1HD1      LEU 136 137.813  -4.349  -3.448
  433   2HD1  LEU 136          2HD1      LEU 136 138.931  -4.186  -4.802
  434   3HD1  LEU 136          3HD1      LEU 136 137.193  -4.244  -5.097
  435   1HD2  LEU 136          1HD2      LEU 136 136.420  -0.835  -4.300
  436   2HD2  LEU 136          2HD2      LEU 136 135.887  -2.341  -3.552
  437   3HD2  LEU 136          3HD2      LEU 136 136.012  -2.224  -5.307
  438    H    MET 137           H        MET 137 140.257  -0.746  -0.757
  439    HA   MET 137           HA       MET 137 138.308   0.924   0.601
  440   1HB   MET 137          2HB       MET 137 140.717  -0.535   1.700
  441   2HB   MET 137          1HB       MET 137 139.458   0.239   2.651
  442   1HG   MET 137          2HG       MET 137 139.074  -2.103   0.802
  443   2HG   MET 137          1HG       MET 137 139.170  -2.178   2.560
  444   1HE   MET 137          1HE       MET 137 137.193  -0.829   4.160
  445   2HE   MET 137          2HE       MET 137 137.282  -2.559   3.829
  446   3HE   MET 137          3HE       MET 137 135.732  -1.721   3.733
  447    H    LYS 138           H        LYS 138 141.493   1.190  -0.697
  448    HA   LYS 138           HA       LYS 138 142.622   3.184   0.864
  449   1HB   LYS 138          2HB       LYS 138 143.709   1.920  -1.030
  450   2HB   LYS 138          1HB       LYS 138 142.875   3.000  -2.139
  451   1HG   LYS 138          2HG       LYS 138 144.070   4.778  -0.472
  452   2HG   LYS 138          1HG       LYS 138 145.243   3.459  -0.479
  453   1HD   LYS 138          2HD       LYS 138 144.084   4.658  -2.987
  454   2HD   LYS 138          1HD       LYS 138 145.582   5.221  -2.247
  455   1HE   LYS 138          2HE       LYS 138 146.177   2.647  -2.348
  456   2HE   LYS 138          1HE       LYS 138 144.995   2.669  -3.657
  457   1HZ   LYS 138          1HZ       LYS 138 146.289   4.452  -4.703
  458   2HZ   LYS 138          2HZ       LYS 138 147.195   3.035  -4.525
  459   3HZ   LYS 138          3HZ       LYS 138 147.447   4.337  -3.474
  460    H    ASP 139           H        ASP 139 140.597   3.567  -2.045
  461    HA   ASP 139           HA       ASP 139 140.433   6.425  -1.631
  462   1HB   ASP 139          2HB       ASP 139 139.283   6.518  -3.718
  463   2HB   ASP 139          1HB       ASP 139 140.587   5.349  -3.906
  464    H    GLY 140           H        GLY 140 138.655   3.652  -0.699
  465   1HA   GLY 140          2HA       GLY 140 136.109   4.973  -0.435
  466   2HA   GLY 140          1HA       GLY 140 136.524   3.375   0.167
  467    H    ASP 141           H        ASP 141 138.896   4.455   1.599
  468    HA   ASP 141           HA       ASP 141 137.583   5.029   4.067
  469   1HB   ASP 141          2HB       ASP 141 139.755   3.753   3.795
  470   2HB   ASP 141          1HB       ASP 141 140.535   5.302   3.487
  471    H    LYS 142           H        LYS 142 137.214   6.932   5.048
  472    HA   LYS 142           HA       LYS 142 138.280   9.360   3.760
  473   1HB   LYS 142          2HB       LYS 142 135.588   8.970   5.079
  474   2HB   LYS 142          1HB       LYS 142 136.199  10.502   4.464
  475   1HG   LYS 142          2HG       LYS 142 135.577   8.034   2.858
  476   2HG   LYS 142          1HG       LYS 142 134.671   9.549   2.875
  477   1HD   LYS 142          2HD       LYS 142 137.096  10.490   2.226
  478   2HD   LYS 142          1HD       LYS 142 137.222   8.870   1.538
  479   1HE   LYS 142          2HE       LYS 142 135.521   9.236   0.025
  480   2HE   LYS 142          1HE       LYS 142 134.781  10.501   1.005
  481   1HZ   LYS 142          1HZ       LYS 142 137.451  11.065   0.008
  482   2HZ   LYS 142          2HZ       LYS 142 136.100  12.078   0.126
  483   3HZ   LYS 142          3HZ       LYS 142 136.232  10.990  -1.163
  484    H    ASN 143           H        ASN 143 137.453   7.763   6.777
  485    HA   ASN 143           HA       ASN 143 138.512  10.009   8.318
  486   1HB   ASN 143          2HB       ASN 143 137.335   7.438   9.380
  487   2HB   ASN 143          1HB       ASN 143 137.585   8.945  10.256
  488   1HD2  ASN 143          1HD2      ASN 143 136.195  10.671   9.908
  489   2HD2  ASN 143          2HD2      ASN 143 134.663  10.475   9.134
  490    H    ASN 144           H        ASN 144 140.053   7.903   6.653
  491    HA   ASN 144           HA       ASN 144 141.917   6.590   6.819
  492   1HB   ASN 144          2HB       ASN 144 143.776   7.688   7.963
  493   2HB   ASN 144          1HB       ASN 144 142.821   8.863   7.064
  494   1HD2  ASN 144          1HD2      ASN 144 143.434   7.546  10.263
  495   2HD2  ASN 144          2HD2      ASN 144 142.942   8.953  11.138
  496    H    ASP 145           H        ASP 145 139.772   5.780   8.598
  497    HA   ASP 145           HA       ASP 145 141.038   4.969  11.069
  498   1HB   ASP 145          2HB       ASP 145 138.879   3.907  11.572
  499   2HB   ASP 145          1HB       ASP 145 138.665   5.580  11.068
  500    H    GLY 146           H        GLY 146 140.319   3.600   7.943
  501   1HA   GLY 146          2HA       GLY 146 141.829   1.765   7.268
  502   2HA   GLY 146          1HA       GLY 146 141.530   1.060   8.850
  503    H    ARG 147           H        ARG 147 138.619   2.004   8.471
  504    HA   ARG 147           HA       ARG 147 137.792  -0.109   6.598
  505   1HB   ARG 147          2HB       ARG 147 136.537   0.493   9.283
  506   2HB   ARG 147          1HB       ARG 147 135.966  -0.705   8.128
  507   1HG   ARG 147          2HG       ARG 147 138.192  -1.842   8.363
  508   2HG   ARG 147          1HG       ARG 147 138.527  -0.740   9.699
  509   1HD   ARG 147          2HD       ARG 147 136.548  -1.557  10.874
  510   2HD   ARG 147          1HD       ARG 147 136.194  -2.644   9.532
  511    HE   ARG 147           HE       ARG 147 138.700  -3.355  10.248
  512   1HH1  ARG 147          1HH1      ARG 147 135.737  -2.955  12.048
  513   2HH1  ARG 147          2HH1      ARG 147 136.143  -4.158  13.226
  514   1HH2  ARG 147          1HH2      ARG 147 139.236  -4.937  11.797
  515   2HH2  ARG 147          2HH2      ARG 147 138.130  -5.282  13.085
  516    H    ILE 148           H        ILE 148 135.254   0.121   6.301
  517    HA   ILE 148           HA       ILE 148 134.675   2.977   5.853
  518    HB   ILE 148           HB       ILE 148 133.785   0.732   4.045
  519   1HG1  ILE 148          2HG1      ILE 148 136.056   2.699   3.671
  520   2HG1  ILE 148          1HG1      ILE 148 136.228   0.970   3.952
  521   1HG2  ILE 148          1HG2      ILE 148 133.792   3.710   3.583
  522   2HG2  ILE 148          2HG2      ILE 148 132.390   2.794   4.136
  523   3HG2  ILE 148          3HG2      ILE 148 133.086   2.468   2.549
  524   1HD1  ILE 148          1HD1      ILE 148 136.549   1.442   1.623
  525   2HD1  ILE 148          2HD1      ILE 148 135.007   2.292   1.542
  526   3HD1  ILE 148          3HD1      ILE 148 135.040   0.551   1.828
  527    H    ASP 149           H        ASP 149 132.652   3.692   6.339
  528    HA   ASP 149           HA       ASP 149 130.656   1.716   7.192
  529   1HB   ASP 149          2HB       ASP 149 130.114   3.050   9.168
  530   2HB   ASP 149          1HB       ASP 149 131.805   2.562   9.204
  531    H    TYR 150           H        TYR 150 128.642   3.394   7.960
  532    HA   TYR 150           HA       TYR 150 127.447   4.120   5.564
  533   1HB   TYR 150          2HB       TYR 150 126.345   3.738   7.828
  534   2HB   TYR 150          1HB       TYR 150 126.783   5.398   8.214
  535    HD1  TYR 150           HD1      TYR 150 124.237   3.361   6.976
  536    HD2  TYR 150           HD2      TYR 150 126.055   7.154   6.334
  537    HE1  TYR 150           HE1      TYR 150 122.186   4.151   5.872
  538    HE2  TYR 150           HE2      TYR 150 124.008   7.954   5.229
  539    HH   TYR 150           HH       TYR 150 121.260   6.973   5.512
  540    H    ASP 151           H        ASP 151 128.959   6.254   7.986
  541    HA   ASP 151           HA       ASP 151 128.561   8.667   6.656
  542   1HB   ASP 151          2HB       ASP 151 130.646   7.750   8.620
  543   2HB   ASP 151          1HB       ASP 151 130.678   9.379   7.953
  544    H    GLU 152           H        GLU 152 131.317   6.433   6.486
  545    HA   GLU 152           HA       GLU 152 132.820   7.989   4.660
  546   1HB   GLU 152          2HB       GLU 152 133.006   4.995   4.900
  547   2HB   GLU 152          1HB       GLU 152 134.279   6.137   4.490
  548   1HG   GLU 152          2HG       GLU 152 133.824   7.063   6.884
  549   2HG   GLU 152          1HG       GLU 152 133.113   5.471   7.148
  550    H    PHE 153           H        PHE 153 130.572   5.283   4.226
  551    HA   PHE 153           HA       PHE 153 130.903   4.911   1.484
  552   1HB   PHE 153          2HB       PHE 153 129.529   3.549   3.232
  553   2HB   PHE 153          1HB       PHE 153 128.211   4.625   2.779
  554    HD1  PHE 153           HD1      PHE 153 127.322   4.603   0.490
  555    HD2  PHE 153           HD2      PHE 153 130.290   1.832   1.768
  556    HE1  PHE 153           HE1      PHE 153 126.830   3.182  -1.457
  557    HE2  PHE 153           HE2      PHE 153 129.801   0.406  -0.178
  558    HZ   PHE 153           HZ       PHE 153 128.070   1.081  -1.795
  559    H    LEU 154           H        LEU 154 129.116   7.332   3.250
  560    HA   LEU 154           HA       LEU 154 127.602   8.260   1.004
  561   1HB   LEU 154          2HB       LEU 154 127.920   8.969   3.826
  562   2HB   LEU 154          1HB       LEU 154 127.665  10.357   2.786
  563    HG   LEU 154           HG       LEU 154 125.571   9.482   3.754
  564   1HD1  LEU 154          1HD1      LEU 154 124.747  10.471   1.944
  565   2HD1  LEU 154          2HD1      LEU 154 124.731   8.889   1.168
  566   3HD1  LEU 154          3HD1      LEU 154 126.117   9.960   0.959
  567   1HD2  LEU 154          1HD2      LEU 154 125.965   7.074   1.995
  568   2HD2  LEU 154          2HD2      LEU 154 124.700   7.358   3.191
  569   3HD2  LEU 154          3HD2      LEU 154 126.363   7.082   3.714
  570    H    GLU 155           H        GLU 155 130.404   9.561   2.784
  571    HA   GLU 155           HA       GLU 155 130.851  11.789   1.163
  572   1HB   GLU 155          2HB       GLU 155 132.764  10.134   2.811
  573   2HB   GLU 155          1HB       GLU 155 133.219  11.641   2.028
  574   1HG   GLU 155          2HG       GLU 155 130.819  11.717   3.745
  575   2HG   GLU 155          1HG       GLU 155 132.369  11.494   4.555
  576    H    PHE 156           H        PHE 156 132.090   8.482   0.902
  577    HA   PHE 156           HA       PHE 156 133.869   8.887  -1.218
  578   1HB   PHE 156          2HB       PHE 156 133.711   6.817   0.176
  579   2HB   PHE 156          1HB       PHE 156 132.234   6.398  -0.686
  580    HD1  PHE 156           HD1      PHE 156 135.669   7.540  -1.619
  581    HD2  PHE 156           HD2      PHE 156 132.505   4.765  -2.257
  582    HE1  PHE 156           HE1      PHE 156 137.006   6.421  -3.355
  583    HE2  PHE 156           HE2      PHE 156 133.838   3.642  -3.994
  584    HZ   PHE 156           HZ       PHE 156 136.089   4.470  -4.546
  585    H    MET 157           H        MET 157 130.400   8.303  -1.191
  586    HA   MET 157           HA       MET 157 130.265   8.170  -4.083
  587   1HB   MET 157          2HB       MET 157 128.611   7.346  -1.934
  588   2HB   MET 157          1HB       MET 157 127.687   8.509  -2.872
  589   1HG   MET 157          2HG       MET 157 127.131   6.593  -3.957
  590   2HG   MET 157          1HG       MET 157 128.547   7.070  -4.893
  591   1HE   MET 157          1HE       MET 157 130.080   5.463  -5.632
  592   2HE   MET 157          2HE       MET 157 130.884   4.243  -4.642
  593   3HE   MET 157          3HE       MET 157 131.104   5.955  -4.282
  594    H    LYS 158           H        LYS 158 129.952  10.541  -1.585
  595    HA   LYS 158           HA       LYS 158 128.512  12.437  -3.215
  596   1HB   LYS 158          2HB       LYS 158 128.743  12.125  -0.535
  597   2HB   LYS 158          1HB       LYS 158 129.940  13.384  -0.806
  598   1HG   LYS 158          2HG       LYS 158 128.282  14.813  -1.806
  599   2HG   LYS 158          1HG       LYS 158 127.072  13.532  -1.707
  600   1HD   LYS 158          2HD       LYS 158 127.995  13.744   0.885
  601   2HD   LYS 158          1HD       LYS 158 127.971  15.416   0.324
  602   1HE   LYS 158          2HE       LYS 158 125.651  13.507   0.079
  603   2HE   LYS 158          1HE       LYS 158 125.851  14.660   1.398
  604   1HZ   LYS 158          1HZ       LYS 158 125.723  15.429  -1.466
  605   2HZ   LYS 158          2HZ       LYS 158 125.704  16.467  -0.130
  606   3HZ   LYS 158          3HZ       LYS 158 124.389  15.444  -0.423
  607    H    GLY 159           H        GLY 159 130.441  11.897  -4.830
  608   1HA   GLY 159          2HA       GLY 159 131.765  13.425  -6.121
  609   2HA   GLY 159          1HA       GLY 159 132.257  14.203  -4.625
  610    H    VAL 160           H        VAL 160 132.509  11.143  -6.404
  611    HA   VAL 160           HA       VAL 160 134.704  10.152  -4.901
  612    HB   VAL 160           HB       VAL 160 133.958   9.392  -7.728
  613   1HG1  VAL 160          1HG1      VAL 160 135.883   8.243  -7.447
  614   2HG1  VAL 160          2HG1      VAL 160 134.832   7.133  -6.567
  615   3HG1  VAL 160          3HG1      VAL 160 135.797   8.315  -5.687
  616   1HG2  VAL 160          1HG2      VAL 160 133.020   7.679  -5.544
  617   2HG2  VAL 160          2HG2      VAL 160 132.191   8.210  -7.007
  618   3HG2  VAL 160          3HG2      VAL 160 132.256   9.268  -5.597
  619    H    GLU 161           H        GLU 161 134.419  12.199  -7.719
  620    HA   GLU 161           HA       GLU 161 137.352  12.258  -7.965
  621   1HB   GLU 161          2HB       GLU 161 136.886  13.287 -10.222
  622   2HB   GLU 161          1HB       GLU 161 136.392  11.609 -10.041
  623   1HG   GLU 161          2HG       GLU 161 134.226  12.084 -10.332
  624   2HG   GLU 161          1HG       GLU 161 134.315  13.562  -9.377
  Start of MODEL   14
    1   1H    MET  81          1HT       MET  81  90.807  16.480  -0.665
    2   2H    MET  81          2HT       MET  81  91.746  16.887  -2.042
    3   3H    MET  81          3HT       MET  81  91.612  17.991  -0.735
    4    HA   MET  81           HA       MET  81  93.724  16.774  -0.859
    5   1HB   MET  81          2HB       MET  81  91.972  17.350   1.321
    6   2HB   MET  81          1HB       MET  81  92.852  15.878   1.705
    7   1HG   MET  81          2HG       MET  81  94.791  17.570   0.691
    8   2HG   MET  81          1HG       MET  81  93.758  18.625   1.652
    9   1HE   MET  81          1HE       MET  81  96.785  18.220   3.723
   10   2HE   MET  81          2HE       MET  81  95.300  18.874   4.414
   11   3HE   MET  81          3HE       MET  81  95.716  19.215   2.735
   12    H    VAL  82           H        VAL  82  94.072  14.971  -2.083
   13    HA   VAL  82           HA       VAL  82  93.606  12.423  -0.794
   14    HB   VAL  82           HB       VAL  82  91.536  12.709  -2.085
   15   1HG1  VAL  82          1HG1      VAL  82  93.035  14.014  -3.919
   16   2HG1  VAL  82          2HG1      VAL  82  91.429  13.358  -4.238
   17   3HG1  VAL  82          3HG1      VAL  82  92.864  12.440  -4.694
   18   1HG2  VAL  82          1HG2      VAL  82  93.477  10.604  -2.996
   19   2HG2  VAL  82          2HG2      VAL  82  91.795  10.622  -3.521
   20   3HG2  VAL  82          3HG2      VAL  82  92.181  10.466  -1.809
   21    H    ARG  83           H        ARG  83  95.134  10.929  -1.309
   22    HA   ARG  83           HA       ARG  83  97.415  11.844  -2.805
   23   1HB   ARG  83          2HB       ARG  83  98.468   9.769  -2.087
   24   2HB   ARG  83          1HB       ARG  83  97.679  10.553  -0.727
   25   1HG   ARG  83          2HG       ARG  83  95.697   8.999  -1.265
   26   2HG   ARG  83          1HG       ARG  83  96.879   8.075  -2.194
   27   1HD   ARG  83          2HD       ARG  83  98.282   7.883  -0.187
   28   2HD   ARG  83          1HD       ARG  83  97.074   8.778   0.733
   29    HE   ARG  83           HE       ARG  83  95.914   6.512  -0.511
   30   1HH1  ARG  83          1HH1      ARG  83  97.962   7.437   2.158
   31   2HH1  ARG  83          2HH1      ARG  83  97.529   6.068   3.128
   32   1HH2  ARG  83          1HH2      ARG  83  95.342   4.712   0.761
   33   2HH2  ARG  83          2HH2      ARG  83  96.043   4.521   2.335
   34    H    CYS  84           H        CYS  84  98.246  10.990  -4.698
   35    HA   CYS  84           HA       CYS  84  96.657   8.979  -6.111
   36   1HB   CYS  84          2HB       CYS  84  97.077  11.806  -6.940
   37   2HB   CYS  84          1HB       CYS  84  97.147  10.574  -8.196
   38    HG   CYS  84           HG       CYS  84  94.690  11.557  -7.846
   39    H    MET  85           H        MET  85  97.986   7.425  -6.733
   40    HA   MET  85           HA       MET  85  99.814   6.303  -7.479
   41   1HB   MET  85          2HB       MET  85 100.430   9.016  -8.647
   42   2HB   MET  85          1HB       MET  85 101.417   7.594  -8.953
   43   1HG   MET  85          2HG       MET  85  98.526   7.309  -9.451
   44   2HG   MET  85          1HG       MET  85  99.410   8.376 -10.539
   45   1HE   MET  85          1HE       MET  85 101.996   7.458 -11.268
   46   2HE   MET  85          2HE       MET  85 100.791   7.527 -12.554
   47   3HE   MET  85          3HE       MET  85 101.837   6.115 -12.399
   48    H    LYS  86           H        LYS  86 101.465   9.404  -6.993
   49    HA   LYS  86           HA       LYS  86 103.097   8.099  -4.918
   50   1HB   LYS  86          2HB       LYS  86 104.076   9.061  -7.171
   51   2HB   LYS  86          1HB       LYS  86 103.979  10.593  -6.312
   52   1HG   LYS  86          2HG       LYS  86 105.341   9.599  -4.493
   53   2HG   LYS  86          1HG       LYS  86 105.526   8.149  -5.483
   54   1HD   LYS  86          2HD       LYS  86 106.182  10.684  -6.826
   55   2HD   LYS  86          1HD       LYS  86 107.252  10.239  -5.495
   56   1HE   LYS  86          2HE       LYS  86 107.799   8.165  -6.519
   57   2HE   LYS  86          1HE       LYS  86 106.522   8.348  -7.719
   58   1HZ   LYS  86          1HZ       LYS  86 107.736  10.290  -8.591
   59   2HZ   LYS  86          2HZ       LYS  86 108.624   8.855  -8.715
   60   3HZ   LYS  86          3HZ       LYS  86 108.995   9.976  -7.505
   61    H    ASP  87           H        ASP  87 102.963   8.836  -2.905
   62    HA   ASP  87           HA       ASP  87 101.645  11.428  -2.458
   63   1HB   ASP  87          2HB       ASP  87 100.614   9.265  -1.542
   64   2HB   ASP  87          1HB       ASP  87 101.952   9.250  -0.397
   65    H    ASP  88           H        ASP  88 104.385   9.416  -1.541
   66    HA   ASP  88           HA       ASP  88 105.501  11.611   0.044
   67   1HB   ASP  88          2HB       ASP  88 107.184   9.929   0.765
   68   2HB   ASP  88          1HB       ASP  88 105.530   9.447   1.133
   69    H    SER  89           H        SER  89 108.120  11.424  -0.164
   70    HA   SER  89           HA       SER  89 108.746  12.678  -2.584
   71   1HB   SER  89          2HB       SER  89 110.198  11.788  -0.202
   72   2HB   SER  89          1HB       SER  89 111.176  11.730  -1.668
   73    HG   SER  89           HG       SER  89 110.896  13.806  -0.306
   74    H    LYS  90           H        LYS  90 110.997  11.660  -3.645
   75    HA   LYS  90           HA       LYS  90 110.085   9.725  -5.439
   76   1HB   LYS  90          2HB       LYS  90 112.189  11.373  -5.430
   77   2HB   LYS  90          1HB       LYS  90 113.009   9.905  -4.919
   78   1HG   LYS  90          2HG       LYS  90 111.932   8.794  -6.939
   79   2HG   LYS  90          1HG       LYS  90 111.541  10.427  -7.482
   80   1HD   LYS  90          2HD       LYS  90 114.123  10.795  -6.944
   81   2HD   LYS  90          1HD       LYS  90 114.171   9.063  -7.280
   82   1HE   LYS  90          2HE       LYS  90 112.738   9.790  -9.376
   83   2HE   LYS  90          1HE       LYS  90 113.525  11.339  -9.086
   84   1HZ   LYS  90          1HZ       LYS  90 115.610   9.699  -8.946
   85   2HZ   LYS  90          2HZ       LYS  90 115.105  10.433 -10.384
   86   3HZ   LYS  90          3HZ       LYS  90 114.650   8.840 -10.042
   87    H    GLY  91           H        GLY  91 110.896   7.538  -5.783
   88   1HA   GLY  91          2HA       GLY  91 110.616   5.938  -3.464
   89   2HA   GLY  91          1HA       GLY  91 111.090   5.367  -5.056
   90    H    LYS  92           H        LYS  92 113.377   5.684  -5.667
   91    HA   LYS  92           HA       LYS  92 115.079   4.944  -3.448
   92   1HB   LYS  92          2HB       LYS  92 115.292   4.896  -6.416
   93   2HB   LYS  92          1HB       LYS  92 116.788   4.961  -5.496
   94   1HG   LYS  92          2HG       LYS  92 116.453   2.883  -4.550
   95   2HG   LYS  92          1HG       LYS  92 114.709   2.930  -4.815
   96   1HD   LYS  92          2HD       LYS  92 114.893   2.315  -7.026
   97   2HD   LYS  92          1HD       LYS  92 116.533   2.950  -7.175
   98   1HE   LYS  92          2HE       LYS  92 117.477   1.032  -6.457
   99   2HE   LYS  92          1HE       LYS  92 116.211   0.737  -5.264
  100   1HZ   LYS  92          1HZ       LYS  92 116.086   0.175  -8.175
  101   2HZ   LYS  92          2HZ       LYS  92 114.760   0.050  -7.134
  102   3HZ   LYS  92          3HZ       LYS  92 116.101  -0.955  -6.918
  103    H    THR  93           H        THR  93 115.657   6.630  -2.201
  104    HA   THR  93           HA       THR  93 116.592   9.091  -3.489
  105    HB   THR  93           HB       THR  93 114.873   9.312  -1.738
  106    HG1  THR  93           HG1      THR  93 115.827  11.009  -0.801
  107   1HG2  THR  93          1HG2      THR  93 115.433   8.946   0.604
  108   2HG2  THR  93          2HG2      THR  93 116.964   8.212   0.124
  109   3HG2  THR  93          3HG2      THR  93 115.440   7.438  -0.308
  110    H    GLU  94           H        GLU  94 118.226  10.038  -1.415
  111    HA   GLU  94           HA       GLU  94 120.668   8.699  -2.048
  112   1HB   GLU  94          2HB       GLU  94 119.924  11.236  -1.103
  113   2HB   GLU  94          1HB       GLU  94 120.915  10.536   0.169
  114   1HG   GLU  94          2HG       GLU  94 122.500   9.944  -1.837
  115   2HG   GLU  94          1HG       GLU  94 121.638  11.270  -2.619
  116    H    GLU  95           H        GLU  95 118.704   9.019   0.890
  117    HA   GLU  95           HA       GLU  95 120.381   7.723   2.682
  118   1HB   GLU  95          2HB       GLU  95 118.407   7.311   4.033
  119   2HB   GLU  95          1HB       GLU  95 118.319   8.916   3.322
  120   1HG   GLU  95          2HG       GLU  95 116.421   8.450   2.274
  121   2HG   GLU  95          1HG       GLU  95 117.057   6.933   1.638
  122    H    GLU  96           H        GLU  96 118.503   6.411   0.091
  123    HA   GLU  96           HA       GLU  96 118.171   3.775   0.947
  124   1HB   GLU  96          2HB       GLU  96 118.361   5.092  -1.730
  125   2HB   GLU  96          1HB       GLU  96 118.382   3.337  -1.642
  126   1HG   GLU  96          2HG       GLU  96 116.212   5.190  -0.700
  127   2HG   GLU  96          1HG       GLU  96 116.144   4.040  -2.035
  128    H    LEU  97           H        LEU  97 121.017   5.460  -0.020
  129    HA   LEU  97           HA       LEU  97 122.643   3.469  -1.018
  130   1HB   LEU  97          2HB       LEU  97 123.026   6.039   0.316
  131   2HB   LEU  97          1HB       LEU  97 124.349   4.923   0.592
  132    HG   LEU  97           HG       LEU  97 123.419   5.259  -2.210
  133   1HD1  LEU  97          1HD1      LEU  97 124.905   7.360  -0.654
  134   2HD1  LEU  97          2HD1      LEU  97 123.430   7.546  -1.606
  135   3HD1  LEU  97          3HD1      LEU  97 124.969   7.236  -2.412
  136   1HD2  LEU  97          1HD2      LEU  97 126.258   5.372  -1.419
  137   2HD2  LEU  97          2HD2      LEU  97 125.475   4.483  -2.726
  138   3HD2  LEU  97          3HD2      LEU  97 125.414   3.861  -1.076
  139    H    SER  98           H        SER  98 121.509   3.930   2.232
  140    HA   SER  98           HA       SER  98 123.410   2.470   3.662
  141   1HB   SER  98          2HB       SER  98 121.600   2.122   5.332
  142   2HB   SER  98          1HB       SER  98 121.712   3.798   4.791
  143    HG   SER  98           HG       SER  98 119.731   1.894   4.314
  144    H    ASP  99           H        ASP  99 120.760   1.420   1.647
  145    HA   ASP  99           HA       ASP  99 120.770  -1.298   2.528
  146   1HB   ASP  99          2HB       ASP  99 119.006   0.196   1.115
  147   2HB   ASP  99          1HB       ASP  99 119.778  -0.696  -0.194
  148    H    LEU 100           H        LEU 100 122.335   0.495  -0.062
  149    HA   LEU 100           HA       LEU 100 123.356  -1.771  -1.435
  150   1HB   LEU 100          2HB       LEU 100 123.956   1.160  -1.456
  151   2HB   LEU 100          1HB       LEU 100 125.033   0.052  -2.284
  152    HG   LEU 100           HG       LEU 100 122.148  -0.201  -2.910
  153   1HD1  LEU 100          1HD1      LEU 100 123.794   2.058  -4.029
  154   2HD1  LEU 100          2HD1      LEU 100 122.539   2.252  -2.806
  155   3HD1  LEU 100          3HD1      LEU 100 122.119   1.660  -4.414
  156   1HD2  LEU 100          1HD2      LEU 100 124.408  -0.019  -4.853
  157   2HD2  LEU 100          2HD2      LEU 100 122.910  -0.947  -4.953
  158   3HD2  LEU 100          3HD2      LEU 100 124.203  -1.473  -3.876
  159    H    PHE 101           H        PHE 101 124.459   0.131   1.273
  160    HA   PHE 101           HA       PHE 101 127.152  -0.800   1.253
  161   1HB   PHE 101          2HB       PHE 101 126.588   1.281   2.364
  162   2HB   PHE 101          1HB       PHE 101 125.491   0.442   3.454
  163    HD1  PHE 101           HD1      PHE 101 126.248  -0.273   5.516
  164    HD2  PHE 101           HD2      PHE 101 129.069   0.549   2.438
  165    HE1  PHE 101           HE1      PHE 101 128.085  -0.598   7.120
  166    HE2  PHE 101           HE2      PHE 101 130.911   0.225   4.035
  167    HZ   PHE 101           HZ       PHE 101 130.421  -0.350   6.380
  168    H    ARG 102           H        ARG 102 124.165  -2.112   2.385
  169    HA   ARG 102           HA       ARG 102 125.093  -3.795   4.425
  170   1HB   ARG 102          2HB       ARG 102 122.669  -3.539   2.797
  171   2HB   ARG 102          1HB       ARG 102 122.997  -5.189   3.310
  172   1HG   ARG 102          2HG       ARG 102 123.406  -3.658   5.591
  173   2HG   ARG 102          1HG       ARG 102 121.985  -2.950   4.824
  174   1HD   ARG 102          2HD       ARG 102 121.007  -5.233   4.673
  175   2HD   ARG 102          1HD       ARG 102 122.386  -5.837   5.592
  176    HE   ARG 102           HE       ARG 102 121.448  -4.984   7.499
  177   1HH1  ARG 102          1HH1      ARG 102 119.838  -3.600   4.729
  178   2HH1  ARG 102          2HH1      ARG 102 118.598  -2.842   5.671
  179   1HH2  ARG 102          1HH2      ARG 102 119.817  -3.989   8.740
  180   2HH2  ARG 102          2HH2      ARG 102 118.586  -3.062   7.948
  181    H    MET 103           H        MET 103 124.521  -4.515   0.979
  182    HA   MET 103           HA       MET 103 125.335  -7.163   0.981
  183   1HB   MET 103          2HB       MET 103 126.015  -6.668  -1.456
  184   2HB   MET 103          1HB       MET 103 124.333  -6.447  -0.996
  185   1HG   MET 103          2HG       MET 103 124.566  -4.092  -0.938
  186   2HG   MET 103          1HG       MET 103 126.321  -4.198  -1.060
  187   1HE   MET 103          1HE       MET 103 126.911  -5.600  -4.525
  188   2HE   MET 103          2HE       MET 103 127.413  -5.518  -2.837
  189   3HE   MET 103          3HE       MET 103 127.500  -4.080  -3.853
  190    H    PHE 104           H        PHE 104 127.286  -4.239   0.622
  191    HA   PHE 104           HA       PHE 104 129.737  -5.432   0.029
  192   1HB   PHE 104          2HB       PHE 104 128.908  -2.839   1.252
  193   2HB   PHE 104          1HB       PHE 104 130.604  -3.301   1.351
  194    HD1  PHE 104           HD1      PHE 104 131.468  -4.312  -1.035
  195    HD2  PHE 104           HD2      PHE 104 128.388  -1.432  -0.469
  196    HE1  PHE 104           HE1      PHE 104 131.829  -3.482  -3.323
  197    HE2  PHE 104           HE2      PHE 104 128.742  -0.597  -2.756
  198    HZ   PHE 104           HZ       PHE 104 130.464  -1.623  -4.186
  199    H    ASP 105           H        ASP 105 128.057  -5.054   3.068
  200    HA   ASP 105           HA       ASP 105 130.351  -6.087   4.557
  201   1HB   ASP 105          2HB       ASP 105 128.650  -4.136   5.242
  202   2HB   ASP 105          1HB       ASP 105 127.769  -5.504   5.915
  203    H    LYS 106           H        LYS 106 130.518  -8.153   5.137
  204    HA   LYS 106           HA       LYS 106 128.484 -10.030   4.368
  205   1HB   LYS 106          2HB       LYS 106 131.087 -10.432   5.853
  206   2HB   LYS 106          1HB       LYS 106 130.056 -11.726   5.261
  207   1HG   LYS 106          2HG       LYS 106 131.243  -9.634   3.461
  208   2HG   LYS 106          1HG       LYS 106 132.051 -11.158   3.839
  209   1HD   LYS 106          2HD       LYS 106 129.274 -10.987   2.681
  210   2HD   LYS 106          1HD       LYS 106 130.732 -11.148   1.699
  211   1HE   LYS 106          2HE       LYS 106 131.269 -13.218   3.004
  212   2HE   LYS 106          1HE       LYS 106 129.678 -13.085   3.752
  213   1HZ   LYS 106          1HZ       LYS 106 128.646 -13.764   1.886
  214   2HZ   LYS 106          2HZ       LYS 106 130.140 -14.482   1.546
  215   3HZ   LYS 106          3HZ       LYS 106 129.738 -12.994   0.847
  216    H    ASN 107           H        ASN 107 130.155  -9.626   7.491
  217    HA   ASN 107           HA       ASN 107 128.185 -10.972   8.979
  218   1HB   ASN 107          2HB       ASN 107 129.309  -9.931  10.964
  219   2HB   ASN 107          1HB       ASN 107 130.408 -10.765   9.868
  220   1HD2  ASN 107          1HD2      ASN 107 131.265  -8.880  11.703
  221   2HD2  ASN 107          2HD2      ASN 107 131.849  -7.494  10.852
  222    H    ALA 108           H        ALA 108 128.390  -7.716   7.842
  223    HA   ALA 108           HA       ALA 108 126.942  -5.964   7.939
  224   1HB   ALA 108          1HB       ALA 108 124.833  -7.479   9.361
  225   2HB   ALA 108          2HB       ALA 108 125.323  -8.083   7.778
  226   3HB   ALA 108          3HB       ALA 108 124.722  -6.433   7.944
  227    H    ASP 109           H        ASP 109 128.814  -5.973   9.869
  228    HA   ASP 109           HA       ASP 109 127.528  -5.547  12.445
  229   1HB   ASP 109          2HB       ASP 109 129.824  -5.231  13.288
  230   2HB   ASP 109          1HB       ASP 109 129.651  -6.752  12.417
  231    H    GLY 110           H        GLY 110 128.599  -3.725   9.732
  232   1HA   GLY 110          2HA       GLY 110 127.585  -1.432   9.732
  233   2HA   GLY 110          1HA       GLY 110 128.345  -1.236  11.303
  234    H    TYR 111           H        TYR 111 130.714  -2.814  10.224
  235    HA   TYR 111           HA       TYR 111 131.860  -0.721   8.502
  236   1HB   TYR 111          2HB       TYR 111 133.331  -2.059  10.780
  237   2HB   TYR 111          1HB       TYR 111 133.928  -0.761   9.751
  238    HD1  TYR 111           HD1      TYR 111 132.998   1.523   9.980
  239    HD2  TYR 111           HD2      TYR 111 131.916  -1.607  12.651
  240    HE1  TYR 111           HE1      TYR 111 132.134   3.187  11.572
  241    HE2  TYR 111           HE2      TYR 111 131.047   0.048  14.249
  242    HH   TYR 111           HH       TYR 111 131.364   2.432  14.783
  243    H    ILE 112           H        ILE 112 133.598  -1.399   7.148
  244    HA   ILE 112           HA       ILE 112 133.845  -4.316   6.834
  245    HB   ILE 112           HB       ILE 112 133.680  -2.379   4.526
  246   1HG1  ILE 112          2HG1      ILE 112 131.561  -4.332   5.435
  247   2HG1  ILE 112          1HG1      ILE 112 131.529  -2.613   5.817
  248   1HG2  ILE 112          1HG2      ILE 112 134.218  -5.263   4.806
  249   2HG2  ILE 112          2HG2      ILE 112 134.751  -4.120   3.572
  250   3HG2  ILE 112          3HG2      ILE 112 133.124  -4.800   3.501
  251   1HD1  ILE 112          1HD1      ILE 112 131.008  -2.011   3.680
  252   2HD1  ILE 112          2HD1      ILE 112 130.209  -3.580   3.774
  253   3HD1  ILE 112          3HD1      ILE 112 131.774  -3.434   2.972
  254    H    ASP 113           H        ASP 113 135.825  -5.068   6.010
  255    HA   ASP 113           HA       ASP 113 137.973  -3.075   5.787
  256   1HB   ASP 113          2HB       ASP 113 139.450  -4.768   7.005
  257   2HB   ASP 113          1HB       ASP 113 138.290  -3.878   7.987
  258    H    LEU 114           H        LEU 114 140.084  -4.391   5.093
  259    HA   LEU 114           HA       LEU 114 139.652  -5.233   2.467
  260   1HB   LEU 114          2HB       LEU 114 141.987  -5.600   4.329
  261   2HB   LEU 114          1HB       LEU 114 142.024  -6.140   2.661
  262    HG   LEU 114           HG       LEU 114 141.428  -3.699   2.070
  263   1HD1  LEU 114          1HD1      LEU 114 142.274  -3.445   4.941
  264   2HD1  LEU 114          2HD1      LEU 114 140.834  -2.795   4.158
  265   3HD1  LEU 114          3HD1      LEU 114 142.419  -2.117   3.791
  266   1HD2  LEU 114          1HD2      LEU 114 143.581  -4.754   1.597
  267   2HD2  LEU 114          2HD2      LEU 114 144.130  -4.368   3.229
  268   3HD2  LEU 114          3HD2      LEU 114 143.782  -3.071   2.086
  269    H    GLU 115           H        GLU 115 139.625  -7.013   5.451
  270    HA   GLU 115           HA       GLU 115 139.916  -9.599   4.254
  271   1HB   GLU 115          2HB       GLU 115 138.823  -8.883   6.978
  272   2HB   GLU 115          1HB       GLU 115 139.378 -10.469   6.461
  273   1HG   GLU 115          2HG       GLU 115 141.631  -9.318   6.037
  274   2HG   GLU 115          1HG       GLU 115 140.984  -8.009   7.026
  275    H    GLU 116           H        GLU 116 137.154  -8.106   5.956
  276    HA   GLU 116           HA       GLU 116 135.240  -9.970   5.219
  277   1HB   GLU 116          2HB       GLU 116 135.285  -7.437   6.513
  278   2HB   GLU 116          1HB       GLU 116 134.001  -7.400   5.315
  279   1HG   GLU 116          2HG       GLU 116 132.705  -8.468   6.748
  280   2HG   GLU 116          1HG       GLU 116 133.761  -9.871   6.600
  281    H    LEU 117           H        LEU 117 136.549  -7.288   3.406
  282    HA   LEU 117           HA       LEU 117 134.519  -7.363   1.370
  283   1HB   LEU 117          2HB       LEU 117 136.207  -5.444   2.139
  284   2HB   LEU 117          1HB       LEU 117 137.168  -6.129   0.844
  285    HG   LEU 117           HG       LEU 117 135.212  -5.783  -0.689
  286   1HD1  LEU 117          1HD1      LEU 117 133.273  -4.837  -0.031
  287   2HD1  LEU 117          2HD1      LEU 117 134.058  -3.802   1.164
  288   3HD1  LEU 117          3HD1      LEU 117 133.737  -5.495   1.538
  289   1HD2  LEU 117          1HD2      LEU 117 135.801  -3.095   0.361
  290   2HD2  LEU 117          2HD2      LEU 117 136.007  -3.753  -1.262
  291   3HD2  LEU 117          3HD2      LEU 117 137.203  -4.098  -0.013
  292    H    LYS 118           H        LYS 118 137.642  -8.825   1.901
  293    HA   LYS 118           HA       LYS 118 138.201  -9.614  -0.742
  294   1HB   LYS 118          2HB       LYS 118 139.402  -9.907   1.781
  295   2HB   LYS 118          1HB       LYS 118 139.154 -11.543   1.188
  296   1HG   LYS 118          2HG       LYS 118 140.225  -9.805  -0.865
  297   2HG   LYS 118          1HG       LYS 118 141.254  -9.855   0.567
  298   1HD   LYS 118          2HD       LYS 118 140.182 -12.355  -0.713
  299   2HD   LYS 118          1HD       LYS 118 141.682 -11.598  -1.253
  300   1HE   LYS 118          2HE       LYS 118 142.141 -11.667   1.389
  301   2HE   LYS 118          1HE       LYS 118 141.083 -13.069   1.239
  302   1HZ   LYS 118          1HZ       LYS 118 142.627 -14.222   0.103
  303   2HZ   LYS 118          2HZ       LYS 118 143.708 -13.174   0.871
  304   3HZ   LYS 118          3HZ       LYS 118 143.219 -12.869  -0.720
  305    H    ILE 119           H        ILE 119 136.149 -10.969   1.735
  306    HA   ILE 119           HA       ILE 119 135.824 -13.542   0.598
  307    HB   ILE 119           HB       ILE 119 133.844 -12.072   2.338
  308   1HG1  ILE 119          2HG1      ILE 119 135.730 -14.035   3.514
  309   2HG1  ILE 119          1HG1      ILE 119 136.419 -12.485   3.044
  310   1HG2  ILE 119          1HG2      ILE 119 134.300 -14.999   1.786
  311   2HG2  ILE 119          2HG2      ILE 119 132.888 -14.036   1.350
  312   3HG2  ILE 119          3HG2      ILE 119 133.234 -14.377   3.046
  313   1HD1  ILE 119          1HD1      ILE 119 134.225 -11.664   4.383
  314   2HD1  ILE 119          2HD1      ILE 119 135.815 -11.885   5.113
  315   3HD1  ILE 119          3HD1      ILE 119 134.601 -13.157   5.243
  316    H    MET 120           H        MET 120 133.637 -10.719   0.584
  317    HA   MET 120           HA       MET 120 131.737 -11.776  -1.160
  318   1HB   MET 120          2HB       MET 120 131.032  -9.453  -1.534
  319   2HB   MET 120          1HB       MET 120 131.321  -9.776   0.170
  320   1HG   MET 120          2HG       MET 120 133.059  -8.348   0.289
  321   2HG   MET 120          1HG       MET 120 133.606  -8.705  -1.347
  322   1HE   MET 120          1HE       MET 120 132.035  -6.192  -3.573
  323   2HE   MET 120          2HE       MET 120 132.571  -7.866  -3.439
  324   3HE   MET 120          3HE       MET 120 133.653  -6.553  -2.974
  325    H    LEU 121           H        LEU 121 134.838 -10.322  -1.793
  326    HA   LEU 121           HA       LEU 121 134.382  -9.887  -4.590
  327   1HB   LEU 121          2HB       LEU 121 136.674  -9.662  -2.723
  328   2HB   LEU 121          1HB       LEU 121 137.059  -9.896  -4.416
  329    HG   LEU 121           HG       LEU 121 135.064  -7.830  -4.125
  330   1HD1  LEU 121          1HD1      LEU 121 137.388  -7.750  -2.288
  331   2HD1  LEU 121          2HD1      LEU 121 135.770  -7.071  -2.105
  332   3HD1  LEU 121          3HD1      LEU 121 136.956  -6.260  -3.129
  333   1HD2  LEU 121          1HD2      LEU 121 137.875  -7.367  -5.004
  334   2HD2  LEU 121          2HD2      LEU 121 136.369  -6.732  -5.666
  335   3HD2  LEU 121          3HD2      LEU 121 136.828  -8.409  -5.968
  336    H    GLN 122           H        GLN 122 135.687 -12.472  -2.619
  337    HA   GLN 122           HA       GLN 122 136.945 -13.968  -4.628
  338   1HB   GLN 122          2HB       GLN 122 135.821 -14.584  -1.933
  339   2HB   GLN 122          1HB       GLN 122 136.247 -15.926  -2.988
  340   1HG   GLN 122          2HG       GLN 122 138.497 -14.567  -3.217
  341   2HG   GLN 122          1HG       GLN 122 137.986 -13.924  -1.657
  342   1HE2  GLN 122          1HE2      GLN 122 139.330 -14.896  -0.278
  343   2HE2  GLN 122          2HE2      GLN 122 139.515 -16.606  -0.108
  344    H    ALA 123           H        ALA 123 133.591 -13.631  -3.756
  345    HA   ALA 123           HA       ALA 123 132.527 -15.931  -4.926
  346   1HB   ALA 123          1HB       ALA 123 130.523 -14.200  -5.318
  347   2HB   ALA 123          2HB       ALA 123 131.483 -13.274  -4.166
  348   3HB   ALA 123          3HB       ALA 123 130.908 -14.885  -3.740
  349    H    THR 124           H        THR 124 133.363 -12.810  -6.346
  350    HA   THR 124           HA       THR 124 132.209 -13.190  -8.870
  351    HB   THR 124           HB       THR 124 133.711 -11.437  -9.645
  352    HG1  THR 124           HG1      THR 124 135.347 -10.681  -8.223
  353   1HG2  THR 124          1HG2      THR 124 131.974 -10.470  -8.433
  354   2HG2  THR 124          2HG2      THR 124 133.437  -9.750  -7.760
  355   3HG2  THR 124          3HG2      THR 124 132.609 -11.042  -6.891
  356    H    GLY 125           H        GLY 125 133.668 -13.265 -10.920
  357   1HA   GLY 125          2HA       GLY 125 135.039 -15.821 -10.818
  358   2HA   GLY 125          1HA       GLY 125 134.642 -14.905 -12.264
  359    H    GLU 126           H        GLU 126 135.864 -12.445 -11.167
  360    HA   GLU 126           HA       GLU 126 138.489 -12.847 -12.180
  361   1HB   GLU 126          2HB       GLU 126 137.315 -10.494 -10.687
  362   2HB   GLU 126          1HB       GLU 126 138.856 -10.487 -11.533
  363   1HG   GLU 126          2HG       GLU 126 136.368 -11.221 -13.004
  364   2HG   GLU 126          1HG       GLU 126 136.724  -9.526 -12.670
  365    H    THR 127           H        THR 127 140.349 -13.292 -11.165
  366    HA   THR 127           HA       THR 127 140.267 -13.971  -8.363
  367    HB   THR 127           HB       THR 127 142.769 -14.468  -8.848
  368    HG1  THR 127           HG1      THR 127 143.167 -14.773 -11.077
  369   1HG2  THR 127          1HG2      THR 127 141.807 -16.382 -10.555
  370   2HG2  THR 127          2HG2      THR 127 140.386 -15.943  -9.607
  371   3HG2  THR 127          3HG2      THR 127 141.854 -16.490  -8.796
  372    H    ILE 128           H        ILE 128 140.288 -12.305  -6.979
  373    HA   ILE 128           HA       ILE 128 142.114 -10.063  -7.476
  374    HB   ILE 128           HB       ILE 128 139.974 -10.230  -5.357
  375   1HG1  ILE 128          2HG1      ILE 128 138.991 -10.471  -7.612
  376   2HG1  ILE 128          1HG1      ILE 128 138.543  -8.945  -6.855
  377   1HG2  ILE 128          1HG2      ILE 128 141.298  -8.493  -4.693
  378   2HG2  ILE 128          2HG2      ILE 128 140.222  -7.642  -5.800
  379   3HG2  ILE 128          3HG2      ILE 128 141.831  -8.127  -6.335
  380   1HD1  ILE 128          1HD1      ILE 128 139.210  -8.941  -9.326
  381   2HD1  ILE 128          2HD1      ILE 128 140.863  -9.109  -8.734
  382   3HD1  ILE 128          3HD1      ILE 128 139.900  -7.706  -8.271
  383    H    THR 129           H        THR 129 143.484  -9.281  -5.804
  384    HA   THR 129           HA       THR 129 144.154 -11.308  -3.771
  385    HB   THR 129           HB       THR 129 146.502 -10.293  -3.937
  386    HG1  THR 129           HG1      THR 129 146.971  -9.198  -5.802
  387   1HG2  THR 129          1HG2      THR 129 146.555 -12.375  -4.826
  388   2HG2  THR 129          2HG2      THR 129 146.847 -11.440  -6.291
  389   3HG2  THR 129          3HG2      THR 129 145.232 -12.056  -5.946
  390    H    GLU 130           H        GLU 130 145.385 -10.355  -1.886
  391    HA   GLU 130           HA       GLU 130 143.819  -8.445  -0.587
  392   1HB   GLU 130          2HB       GLU 130 146.671  -9.258   0.005
  393   2HB   GLU 130          1HB       GLU 130 145.613  -8.389   1.108
  394   1HG   GLU 130          2HG       GLU 130 144.035 -10.403   0.836
  395   2HG   GLU 130          1HG       GLU 130 145.453 -11.231   0.191
  396    H    ASP 131           H        ASP 131 146.636  -8.094  -2.613
  397    HA   ASP 131           HA       ASP 131 147.245  -5.412  -1.878
  398   1HB   ASP 131          2HB       ASP 131 148.568  -7.319  -3.280
  399   2HB   ASP 131          1HB       ASP 131 147.976  -6.312  -4.599
  400    H    ASP 132           H        ASP 132 145.131  -6.896  -4.240
  401    HA   ASP 132           HA       ASP 132 144.624  -4.512  -5.725
  402   1HB   ASP 132          2HB       ASP 132 143.505  -7.267  -5.641
  403   2HB   ASP 132          1HB       ASP 132 142.486  -6.005  -6.329
  404    H    ILE 133           H        ILE 133 142.969  -6.195  -3.090
  405    HA   ILE 133           HA       ILE 133 140.690  -4.529  -3.012
  406    HB   ILE 133           HB       ILE 133 141.890  -6.034  -0.687
  407   1HG1  ILE 133          2HG1      ILE 133 141.639  -7.567  -2.549
  408   2HG1  ILE 133          1HG1      ILE 133 140.373  -7.882  -1.369
  409   1HG2  ILE 133          1HG2      ILE 133 139.300  -4.689  -1.204
  410   2HG2  ILE 133          2HG2      ILE 133 140.225  -4.835   0.290
  411   3HG2  ILE 133          3HG2      ILE 133 139.270  -6.198  -0.293
  412   1HD1  ILE 133          1HD1      ILE 133 140.162  -6.630  -4.072
  413   2HD1  ILE 133          2HD1      ILE 133 138.931  -6.341  -2.842
  414   3HD1  ILE 133          3HD1      ILE 133 139.260  -7.984  -3.391
  415    H    GLU 134           H        GLU 134 143.914  -4.175  -1.764
  416    HA   GLU 134           HA       GLU 134 143.478  -2.304   0.265
  417   1HB   GLU 134          2HB       GLU 134 145.777  -3.042  -1.474
  418   2HB   GLU 134          1HB       GLU 134 145.881  -1.520  -0.600
  419   1HG   GLU 134          2HG       GLU 134 145.642  -2.633   1.502
  420   2HG   GLU 134          1HG       GLU 134 145.302  -4.168   0.703
  421    H    GLU 135           H        GLU 135 143.573  -1.943  -3.208
  422    HA   GLU 135           HA       GLU 135 143.814   0.892  -3.244
  423   1HB   GLU 135          2HB       GLU 135 142.757  -1.028  -5.326
  424   2HB   GLU 135          1HB       GLU 135 143.064   0.680  -5.611
  425   1HG   GLU 135          2HG       GLU 135 145.435  -0.276  -4.535
  426   2HG   GLU 135          1HG       GLU 135 144.890  -1.557  -5.615
  427    H    LEU 136           H        LEU 136 141.085  -1.341  -3.240
  428    HA   LEU 136           HA       LEU 136 139.069   0.565  -3.746
  429   1HB   LEU 136          2HB       LEU 136 139.225  -2.227  -2.919
  430   2HB   LEU 136          1HB       LEU 136 137.874  -1.384  -2.185
  431    HG   LEU 136           HG       LEU 136 137.585  -0.599  -4.763
  432   1HD1  LEU 136          1HD1      LEU 136 138.141  -3.453  -5.227
  433   2HD1  LEU 136          2HD1      LEU 136 139.554  -2.408  -5.070
  434   3HD1  LEU 136          3HD1      LEU 136 138.337  -2.065  -6.298
  435   1HD2  LEU 136          1HD2      LEU 136 135.660  -1.376  -3.856
  436   2HD2  LEU 136          2HD2      LEU 136 136.448  -2.755  -3.089
  437   3HD2  LEU 136          3HD2      LEU 136 136.072  -2.800  -4.811
  438    H    MET 137           H        MET 137 140.393  -0.734  -0.721
  439    HA   MET 137           HA       MET 137 138.688   0.857   0.937
  440   1HB   MET 137          2HB       MET 137 141.275  -0.457   1.763
  441   2HB   MET 137          1HB       MET 137 139.904  -0.042   2.782
  442   1HG   MET 137          2HG       MET 137 140.004  -2.179   0.669
  443   2HG   MET 137          1HG       MET 137 139.946  -2.411   2.416
  444   1HE   MET 137          1HE       MET 137 138.138  -2.014   3.886
  445   2HE   MET 137          2HE       MET 137 136.430  -1.874   3.466
  446   3HE   MET 137          3HE       MET 137 137.459  -0.441   3.465
  447    H    LYS 138           H        LYS 138 141.829   1.261  -0.512
  448    HA   LYS 138           HA       LYS 138 142.893   3.267   1.101
  449   1HB   LYS 138          2HB       LYS 138 143.416   2.151  -1.514
  450   2HB   LYS 138          1HB       LYS 138 143.664   3.892  -1.523
  451   1HG   LYS 138          2HG       LYS 138 145.078   3.525   0.569
  452   2HG   LYS 138          1HG       LYS 138 145.046   1.814   0.135
  453   1HD   LYS 138          2HD       LYS 138 146.525   2.098  -1.521
  454   2HD   LYS 138          1HD       LYS 138 145.714   3.551  -2.110
  455   1HE   LYS 138          2HE       LYS 138 146.763   4.660  -0.002
  456   2HE   LYS 138          1HE       LYS 138 147.859   3.280  -0.043
  457   1HZ   LYS 138          1HZ       LYS 138 147.606   5.511  -1.920
  458   2HZ   LYS 138          2HZ       LYS 138 148.052   4.005  -2.545
  459   3HZ   LYS 138          3HZ       LYS 138 148.996   4.734  -1.346
  460    H    ASP 139           H        ASP 139 141.065   3.661  -1.938
  461    HA   ASP 139           HA       ASP 139 140.751   6.486  -1.481
  462   1HB   ASP 139          2HB       ASP 139 139.674   6.559  -3.608
  463   2HB   ASP 139          1HB       ASP 139 141.013   5.426  -3.757
  464    H    GLY 140           H        GLY 140 139.003   3.641  -0.678
  465   1HA   GLY 140          2HA       GLY 140 136.429   4.922  -0.458
  466   2HA   GLY 140          1HA       GLY 140 136.841   3.302   0.086
  467    H    ASP 141           H        ASP 141 139.151   4.358   1.641
  468    HA   ASP 141           HA       ASP 141 137.676   4.931   4.054
  469   1HB   ASP 141          2HB       ASP 141 139.640   3.382   3.993
  470   2HB   ASP 141          1HB       ASP 141 140.672   4.772   3.669
  471    H    LYS 142           H        LYS 142 137.055   6.929   4.523
  472    HA   LYS 142           HA       LYS 142 138.646   9.194   3.561
  473   1HB   LYS 142          2HB       LYS 142 135.865   9.135   4.744
  474   2HB   LYS 142          1HB       LYS 142 136.673  10.557   4.102
  475   1HG   LYS 142          2HG       LYS 142 136.160   8.121   2.428
  476   2HG   LYS 142          1HG       LYS 142 134.973   9.415   2.607
  477   1HD   LYS 142          2HD       LYS 142 137.785  10.050   1.806
  478   2HD   LYS 142          1HD       LYS 142 136.632   9.462   0.606
  479   1HE   LYS 142          2HE       LYS 142 136.260  11.699   0.398
  480   2HE   LYS 142          1HE       LYS 142 135.115  11.343   1.690
  481   1HZ   LYS 142          1HZ       LYS 142 137.817  12.007   2.527
  482   2HZ   LYS 142          2HZ       LYS 142 136.333  12.464   3.196
  483   3HZ   LYS 142          3HZ       LYS 142 136.932  13.271   1.836
  484    H    ASN 143           H        ASN 143 137.676   7.550   6.458
  485    HA   ASN 143           HA       ASN 143 138.504   9.703   8.207
  486   1HB   ASN 143          2HB       ASN 143 137.494   6.904   8.689
  487   2HB   ASN 143          1HB       ASN 143 138.082   7.924   9.998
  488   1HD2  ASN 143          1HD2      ASN 143 136.799   9.481  10.805
  489   2HD2  ASN 143          2HD2      ASN 143 135.201   9.817  10.243
  490    H    ASN 144           H        ASN 144 139.969   7.046   6.633
  491    HA   ASN 144           HA       ASN 144 142.094   6.248   6.625
  492   1HB   ASN 144          2HB       ASN 144 142.350   8.909   7.816
  493   2HB   ASN 144          1HB       ASN 144 143.616   7.801   8.333
  494   1HD2  ASN 144          1HD2      ASN 144 144.070  10.076   6.784
  495   2HD2  ASN 144          2HD2      ASN 144 144.633   9.575   5.228
  496    H    ASP 145           H        ASP 145 140.129   5.364   8.573
  497    HA   ASP 145           HA       ASP 145 141.708   4.749  10.946
  498   1HB   ASP 145          2HB       ASP 145 139.627   3.779  11.825
  499   2HB   ASP 145          1HB       ASP 145 139.372   5.428  11.260
  500    H    GLY 146           H        GLY 146 140.656   3.284   7.989
  501   1HA   GLY 146          2HA       GLY 146 142.073   1.356   7.316
  502   2HA   GLY 146          1HA       GLY 146 141.761   0.704   8.918
  503    H    ARG 147           H        ARG 147 138.908   1.801   8.601
  504    HA   ARG 147           HA       ARG 147 137.911  -0.271   6.764
  505   1HB   ARG 147          2HB       ARG 147 136.941   0.364   9.552
  506   2HB   ARG 147          1HB       ARG 147 136.017  -0.596   8.403
  507   1HG   ARG 147          2HG       ARG 147 138.352  -1.915   8.317
  508   2HG   ARG 147          1HG       ARG 147 138.410  -1.298   9.969
  509   1HD   ARG 147          2HD       ARG 147 135.913  -2.192   9.984
  510   2HD   ARG 147          1HD       ARG 147 136.551  -3.252   8.729
  511    HE   ARG 147           HE       ARG 147 137.747  -4.375  10.328
  512   1HH1  ARG 147          1HH1      ARG 147 136.596  -1.368  11.672
  513   2HH1  ARG 147          2HH1      ARG 147 137.078  -1.760  13.288
  514   1HH2  ARG 147          1HH2      ARG 147 138.383  -4.893  12.454
  515   2HH2  ARG 147          2HH2      ARG 147 138.093  -3.762  13.733
  516    H    ILE 148           H        ILE 148 135.455   0.079   6.397
  517    HA   ILE 148           HA       ILE 148 134.999   2.962   5.970
  518    HB   ILE 148           HB       ILE 148 133.934   0.719   4.253
  519   1HG1  ILE 148          2HG1      ILE 148 136.082   2.656   3.429
  520   2HG1  ILE 148          1HG1      ILE 148 136.490   1.152   4.249
  521   1HG2  ILE 148          1HG2      ILE 148 133.965   3.707   3.839
  522   2HG2  ILE 148          2HG2      ILE 148 132.558   2.735   4.268
  523   3HG2  ILE 148          3HG2      ILE 148 133.340   2.510   2.704
  524   1HD1  ILE 148          1HD1      ILE 148 134.939   1.346   1.679
  525   2HD1  ILE 148          2HD1      ILE 148 135.485  -0.130   2.475
  526   3HD1  ILE 148          3HD1      ILE 148 136.664   0.997   1.805
  527    H    ASP 149           H        ASP 149 132.871   3.745   6.181
  528    HA   ASP 149           HA       ASP 149 130.938   1.923   7.432
  529   1HB   ASP 149          2HB       ASP 149 130.368   3.667   9.091
  530   2HB   ASP 149          1HB       ASP 149 132.033   3.116   9.255
  531    H    TYR 150           H        TYR 150 128.828   3.460   7.844
  532    HA   TYR 150           HA       TYR 150 127.732   3.866   5.304
  533   1HB   TYR 150          2HB       TYR 150 126.419   3.429   7.372
  534   2HB   TYR 150          1HB       TYR 150 126.780   5.065   7.914
  535    HD1  TYR 150           HD1      TYR 150 124.861   6.344   7.822
  536    HD2  TYR 150           HD2      TYR 150 125.689   3.668   4.619
  537    HE1  TYR 150           HE1      TYR 150 122.884   7.179   6.621
  538    HE2  TYR 150           HE2      TYR 150 123.716   4.496   3.408
  539    HH   TYR 150           HH       TYR 150 121.560   5.609   3.946
  540    H    ASP 151           H        ASP 151 129.095   6.167   7.622
  541    HA   ASP 151           HA       ASP 151 128.435   8.516   6.226
  542   1HB   ASP 151          2HB       ASP 151 130.296   7.776   8.406
  543   2HB   ASP 151          1HB       ASP 151 130.701   9.242   7.517
  544    H    GLU 152           H        GLU 152 131.428   6.587   6.227
  545    HA   GLU 152           HA       GLU 152 132.785   8.175   4.328
  546   1HB   GLU 152          2HB       GLU 152 133.206   5.235   4.891
  547   2HB   GLU 152          1HB       GLU 152 134.366   6.348   4.176
  548   1HG   GLU 152          2HG       GLU 152 134.396   7.619   6.289
  549   2HG   GLU 152          1HG       GLU 152 133.313   6.420   6.993
  550    H    PHE 153           H        PHE 153 130.759   5.293   4.026
  551    HA   PHE 153           HA       PHE 153 131.184   4.791   1.305
  552   1HB   PHE 153          2HB       PHE 153 130.013   3.289   2.971
  553   2HB   PHE 153          1HB       PHE 153 128.593   4.314   2.784
  554    HD1  PHE 153           HD1      PHE 153 126.975   3.383   1.468
  555    HD2  PHE 153           HD2      PHE 153 131.059   2.723   0.471
  556    HE1  PHE 153           HE1      PHE 153 126.279   2.064  -0.489
  557    HE2  PHE 153           HE2      PHE 153 130.371   1.405  -1.489
  558    HZ   PHE 153           HZ       PHE 153 127.979   1.073  -1.971
  559    H    LEU 154           H        LEU 154 128.858   6.892   2.942
  560    HA   LEU 154           HA       LEU 154 127.394   7.625   0.644
  561   1HB   LEU 154          2HB       LEU 154 127.389   8.250   3.410
  562   2HB   LEU 154          1HB       LEU 154 127.444   9.769   2.537
  563    HG   LEU 154           HG       LEU 154 125.147   9.157   3.021
  564   1HD1  LEU 154          1HD1      LEU 154 124.280   9.074   0.650
  565   2HD1  LEU 154          2HD1      LEU 154 125.962   8.989   0.133
  566   3HD1  LEU 154          3HD1      LEU 154 125.386  10.395   1.027
  567   1HD2  LEU 154          1HD2      LEU 154 124.873   6.918   3.210
  568   2HD2  LEU 154          2HD2      LEU 154 126.024   6.558   1.922
  569   3HD2  LEU 154          3HD2      LEU 154 124.388   7.077   1.522
  570    H    GLU 155           H        GLU 155 130.063   9.258   2.343
  571    HA   GLU 155           HA       GLU 155 130.252  11.427   0.546
  572   1HB   GLU 155          2HB       GLU 155 132.187  10.233   2.524
  573   2HB   GLU 155          1HB       GLU 155 132.599  11.633   1.542
  574   1HG   GLU 155          2HG       GLU 155 130.053  12.012   2.822
  575   2HG   GLU 155          1HG       GLU 155 131.294  11.605   4.006
  576    H    PHE 156           H        PHE 156 132.056   8.377   0.781
  577    HA   PHE 156           HA       PHE 156 133.814   8.833  -1.350
  578   1HB   PHE 156          2HB       PHE 156 134.126   7.024   0.282
  579   2HB   PHE 156          1HB       PHE 156 132.702   6.203  -0.346
  580    HD1  PHE 156           HD1      PHE 156 133.402   4.252  -1.344
  581    HD2  PHE 156           HD2      PHE 156 135.566   7.843  -2.078
  582    HE1  PHE 156           HE1      PHE 156 134.808   3.066  -2.980
  583    HE2  PHE 156           HE2      PHE 156 136.974   6.664  -3.715
  584    HZ   PHE 156           HZ       PHE 156 136.594   4.273  -4.169
  585    H    MET 157           H        MET 157 130.497   7.749  -1.276
  586    HA   MET 157           HA       MET 157 130.553   7.305  -4.179
  587   1HB   MET 157          2HB       MET 157 128.615   6.457  -2.033
  588   2HB   MET 157          1HB       MET 157 128.228   6.342  -3.743
  589   1HG   MET 157          2HG       MET 157 130.750   5.117  -2.741
  590   2HG   MET 157          1HG       MET 157 129.215   4.301  -2.449
  591   1HE   MET 157          1HE       MET 157 127.432   4.671  -4.571
  592   2HE   MET 157          2HE       MET 157 127.843   2.956  -4.522
  593   3HE   MET 157          3HE       MET 157 127.848   3.820  -6.059
  594    H    LYS 158           H        LYS 158 130.497   9.941  -2.728
  595    HA   LYS 158           HA       LYS 158 127.874  10.987  -3.434
  596   1HB   LYS 158          2HB       LYS 158 129.418  11.574  -1.352
  597   2HB   LYS 158          1HB       LYS 158 130.070  12.756  -2.479
  598   1HG   LYS 158          2HG       LYS 158 128.138  13.973  -2.541
  599   2HG   LYS 158          1HG       LYS 158 127.120  12.581  -2.163
  600   1HD   LYS 158          2HD       LYS 158 127.076  13.232  -0.038
  601   2HD   LYS 158          1HD       LYS 158 128.818  12.971   0.056
  602   1HE   LYS 158          2HE       LYS 158 128.702  15.380  -1.198
  603   2HE   LYS 158          1HE       LYS 158 127.285  15.467  -0.154
  604   1HZ   LYS 158          1HZ       LYS 158 130.101  15.448   0.542
  605   2HZ   LYS 158          2HZ       LYS 158 129.103  14.522   1.546
  606   3HZ   LYS 158          3HZ       LYS 158 128.792  16.171   1.336
  607    H    GLY 159           H        GLY 159 129.911  10.082  -5.472
  608   1HA   GLY 159          2HA       GLY 159 129.887  10.922  -7.718
  609   2HA   GLY 159          1HA       GLY 159 129.842  12.553  -7.067
  610    H    VAL 160           H        VAL 160 131.938   9.674  -6.865
  611    HA   VAL 160           HA       VAL 160 134.272  11.442  -6.864
  612    HB   VAL 160           HB       VAL 160 135.510   9.268  -6.358
  613   1HG1  VAL 160          1HG1      VAL 160 135.340  10.704  -4.558
  614   2HG1  VAL 160          2HG1      VAL 160 134.534   9.259  -3.948
  615   3HG1  VAL 160          3HG1      VAL 160 133.578  10.623  -4.527
  616   1HG2  VAL 160          1HG2      VAL 160 132.739   8.287  -5.695
  617   2HG2  VAL 160          2HG2      VAL 160 134.259   7.409  -5.520
  618   3HG2  VAL 160          3HG2      VAL 160 133.646   7.799  -7.126
  619    H    GLU 161           H        GLU 161 132.748   8.852  -8.681
  620    HA   GLU 161           HA       GLU 161 134.935   8.689 -10.573
  621   1HB   GLU 161          2HB       GLU 161 133.385   7.088 -11.758
  622   2HB   GLU 161          1HB       GLU 161 133.837   6.627 -10.123
  623   1HG   GLU 161          2HG       GLU 161 131.722   6.579  -9.477
  624   2HG   GLU 161          1HG       GLU 161 131.435   8.206 -10.095
  Start of MODEL   15
    1   1H    MET  81          1HT       MET  81  92.274  16.726  -1.859
    2   2H    MET  81          2HT       MET  81  91.479  16.607  -0.343
    3   3H    MET  81          3HT       MET  81  91.469  15.275  -1.426
    4    HA   MET  81           HA       MET  81  93.652  16.348   0.197
    5   1HB   MET  81          2HB       MET  81  93.795  14.065   0.947
    6   2HB   MET  81          1HB       MET  81  92.113  14.568   1.031
    7   1HG   MET  81          2HG       MET  81  92.243  13.477  -1.462
    8   2HG   MET  81          1HG       MET  81  93.380  12.473  -0.566
    9   1HE   MET  81          1HE       MET  81  89.237  13.036  -0.917
   10   2HE   MET  81          2HE       MET  81  89.481  11.314  -1.204
   11   3HE   MET  81          3HE       MET  81  90.489  12.497  -2.036
   12    H    VAL  82           H        VAL  82  95.737  15.173  -0.127
   13    HA   VAL  82           HA       VAL  82  96.277  14.880  -3.008
   14    HB   VAL  82           HB       VAL  82  98.322  15.489  -0.877
   15   1HG1  VAL  82          1HG1      VAL  82  98.555  14.733  -3.557
   16   2HG1  VAL  82          2HG1      VAL  82  99.821  15.379  -2.513
   17   3HG1  VAL  82          3HG1      VAL  82  98.875  16.466  -3.528
   18   1HG2  VAL  82          1HG2      VAL  82  98.076  17.827  -2.179
   19   2HG2  VAL  82          2HG2      VAL  82  97.208  17.449  -0.691
   20   3HG2  VAL  82          3HG2      VAL  82  96.406  17.266  -2.251
   21    H    ARG  83           H        ARG  83  95.394  12.820  -0.953
   22    HA   ARG  83           HA       ARG  83  95.835  10.658  -0.391
   23   1HB   ARG  83          2HB       ARG  83  96.895  11.055  -3.102
   24   2HB   ARG  83          1HB       ARG  83  97.586   9.675  -2.259
   25   1HG   ARG  83          2HG       ARG  83  95.744   8.839  -3.445
   26   2HG   ARG  83          1HG       ARG  83  95.209   8.957  -1.768
   27   1HD   ARG  83          2HD       ARG  83  94.415  11.347  -2.556
   28   2HD   ARG  83          1HD       ARG  83  94.419  10.574  -4.140
   29    HE   ARG  83           HE       ARG  83  92.541  10.157  -2.026
   30   1HH1  ARG  83          1HH1      ARG  83  94.086   8.632  -4.759
   31   2HH1  ARG  83          2HH1      ARG  83  92.799   7.505  -5.016
   32   1HH2  ARG  83          1HH2      ARG  83  90.847   8.673  -2.362
   33   2HH2  ARG  83          2HH2      ARG  83  90.959   7.527  -3.657
   34    H    CYS  84           H        CYS  84  97.919   8.998  -0.404
   35    HA   CYS  84           HA       CYS  84 100.001  10.459   1.082
   36   1HB   CYS  84          2HB       CYS  84  99.007   7.627   1.461
   37   2HB   CYS  84          1HB       CYS  84 100.356   8.341   2.335
   38    HG   CYS  84           HG       CYS  84  98.582   8.875   3.959
   39    H    MET  85           H        MET  85 101.991   8.727   1.286
   40    HA   MET  85           HA       MET  85 103.774   7.801   0.222
   41   1HB   MET  85          2HB       MET  85 101.454   6.807  -1.290
   42   2HB   MET  85          1HB       MET  85 102.965   6.790  -2.189
   43   1HG   MET  85          2HG       MET  85 103.773   5.712   0.148
   44   2HG   MET  85          1HG       MET  85 102.101   5.158   0.094
   45   1HE   MET  85          1HE       MET  85 101.719   3.051  -0.430
   46   2HE   MET  85          2HE       MET  85 102.336   2.080  -1.769
   47   3HE   MET  85          3HE       MET  85 101.206   3.398  -2.082
   48    H    LYS  86           H        LYS  86 103.087  10.575  -0.191
   49    HA   LYS  86           HA       LYS  86 103.359  11.402  -2.853
   50   1HB   LYS  86          2HB       LYS  86 102.673  12.843  -0.920
   51   2HB   LYS  86          1HB       LYS  86 104.354  12.872  -0.409
   52   1HG   LYS  86          2HG       LYS  86 104.729  13.714  -2.880
   53   2HG   LYS  86          1HG       LYS  86 103.045  14.213  -2.709
   54   1HD   LYS  86          2HD       LYS  86 105.197  14.917  -0.721
   55   2HD   LYS  86          1HD       LYS  86 104.752  15.951  -2.081
   56   1HE   LYS  86          2HE       LYS  86 102.798  16.582  -1.135
   57   2HE   LYS  86          1HE       LYS  86 102.524  15.004  -0.397
   58   1HZ   LYS  86          1HZ       LYS  86 102.906  16.559   1.334
   59   2HZ   LYS  86          2HZ       LYS  86 104.299  17.166   0.591
   60   3HZ   LYS  86          3HZ       LYS  86 104.297  15.599   1.229
   61    H    ASP  87           H        ASP  87 105.822  10.933  -0.336
   62    HA   ASP  87           HA       ASP  87 107.966  11.470  -2.205
   63   1HB   ASP  87          2HB       ASP  87 109.448  11.058  -0.288
   64   2HB   ASP  87          1HB       ASP  87 108.178  12.205   0.125
   65    H    ASP  88           H        ASP  88 106.366   8.714  -0.790
   66    HA   ASP  88           HA       ASP  88 108.268   6.729  -1.247
   67   1HB   ASP  88          2HB       ASP  88 105.565   6.846  -0.427
   68   2HB   ASP  88          1HB       ASP  88 105.635   5.700  -1.763
   69    H    SER  89           H        SER  89 106.314   8.485  -3.480
   70    HA   SER  89           HA       SER  89 106.785   6.544  -5.615
   71   1HB   SER  89          2HB       SER  89 104.951   8.865  -5.241
   72   2HB   SER  89          1HB       SER  89 105.433   8.455  -6.888
   73    HG   SER  89           HG       SER  89 103.590   7.302  -6.392
   74    H    LYS  90           H        LYS  90 109.058   7.867  -4.560
   75    HA   LYS  90           HA       LYS  90 109.822   9.577  -6.838
   76   1HB   LYS  90          2HB       LYS  90 109.777  10.391  -4.269
   77   2HB   LYS  90          1HB       LYS  90 111.403   9.724  -4.335
   78   1HG   LYS  90          2HG       LYS  90 111.254  11.235  -6.629
   79   2HG   LYS  90          1HG       LYS  90 110.347  12.188  -5.454
   80   1HD   LYS  90          2HD       LYS  90 112.186  12.376  -4.016
   81   2HD   LYS  90          1HD       LYS  90 113.040  11.036  -4.790
   82   1HE   LYS  90          2HE       LYS  90 113.270  12.416  -6.829
   83   2HE   LYS  90          1HE       LYS  90 112.506  13.758  -5.978
   84   1HZ   LYS  90          1HZ       LYS  90 114.455  13.142  -4.279
   85   2HZ   LYS  90          2HZ       LYS  90 114.632  14.278  -5.519
   86   3HZ   LYS  90          3HZ       LYS  90 115.199  12.698  -5.731
   87    H    GLY  91           H        GLY  91 112.409   9.630  -6.883
   88   1HA   GLY  91          2HA       GLY  91 113.181   7.019  -7.703
   89   2HA   GLY  91          1HA       GLY  91 114.226   8.429  -7.625
   90    H    LYS  92           H        LYS  92 115.980   7.862  -6.517
   91    HA   LYS  92           HA       LYS  92 115.617   6.329  -4.028
   92   1HB   LYS  92          2HB       LYS  92 117.961   5.623  -4.293
   93   2HB   LYS  92          1HB       LYS  92 116.971   5.143  -5.666
   94   1HG   LYS  92          2HG       LYS  92 117.957   7.611  -6.411
   95   2HG   LYS  92          1HG       LYS  92 119.308   6.857  -5.563
   96   1HD   LYS  92          2HD       LYS  92 118.439   4.791  -7.089
   97   2HD   LYS  92          1HD       LYS  92 118.055   6.161  -8.132
   98   1HE   LYS  92          2HE       LYS  92 120.563   6.800  -7.284
   99   2HE   LYS  92          1HE       LYS  92 120.654   5.041  -7.357
  100   1HZ   LYS  92          1HZ       LYS  92 119.920   5.117  -9.645
  101   2HZ   LYS  92          2HZ       LYS  92 121.296   6.082  -9.452
  102   3HZ   LYS  92          3HZ       LYS  92 119.771   6.802  -9.580
  103    H    THR  93           H        THR  93 116.034   7.327  -2.172
  104    HA   THR  93           HA       THR  93 117.147  10.005  -2.219
  105    HB   THR  93           HB       THR  93 116.482   8.738   0.372
  106    HG1  THR  93           HG1      THR  93 114.516   9.249  -1.606
  107   1HG2  THR  93          1HG2      THR  93 116.518  10.907   0.853
  108   2HG2  THR  93          2HG2      THR  93 114.937  10.978   0.076
  109   3HG2  THR  93          3HG2      THR  93 116.390  11.378  -0.840
  110    H    GLU  94           H        GLU  94 118.427  10.308   0.117
  111    HA   GLU  94           HA       GLU  94 120.988   9.216  -0.413
  112   1HB   GLU  94          2HB       GLU  94 120.073  11.367   0.989
  113   2HB   GLU  94          1HB       GLU  94 120.518  10.279   2.296
  114   1HG   GLU  94          2HG       GLU  94 122.481  11.391   2.005
  115   2HG   GLU  94          1HG       GLU  94 122.730  10.031   0.911
  116    H    GLU  95           H        GLU  95 118.420   8.386   1.838
  117    HA   GLU  95           HA       GLU  95 119.861   6.622   3.478
  118   1HB   GLU  95          2HB       GLU  95 117.211   7.509   3.271
  119   2HB   GLU  95          1HB       GLU  95 117.123   5.762   3.088
  120   1HG   GLU  95          2HG       GLU  95 117.011   5.820   5.329
  121   2HG   GLU  95          1HG       GLU  95 118.767   5.900   5.196
  122    H    GLU  96           H        GLU  96 118.486   6.242   0.301
  123    HA   GLU  96           HA       GLU  96 118.316   3.466   0.134
  124   1HB   GLU  96          2HB       GLU  96 118.961   5.519  -1.982
  125   2HB   GLU  96          1HB       GLU  96 118.665   3.823  -2.337
  126   1HG   GLU  96          2HG       GLU  96 116.666   5.479  -0.845
  127   2HG   GLU  96          1HG       GLU  96 116.733   5.474  -2.605
  128    H    LEU  97           H        LEU  97 121.083   5.565   0.081
  129    HA   LEU  97           HA       LEU  97 122.970   3.953  -1.176
  130   1HB   LEU  97          2HB       LEU  97 123.124   6.065   0.934
  131   2HB   LEU  97          1HB       LEU  97 124.564   5.149   0.531
  132    HG   LEU  97           HG       LEU  97 122.941   6.773  -1.431
  133   1HD1  LEU  97          1HD1      LEU  97 124.233   8.032   0.356
  134   2HD1  LEU  97          2HD1      LEU  97 124.602   8.429  -1.321
  135   3HD1  LEU  97          3HD1      LEU  97 125.692   7.393  -0.400
  136   1HD2  LEU  97          1HD2      LEU  97 125.508   5.222  -1.701
  137   2HD2  LEU  97          2HD2      LEU  97 124.951   6.413  -2.877
  138   3HD2  LEU  97          3HD2      LEU  97 123.996   4.963  -2.569
  139    H    SER  98           H        SER  98 121.577   3.728   2.008
  140    HA   SER  98           HA       SER  98 123.488   2.139   3.283
  141   1HB   SER  98          2HB       SER  98 121.437   3.235   4.315
  142   2HB   SER  98          1HB       SER  98 120.507   1.875   3.691
  143    HG   SER  98           HG       SER  98 121.077   1.009   5.531
  144    H    ASP  99           H        ASP  99 121.037   1.332   0.932
  145    HA   ASP  99           HA       ASP  99 121.037  -1.469   1.312
  146   1HB   ASP  99          2HB       ASP  99 119.549   0.250  -0.183
  147   2HB   ASP  99          1HB       ASP  99 120.553  -0.483  -1.430
  148    H    LEU 100           H        LEU 100 122.971   0.683  -0.705
  149    HA   LEU 100           HA       LEU 100 124.311  -1.390  -2.123
  150   1HB   LEU 100          2HB       LEU 100 124.734   1.547  -1.756
  151   2HB   LEU 100          1HB       LEU 100 126.011   0.580  -2.471
  152    HG   LEU 100           HG       LEU 100 123.276   0.330  -3.618
  153   1HD1  LEU 100          1HD1      LEU 100 125.011   2.520  -4.629
  154   2HD1  LEU 100          2HD1      LEU 100 124.011   2.825  -3.210
  155   3HD1  LEU 100          3HD1      LEU 100 123.261   2.326  -4.726
  156   1HD2  LEU 100          1HD2      LEU 100 126.096  -0.035  -4.460
  157   2HD2  LEU 100          2HD2      LEU 100 124.929   0.447  -5.691
  158   3HD2  LEU 100          3HD2      LEU 100 124.680  -1.038  -4.773
  159    H    PHE 101           H        PHE 101 124.903   0.319   0.875
  160    HA   PHE 101           HA       PHE 101 127.588  -0.438   1.257
  161   1HB   PHE 101          2HB       PHE 101 126.487   1.349   2.551
  162   2HB   PHE 101          1HB       PHE 101 125.472   0.146   3.341
  163    HD1  PHE 101           HD1      PHE 101 126.345  -1.282   5.066
  164    HD2  PHE 101           HD2      PHE 101 128.852   1.530   3.085
  165    HE1  PHE 101           HE1      PHE 101 128.054  -1.579   6.813
  166    HE2  PHE 101           HE2      PHE 101 130.564   1.235   4.826
  167    HZ   PHE 101           HZ       PHE 101 130.166  -0.320   6.693
  168    H    ARG 102           H        ARG 102 124.541  -2.004   2.101
  169    HA   ARG 102           HA       ARG 102 125.573  -4.066   3.693
  170   1HB   ARG 102          2HB       ARG 102 123.169  -3.501   3.523
  171   2HB   ARG 102          1HB       ARG 102 123.148  -4.151   1.891
  172   1HG   ARG 102          2HG       ARG 102 122.382  -5.973   2.983
  173   2HG   ARG 102          1HG       ARG 102 124.109  -6.285   3.158
  174   1HD   ARG 102          2HD       ARG 102 123.865  -4.885   5.338
  175   2HD   ARG 102          1HD       ARG 102 122.151  -5.266   5.175
  176    HE   ARG 102           HE       ARG 102 124.241  -7.039   5.995
  177   1HH1  ARG 102          1HH1      ARG 102 121.127  -6.883   4.425
  178   2HH1  ARG 102          2HH1      ARG 102 120.707  -8.516   4.821
  179   1HH2  ARG 102          1HH2      ARG 102 123.689  -9.186   6.517
  180   2HH2  ARG 102          2HH2      ARG 102 122.161  -9.823   6.008
  181    H    MET 103           H        MET 103 125.460  -3.653   0.234
  182    HA   MET 103           HA       MET 103 125.808  -6.291  -0.604
  183   1HB   MET 103          2HB       MET 103 126.868  -3.745  -1.840
  184   2HB   MET 103          1HB       MET 103 126.812  -5.304  -2.648
  185   1HG   MET 103          2HG       MET 103 124.248  -4.456  -1.538
  186   2HG   MET 103          1HG       MET 103 124.888  -3.379  -2.779
  187   1HE   MET 103          1HE       MET 103 125.220  -3.686  -4.898
  188   2HE   MET 103          2HE       MET 103 123.626  -4.173  -5.475
  189   3HE   MET 103          3HE       MET 103 125.047  -5.127  -5.901
  190    H    PHE 104           H        PHE 104 128.137  -3.925   0.559
  191    HA   PHE 104           HA       PHE 104 130.375  -5.701   0.038
  192   1HB   PHE 104          2HB       PHE 104 130.142  -2.919   1.168
  193   2HB   PHE 104          1HB       PHE 104 131.658  -3.812   1.214
  194    HD1  PHE 104           HD1      PHE 104 132.831  -4.374  -0.859
  195    HD2  PHE 104           HD2      PHE 104 129.298  -2.003  -0.869
  196    HE1  PHE 104           HE1      PHE 104 133.342  -3.630  -3.149
  197    HE2  PHE 104           HE2      PHE 104 129.799  -1.256  -3.159
  198    HZ   PHE 104           HZ       PHE 104 131.824  -2.071  -4.301
  199    H    ASP 105           H        ASP 105 128.381  -4.657   2.708
  200    HA   ASP 105           HA       ASP 105 130.053  -5.618   4.792
  201   1HB   ASP 105          2HB       ASP 105 127.819  -4.070   4.717
  202   2HB   ASP 105          1HB       ASP 105 127.143  -5.593   5.285
  203    H    LYS 106           H        LYS 106 130.156  -7.569   5.787
  204    HA   LYS 106           HA       LYS 106 128.728  -9.773   4.480
  205   1HB   LYS 106          2HB       LYS 106 131.189  -9.762   6.236
  206   2HB   LYS 106          1HB       LYS 106 130.435 -11.216   5.596
  207   1HG   LYS 106          2HG       LYS 106 131.225  -9.072   3.692
  208   2HG   LYS 106          1HG       LYS 106 132.481 -10.094   4.396
  209   1HD   LYS 106          2HD       LYS 106 131.862 -11.158   2.386
  210   2HD   LYS 106          1HD       LYS 106 131.066 -12.076   3.667
  211   1HE   LYS 106          2HE       LYS 106 128.978 -11.332   3.089
  212   2HE   LYS 106          1HE       LYS 106 129.585  -9.820   2.418
  213   1HZ   LYS 106          1HZ       LYS 106 128.781 -11.241   0.668
  214   2HZ   LYS 106          2HZ       LYS 106 129.793 -12.503   1.163
  215   3HZ   LYS 106          3HZ       LYS 106 130.460 -11.084   0.529
  216    H    ASN 107           H        ASN 107 129.855  -8.994   7.777
  217    HA   ASN 107           HA       ASN 107 127.760 -10.622   8.925
  218   1HB   ASN 107          2HB       ASN 107 128.776  -9.931  11.097
  219   2HB   ASN 107          1HB       ASN 107 129.923 -10.684   9.992
  220   1HD2  ASN 107          1HD2      ASN 107 131.631  -9.703  11.116
  221   2HD2  ASN 107          2HD2      ASN 107 132.005  -8.030  10.903
  222    H    ALA 108           H        ALA 108 128.183  -7.340   8.054
  223    HA   ALA 108           HA       ALA 108 126.806  -5.533   8.191
  224   1HB   ALA 108          1HB       ALA 108 124.519  -5.836   8.430
  225   2HB   ALA 108          2HB       ALA 108 124.711  -7.171   9.565
  226   3HB   ALA 108          3HB       ALA 108 125.061  -7.410   7.852
  227    H    ASP 109           H        ASP 109 128.710  -5.723  10.104
  228    HA   ASP 109           HA       ASP 109 127.510  -5.316  12.714
  229   1HB   ASP 109          2HB       ASP 109 129.847  -5.030  13.481
  230   2HB   ASP 109          1HB       ASP 109 129.608  -6.537  12.604
  231    H    GLY 110           H        GLY 110 128.425  -3.414  10.019
  232   1HA   GLY 110          2HA       GLY 110 127.440  -1.112  10.173
  233   2HA   GLY 110          1HA       GLY 110 128.321  -0.976  11.688
  234    H    TYR 111           H        TYR 111 130.581  -2.541  10.367
  235    HA   TYR 111           HA       TYR 111 131.609  -0.398   8.634
  236   1HB   TYR 111          2HB       TYR 111 133.140  -1.785  10.847
  237   2HB   TYR 111          1HB       TYR 111 133.818  -0.623   9.710
  238    HD1  TYR 111           HD1      TYR 111 131.133  -0.942  12.280
  239    HD2  TYR 111           HD2      TYR 111 133.865   1.629  10.274
  240    HE1  TYR 111           HE1      TYR 111 130.508   0.891  13.793
  241    HE2  TYR 111           HE2      TYR 111 133.249   3.471  11.782
  242    HH   TYR 111           HH       TYR 111 130.708   3.760  13.388
  243    H    ILE 112           H        ILE 112 133.569  -1.110   7.385
  244    HA   ILE 112           HA       ILE 112 133.469  -3.988   6.773
  245    HB   ILE 112           HB       ILE 112 133.768  -1.837   4.678
  246   1HG1  ILE 112          2HG1      ILE 112 131.315  -3.518   5.227
  247   2HG1  ILE 112          1HG1      ILE 112 131.504  -1.863   5.796
  248   1HG2  ILE 112          1HG2      ILE 112 134.740  -3.739   3.805
  249   2HG2  ILE 112          2HG2      ILE 112 133.074  -3.897   3.250
  250   3HG2  ILE 112          3HG2      ILE 112 133.629  -4.821   4.645
  251   1HD1  ILE 112          1HD1      ILE 112 130.284  -2.505   3.511
  252   2HD1  ILE 112          2HD1      ILE 112 131.932  -2.311   2.914
  253   3HD1  ILE 112          3HD1      ILE 112 131.136  -0.981   3.755
  254    H    ASP 113           H        ASP 113 135.396  -4.953   6.211
  255    HA   ASP 113           HA       ASP 113 137.797  -3.258   6.200
  256   1HB   ASP 113          2HB       ASP 113 138.941  -5.069   7.550
  257   2HB   ASP 113          1HB       ASP 113 137.742  -4.120   8.424
  258    H    LEU 114           H        LEU 114 139.772  -4.704   5.579
  259    HA   LEU 114           HA       LEU 114 139.423  -5.562   2.955
  260   1HB   LEU 114          2HB       LEU 114 141.597  -6.023   4.973
  261   2HB   LEU 114          1HB       LEU 114 141.685  -6.734   3.373
  262    HG   LEU 114           HG       LEU 114 141.118  -4.034   2.920
  263   1HD1  LEU 114          1HD1      LEU 114 143.524  -4.002   4.643
  264   2HD1  LEU 114          2HD1      LEU 114 141.954  -3.999   5.447
  265   3HD1  LEU 114          3HD1      LEU 114 142.356  -2.726   4.296
  266   1HD2  LEU 114          1HD2      LEU 114 143.386  -5.892   2.552
  267   2HD2  LEU 114          2HD2      LEU 114 143.744  -4.171   2.412
  268   3HD2  LEU 114          3HD2      LEU 114 142.522  -4.906   1.373
  269    H    GLU 115           H        GLU 115 139.156  -7.313   5.960
  270    HA   GLU 115           HA       GLU 115 139.322  -9.932   4.924
  271   1HB   GLU 115          2HB       GLU 115 138.520  -8.669   7.444
  272   2HB   GLU 115          1HB       GLU 115 137.656 -10.161   7.099
  273   1HG   GLU 115          2HG       GLU 115 139.498 -10.838   8.340
  274   2HG   GLU 115          1HG       GLU 115 139.953 -11.185   6.672
  275    H    GLU 116           H        GLU 116 136.618  -7.707   5.364
  276    HA   GLU 116           HA       GLU 116 134.608  -9.578   4.610
  277   1HB   GLU 116          2HB       GLU 116 134.711  -6.618   5.018
  278   2HB   GLU 116          1HB       GLU 116 133.322  -7.319   4.198
  279   1HG   GLU 116          2HG       GLU 116 132.905  -8.755   6.127
  280   2HG   GLU 116          1HG       GLU 116 134.299  -8.054   6.948
  281    H    LEU 117           H        LEU 117 136.490  -7.146   2.886
  282    HA   LEU 117           HA       LEU 117 135.057  -7.324   0.443
  283   1HB   LEU 117          2HB       LEU 117 137.940  -6.513   0.774
  284   2HB   LEU 117          1HB       LEU 117 136.849  -6.061  -0.522
  285    HG   LEU 117           HG       LEU 117 136.409  -5.234   2.341
  286   1HD1  LEU 117          1HD1      LEU 117 137.247  -2.982   1.427
  287   2HD1  LEU 117          2HD1      LEU 117 138.024  -3.946   0.172
  288   3HD1  LEU 117          3HD1      LEU 117 138.441  -4.204   1.865
  289   1HD2  LEU 117          1HD2      LEU 117 135.422  -3.667   0.043
  290   2HD2  LEU 117          2HD2      LEU 117 134.659  -4.014   1.596
  291   3HD2  LEU 117          3HD2      LEU 117 134.649  -5.229   0.316
  292    H    LYS 118           H        LYS 118 137.881  -8.991   1.737
  293    HA   LYS 118           HA       LYS 118 138.702 -10.292  -0.602
  294   1HB   LYS 118          2HB       LYS 118 140.007 -10.172   1.520
  295   2HB   LYS 118          1HB       LYS 118 138.899 -11.340   2.227
  296   1HG   LYS 118          2HG       LYS 118 139.547 -12.932   0.414
  297   2HG   LYS 118          1HG       LYS 118 140.789 -11.774  -0.072
  298   1HD   LYS 118          2HD       LYS 118 141.920 -11.988   2.007
  299   2HD   LYS 118          1HD       LYS 118 140.575 -12.880   2.722
  300   1HE   LYS 118          2HE       LYS 118 141.141 -14.456   0.602
  301   2HE   LYS 118          1HE       LYS 118 142.741 -13.804   0.951
  302   1HZ   LYS 118          1HZ       LYS 118 141.816 -15.952   2.140
  303   2HZ   LYS 118          2HZ       LYS 118 141.179 -14.803   3.207
  304   3HZ   LYS 118          3HZ       LYS 118 142.848 -14.869   2.934
  305    H    ILE 119           H        ILE 119 136.135 -10.998   1.656
  306    HA   ILE 119           HA       ILE 119 135.657 -13.667   0.754
  307    HB   ILE 119           HB       ILE 119 133.745 -11.829   2.200
  308   1HG1  ILE 119          2HG1      ILE 119 135.374 -13.929   3.572
  309   2HG1  ILE 119          1HG1      ILE 119 136.127 -12.381   3.199
  310   1HG2  ILE 119          1HG2      ILE 119 132.856 -14.046   3.038
  311   2HG2  ILE 119          2HG2      ILE 119 133.821 -14.804   1.772
  312   3HG2  ILE 119          3HG2      ILE 119 132.541 -13.669   1.344
  313   1HD1  ILE 119          1HD1      ILE 119 135.357 -11.951   5.290
  314   2HD1  ILE 119          2HD1      ILE 119 133.973 -13.032   5.126
  315   3HD1  ILE 119          3HD1      ILE 119 133.949 -11.447   4.355
  316    H    MET 120           H        MET 120 133.787 -10.651   0.340
  317    HA   MET 120           HA       MET 120 131.962 -11.664  -1.516
  318   1HB   MET 120          2HB       MET 120 131.540  -9.298  -2.109
  319   2HB   MET 120          1HB       MET 120 131.559  -9.570  -0.372
  320   1HG   MET 120          2HG       MET 120 133.405  -8.315  -0.053
  321   2HG   MET 120          1HG       MET 120 134.121  -8.775  -1.597
  322   1HE   MET 120          1HE       MET 120 133.936  -5.547  -3.337
  323   2HE   MET 120          2HE       MET 120 134.142  -7.268  -3.659
  324   3HE   MET 120          3HE       MET 120 134.987  -6.519  -2.306
  325    H    LEU 121           H        LEU 121 135.220 -10.494  -1.915
  326    HA   LEU 121           HA       LEU 121 135.078 -10.207  -4.760
  327   1HB   LEU 121          2HB       LEU 121 137.400 -10.367  -2.844
  328   2HB   LEU 121          1HB       LEU 121 137.593 -10.131  -4.571
  329    HG   LEU 121           HG       LEU 121 135.872  -8.247  -3.008
  330   1HD1  LEU 121          1HD1      LEU 121 138.415  -8.701  -2.175
  331   2HD1  LEU 121          2HD1      LEU 121 137.569  -7.161  -2.023
  332   3HD1  LEU 121          3HD1      LEU 121 138.666  -7.434  -3.377
  333   1HD2  LEU 121          1HD2      LEU 121 136.217  -8.395  -5.603
  334   2HD2  LEU 121          2HD2      LEU 121 137.709  -7.528  -5.241
  335   3HD2  LEU 121          3HD2      LEU 121 136.153  -6.831  -4.790
  336    H    GLN 122           H        GLN 122 135.852 -12.782  -2.539
  337    HA   GLN 122           HA       GLN 122 137.205 -14.500  -4.305
  338   1HB   GLN 122          2HB       GLN 122 135.819 -14.770  -1.701
  339   2HB   GLN 122          1HB       GLN 122 136.012 -16.250  -2.632
  340   1HG   GLN 122          2HG       GLN 122 138.503 -15.284  -2.817
  341   2HG   GLN 122          1HG       GLN 122 138.027 -14.586  -1.269
  342   1HE2  GLN 122          1HE2      GLN 122 137.036 -16.142   0.286
  343   2HE2  GLN 122          2HE2      GLN 122 137.722 -17.725   0.373
  344    H    ALA 123           H        ALA 123 133.817 -13.823  -3.834
  345    HA   ALA 123           HA       ALA 123 132.825 -16.109  -5.219
  346   1HB   ALA 123          1HB       ALA 123 131.129 -13.715  -5.214
  347   2HB   ALA 123          2HB       ALA 123 131.696 -14.222  -3.622
  348   3HB   ALA 123          3HB       ALA 123 130.793 -15.348  -4.639
  349    H    THR 124           H        THR 124 133.704 -12.834  -6.162
  350    HA   THR 124           HA       THR 124 132.580 -12.807  -8.725
  351    HB   THR 124           HB       THR 124 133.994 -10.950  -9.187
  352    HG1  THR 124           HG1      THR 124 135.669 -12.044  -7.197
  353   1HG2  THR 124          1HG2      THR 124 132.894  -9.754  -7.692
  354   2HG2  THR 124          2HG2      THR 124 134.183 -10.102  -6.540
  355   3HG2  THR 124          3HG2      THR 124 132.757 -11.137  -6.606
  356    H    GLY 125           H        GLY 125 134.024 -12.658 -10.762
  357   1HA   GLY 125          2HA       GLY 125 135.392 -15.219 -10.973
  358   2HA   GLY 125          1HA       GLY 125 134.940 -14.164 -12.305
  359    H    GLU 126           H        GLU 126 136.142 -11.784 -11.375
  360    HA   GLU 126           HA       GLU 126 138.757 -12.110 -12.354
  361   1HB   GLU 126          2HB       GLU 126 137.618  -9.833 -10.722
  362   2HB   GLU 126          1HB       GLU 126 139.106  -9.776 -11.659
  363   1HG   GLU 126          2HG       GLU 126 136.943 -10.648 -13.321
  364   2HG   GLU 126          1HG       GLU 126 136.510  -9.147 -12.503
  365    H    THR 127           H        THR 127 140.637 -12.589 -11.403
  366    HA   THR 127           HA       THR 127 140.680 -13.520  -8.713
  367    HB   THR 127           HB       THR 127 143.009 -14.018  -9.104
  368    HG1  THR 127           HG1      THR 127 143.958 -12.422 -10.134
  369   1HG2  THR 127          1HG2      THR 127 142.281 -14.572 -11.844
  370   2HG2  THR 127          2HG2      THR 127 141.000 -15.010 -10.714
  371   3HG2  THR 127          3HG2      THR 127 142.620 -15.679 -10.514
  372    H    ILE 128           H        ILE 128 140.466 -12.081  -7.106
  373    HA   ILE 128           HA       ILE 128 141.858  -9.517  -7.259
  374    HB   ILE 128           HB       ILE 128 139.985 -10.465  -5.093
  375   1HG1  ILE 128          2HG1      ILE 128 138.871 -10.489  -7.300
  376   2HG1  ILE 128          1HG1      ILE 128 138.219  -9.237  -6.245
  377   1HG2  ILE 128          1HG2      ILE 128 140.195  -8.439  -4.157
  378   2HG2  ILE 128          2HG2      ILE 128 140.197  -7.611  -5.714
  379   3HG2  ILE 128          3HG2      ILE 128 141.682  -8.335  -5.097
  380   1HD1  ILE 128          1HD1      ILE 128 138.450  -8.374  -8.467
  381   2HD1  ILE 128          2HD1      ILE 128 140.145  -8.854  -8.521
  382   3HD1  ILE 128          3HD1      ILE 128 139.624  -7.580  -7.418
  383    H    THR 129           H        THR 129 143.817  -9.326  -6.417
  384    HA   THR 129           HA       THR 129 144.779 -11.284  -4.493
  385    HB   THR 129           HB       THR 129 146.905  -9.700  -4.821
  386    HG1  THR 129           HG1      THR 129 146.457  -8.225  -6.235
  387   1HG2  THR 129          1HG2      THR 129 146.830 -11.093  -7.262
  388   2HG2  THR 129          2HG2      THR 129 145.997 -12.089  -6.068
  389   3HG2  THR 129          3HG2      THR 129 147.647 -11.546  -5.766
  390    H    GLU 130           H        GLU 130 146.493 -10.082  -2.902
  391    HA   GLU 130           HA       GLU 130 144.903  -8.837  -0.945
  392   1HB   GLU 130          2HB       GLU 130 147.890  -9.084  -1.272
  393   2HB   GLU 130          1HB       GLU 130 147.157  -8.304   0.122
  394   1HG   GLU 130          2HG       GLU 130 146.053 -10.941  -0.455
  395   2HG   GLU 130          1HG       GLU 130 147.775 -10.954  -0.079
  396    H    ASP 131           H        ASP 131 147.256  -7.511  -3.244
  397    HA   ASP 131           HA       ASP 131 147.084  -4.839  -2.325
  398   1HB   ASP 131          2HB       ASP 131 148.371  -6.275  -4.507
  399   2HB   ASP 131          1HB       ASP 131 147.784  -4.694  -5.017
  400    H    ASP 132           H        ASP 132 145.247  -6.710  -4.650
  401    HA   ASP 132           HA       ASP 132 143.912  -4.575  -5.916
  402   1HB   ASP 132          2HB       ASP 132 143.483  -7.508  -5.667
  403   2HB   ASP 132          1HB       ASP 132 142.111  -6.534  -6.188
  404    H    ILE 133           H        ILE 133 143.172  -6.459  -3.025
  405    HA   ILE 133           HA       ILE 133 140.591  -5.364  -2.593
  406    HB   ILE 133           HB       ILE 133 142.442  -6.523  -0.509
  407   1HG1  ILE 133          2HG1      ILE 133 140.304  -8.139  -1.816
  408   2HG1  ILE 133          1HG1      ILE 133 141.796  -7.873  -2.713
  409   1HG2  ILE 133          1HG2      ILE 133 139.432  -6.437  -0.577
  410   2HG2  ILE 133          2HG2      ILE 133 140.438  -5.279   0.294
  411   3HG2  ILE 133          3HG2      ILE 133 140.459  -6.983   0.749
  412   1HD1  ILE 133          1HD1      ILE 133 142.124  -8.750   0.074
  413   2HD1  ILE 133          2HD1      ILE 133 142.986  -9.237  -1.384
  414   3HD1  ILE 133          3HD1      ILE 133 141.401  -9.921  -1.027
  415    H    GLU 134           H        GLU 134 143.822  -4.346  -1.744
  416    HA   GLU 134           HA       GLU 134 143.195  -2.506   0.282
  417   1HB   GLU 134          2HB       GLU 134 145.466  -2.573  -1.707
  418   2HB   GLU 134          1HB       GLU 134 145.372  -1.419  -0.384
  419   1HG   GLU 134          2HG       GLU 134 145.344  -3.290   1.213
  420   2HG   GLU 134          1HG       GLU 134 145.522  -4.414  -0.134
  421    H    GLU 135           H        GLU 135 143.117  -2.257  -3.214
  422    HA   GLU 135           HA       GLU 135 142.912   0.533  -3.442
  423   1HB   GLU 135          2HB       GLU 135 141.697  -1.578  -5.233
  424   2HB   GLU 135          1HB       GLU 135 141.965   0.107  -5.660
  425   1HG   GLU 135          2HG       GLU 135 144.348  -0.187  -5.527
  426   2HG   GLU 135          1HG       GLU 135 144.147  -1.837  -4.942
  427    H    LEU 136           H        LEU 136 140.529  -1.935  -2.730
  428    HA   LEU 136           HA       LEU 136 138.220  -0.356  -3.127
  429   1HB   LEU 136          2HB       LEU 136 138.868  -2.975  -2.073
  430   2HB   LEU 136          1HB       LEU 136 137.617  -2.203  -1.115
  431    HG   LEU 136           HG       LEU 136 137.171  -2.030  -4.011
  432   1HD1  LEU 136          1HD1      LEU 136 136.595  -4.308  -4.373
  433   2HD1  LEU 136          2HD1      LEU 136 136.917  -4.722  -2.689
  434   3HD1  LEU 136          3HD1      LEU 136 138.248  -4.279  -3.758
  435   1HD2  LEU 136          1HD2      LEU 136 135.664  -1.575  -1.871
  436   2HD2  LEU 136          2HD2      LEU 136 135.274  -3.278  -2.106
  437   3HD2  LEU 136          3HD2      LEU 136 134.982  -2.121  -3.403
  438    H    MET 137           H        MET 137 140.314  -0.882  -0.341
  439    HA   MET 137           HA       MET 137 138.648   0.781   1.359
  440   1HB   MET 137          2HB       MET 137 140.404  -1.319   1.835
  441   2HB   MET 137          1HB       MET 137 141.267   0.093   2.429
  442   1HG   MET 137          2HG       MET 137 140.120  -0.135   4.308
  443   2HG   MET 137          1HG       MET 137 138.708   0.423   3.414
  444   1HE   MET 137          1HE       MET 137 136.731  -0.898   4.657
  445   2HE   MET 137          2HE       MET 137 136.323  -2.333   3.718
  446   3HE   MET 137          3HE       MET 137 136.739  -0.830   2.895
  447    H    LYS 138           H        LYS 138 141.555   1.026  -0.536
  448    HA   LYS 138           HA       LYS 138 142.755   3.253   0.633
  449   1HB   LYS 138          2HB       LYS 138 143.040   1.737  -1.776
  450   2HB   LYS 138          1HB       LYS 138 143.091   3.447  -2.181
  451   1HG   LYS 138          2HG       LYS 138 144.830   3.714  -0.389
  452   2HG   LYS 138          1HG       LYS 138 144.872   1.953  -0.276
  453   1HD   LYS 138          2HD       LYS 138 145.762   1.713  -2.409
  454   2HD   LYS 138          1HD       LYS 138 145.218   3.312  -2.921
  455   1HE   LYS 138          2HE       LYS 138 146.845   4.217  -1.162
  456   2HE   LYS 138          1HE       LYS 138 147.530   2.593  -1.145
  457   1HZ   LYS 138          1HZ       LYS 138 147.484   3.072  -3.755
  458   2HZ   LYS 138          2HZ       LYS 138 148.806   3.451  -2.769
  459   3HZ   LYS 138          3HZ       LYS 138 147.691   4.652  -3.187
  460    H    ASP 139           H        ASP 139 140.424   3.139  -2.061
  461    HA   ASP 139           HA       ASP 139 140.125   6.016  -2.001
  462   1HB   ASP 139          2HB       ASP 139 138.772   5.772  -3.949
  463   2HB   ASP 139          1HB       ASP 139 140.116   4.651  -4.123
  464    H    GLY 140           H        GLY 140 138.611   3.299  -0.559
  465   1HA   GLY 140          2HA       GLY 140 136.021   4.484  -0.208
  466   2HA   GLY 140          1HA       GLY 140 136.624   3.038   0.590
  467    H    ASP 141           H        ASP 141 138.920   4.171   1.795
  468    HA   ASP 141           HA       ASP 141 137.683   5.389   4.084
  469   1HB   ASP 141          2HB       ASP 141 139.689   3.724   3.995
  470   2HB   ASP 141          1HB       ASP 141 140.654   5.169   3.711
  471    H    LYS 142           H        LYS 142 137.896   7.462   4.832
  472    HA   LYS 142           HA       LYS 142 139.133   9.386   2.971
  473   1HB   LYS 142          2HB       LYS 142 136.796   9.852   4.833
  474   2HB   LYS 142          1HB       LYS 142 137.473  11.019   3.705
  475   1HG   LYS 142          2HG       LYS 142 136.068   8.451   3.005
  476   2HG   LYS 142          1HG       LYS 142 135.448  10.090   2.799
  477   1HD   LYS 142          2HD       LYS 142 137.792  10.250   1.447
  478   2HD   LYS 142          1HD       LYS 142 137.354   8.565   1.159
  479   1HE   LYS 142          2HE       LYS 142 136.507  10.153  -0.566
  480   2HE   LYS 142          1HE       LYS 142 135.252   9.198   0.221
  481   1HZ   LYS 142          1HZ       LYS 142 135.857  11.785   1.410
  482   2HZ   LYS 142          2HZ       LYS 142 134.369  11.007   1.211
  483   3HZ   LYS 142          3HZ       LYS 142 135.082  11.815  -0.093
  484    H    ASN 143           H        ASN 143 138.546   8.582   6.355
  485    HA   ASN 143           HA       ASN 143 140.417  10.661   7.208
  486   1HB   ASN 143          2HB       ASN 143 139.661  10.100   9.493
  487   2HB   ASN 143          1HB       ASN 143 138.321  10.536   8.437
  488   1HD2  ASN 143          1HD2      ASN 143 136.997   9.439   9.997
  489   2HD2  ASN 143          2HD2      ASN 143 136.838   7.720   9.931
  490    H    ASN 144           H        ASN 144 140.588   7.495   6.248
  491    HA   ASN 144           HA       ASN 144 142.178   5.881   6.414
  492   1HB   ASN 144          2HB       ASN 144 143.640   7.992   6.170
  493   2HB   ASN 144          1HB       ASN 144 143.926   7.830   7.900
  494   1HD2  ASN 144          1HD2      ASN 144 145.468   6.496   8.566
  495   2HD2  ASN 144          2HD2      ASN 144 146.313   5.367   7.569
  496    H    ASP 145           H        ASP 145 140.376   5.287   8.090
  497    HA   ASP 145           HA       ASP 145 141.511   5.107  10.788
  498   1HB   ASP 145          2HB       ASP 145 139.247   4.465  11.499
  499   2HB   ASP 145          1HB       ASP 145 139.233   5.999  10.633
  500    H    GLY 146           H        GLY 146 140.738   3.210   7.998
  501   1HA   GLY 146          2HA       GLY 146 142.036   1.093   7.886
  502   2HA   GLY 146          1HA       GLY 146 141.440   0.767   9.507
  503    H    ARG 147           H        ARG 147 138.766   1.874   8.794
  504    HA   ARG 147           HA       ARG 147 137.819  -0.199   6.943
  505   1HB   ARG 147          2HB       ARG 147 136.678   0.389   9.680
  506   2HB   ARG 147          1HB       ARG 147 135.892  -0.622   8.474
  507   1HG   ARG 147          2HG       ARG 147 137.865  -2.121   8.518
  508   2HG   ARG 147          1HG       ARG 147 138.528  -1.145   9.831
  509   1HD   ARG 147          2HD       ARG 147 135.762  -2.045  10.233
  510   2HD   ARG 147          1HD       ARG 147 136.956  -3.340  10.165
  511    HE   ARG 147           HE       ARG 147 137.688  -1.166  11.903
  512   1HH1  ARG 147          1HH1      ARG 147 135.959  -4.188  11.666
  513   2HH1  ARG 147          2HH1      ARG 147 136.056  -4.521  13.361
  514   1HH2  ARG 147          1HH2      ARG 147 137.818  -1.602  14.133
  515   2HH2  ARG 147          2HH2      ARG 147 137.111  -3.052  14.763
  516    H    ILE 148           H        ILE 148 135.254   0.210   6.740
  517    HA   ILE 148           HA       ILE 148 134.874   3.103   6.331
  518    HB   ILE 148           HB       ILE 148 133.869   0.969   4.449
  519   1HG1  ILE 148          2HG1      ILE 148 136.229   2.836   4.118
  520   2HG1  ILE 148          1HG1      ILE 148 136.332   1.100   4.392
  521   1HG2  ILE 148          1HG2      ILE 148 133.781   3.185   3.005
  522   2HG2  ILE 148          2HG2      ILE 148 133.642   3.928   4.599
  523   3HG2  ILE 148          3HG2      ILE 148 132.460   2.727   4.081
  524   1HD1  ILE 148          1HD1      ILE 148 135.089   2.428   1.996
  525   2HD1  ILE 148          2HD1      ILE 148 135.223   0.690   2.268
  526   3HD1  ILE 148          3HD1      ILE 148 136.679   1.664   2.053
  527    H    ASP 149           H        ASP 149 132.793   3.898   6.608
  528    HA   ASP 149           HA       ASP 149 130.762   2.009   7.570
  529   1HB   ASP 149          2HB       ASP 149 130.167   3.546   9.395
  530   2HB   ASP 149          1HB       ASP 149 131.832   2.993   9.547
  531    H    TYR 150           H        TYR 150 128.612   3.368   7.922
  532    HA   TYR 150           HA       TYR 150 127.717   4.143   5.414
  533   1HB   TYR 150          2HB       TYR 150 126.290   3.475   7.372
  534   2HB   TYR 150          1HB       TYR 150 126.550   5.084   8.037
  535    HD1  TYR 150           HD1      TYR 150 125.681   3.757   4.646
  536    HD2  TYR 150           HD2      TYR 150 124.687   6.418   7.813
  537    HE1  TYR 150           HE1      TYR 150 123.779   4.597   3.335
  538    HE2  TYR 150           HE2      TYR 150 122.782   7.265   6.511
  539    HH   TYR 150           HH       TYR 150 122.395   6.687   3.228
  540    H    ASP 151           H        ASP 151 128.563   6.245   8.165
  541    HA   ASP 151           HA       ASP 151 128.103   8.700   6.978
  542   1HB   ASP 151          2HB       ASP 151 130.095   7.837   9.068
  543   2HB   ASP 151          1HB       ASP 151 129.948   9.518   8.562
  544    H    GLU 152           H        GLU 152 130.971   6.644   6.784
  545    HA   GLU 152           HA       GLU 152 132.448   8.564   5.225
  546   1HB   GLU 152          2HB       GLU 152 133.047   5.639   5.687
  547   2HB   GLU 152          1HB       GLU 152 134.167   6.856   5.093
  548   1HG   GLU 152          2HG       GLU 152 133.203   7.856   7.514
  549   2HG   GLU 152          1HG       GLU 152 133.500   6.142   7.794
  550    H    PHE 153           H        PHE 153 130.440   5.766   4.615
  551    HA   PHE 153           HA       PHE 153 131.192   5.428   1.887
  552   1HB   PHE 153          2HB       PHE 153 129.877   3.859   3.624
  553   2HB   PHE 153          1HB       PHE 153 128.498   4.553   2.779
  554    HD1  PHE 153           HD1      PHE 153 127.666   3.273   1.081
  555    HD2  PHE 153           HD2      PHE 153 131.849   3.183   1.857
  556    HE1  PHE 153           HE1      PHE 153 127.966   1.651  -0.745
  557    HE2  PHE 153           HE2      PHE 153 132.157   1.562   0.032
  558    HZ   PHE 153           HZ       PHE 153 130.214   0.794  -1.272
  559    H    LEU 154           H        LEU 154 128.807   7.357   3.564
  560    HA   LEU 154           HA       LEU 154 127.101   7.988   1.451
  561   1HB   LEU 154          2HB       LEU 154 127.913   9.491   3.923
  562   2HB   LEU 154          1HB       LEU 154 126.786  10.179   2.770
  563    HG   LEU 154           HG       LEU 154 126.408   7.667   4.396
  564   1HD1  LEU 154          1HD1      LEU 154 126.060  10.065   5.337
  565   2HD1  LEU 154          2HD1      LEU 154 124.837   8.826   5.619
  566   3HD1  LEU 154          3HD1      LEU 154 124.593  10.036   4.359
  567   1HD2  LEU 154          1HD2      LEU 154 125.432   7.149   2.324
  568   2HD2  LEU 154          2HD2      LEU 154 124.815   8.787   2.110
  569   3HD2  LEU 154          3HD2      LEU 154 124.101   7.728   3.325
  570    H    GLU 155           H        GLU 155 130.232   9.305   2.338
  571    HA   GLU 155           HA       GLU 155 130.092  11.413   0.363
  572   1HB   GLU 155          2HB       GLU 155 132.263  10.477   2.235
  573   2HB   GLU 155          1HB       GLU 155 132.517  11.753   1.052
  574   1HG   GLU 155          2HG       GLU 155 130.361  12.756   2.195
  575   2HG   GLU 155          1HG       GLU 155 130.911  11.765   3.545
  576    H    PHE 156           H        PHE 156 131.838   8.359   0.796
  577    HA   PHE 156           HA       PHE 156 133.413   8.480  -1.511
  578   1HB   PHE 156          2HB       PHE 156 133.802   6.843   0.264
  579   2HB   PHE 156          1HB       PHE 156 132.275   6.051  -0.110
  580    HD1  PHE 156           HD1      PHE 156 135.215   7.208  -2.105
  581    HD2  PHE 156           HD2      PHE 156 132.555   4.031  -1.136
  582    HE1  PHE 156           HE1      PHE 156 136.366   5.755  -3.724
  583    HE2  PHE 156           HE2      PHE 156 133.701   2.572  -2.752
  584    HZ   PHE 156           HZ       PHE 156 135.608   3.433  -4.048
  585    H    MET 157           H        MET 157 130.133   7.258  -1.014
  586    HA   MET 157           HA       MET 157 129.855   6.350  -3.724
  587   1HB   MET 157          2HB       MET 157 127.946   6.664  -1.417
  588   2HB   MET 157          1HB       MET 157 127.381   6.219  -3.022
  589   1HG   MET 157          2HG       MET 157 129.599   4.565  -2.268
  590   2HG   MET 157          1HG       MET 157 128.361   4.536  -1.013
  591   1HE   MET 157          1HE       MET 157 128.042   3.190  -5.349
  592   2HE   MET 157          2HE       MET 157 129.086   4.440  -4.676
  593   3HE   MET 157          3HE       MET 157 127.410   4.815  -5.080
  594    H    LYS 158           H        LYS 158 129.083   9.249  -1.921
  595    HA   LYS 158           HA       LYS 158 127.573  10.395  -4.117
  596   1HB   LYS 158          2HB       LYS 158 127.014  10.775  -1.682
  597   2HB   LYS 158          1HB       LYS 158 128.467  11.760  -1.577
  598   1HG   LYS 158          2HG       LYS 158 127.275  12.907  -3.699
  599   2HG   LYS 158          1HG       LYS 158 125.861  12.356  -2.799
  600   1HD   LYS 158          2HD       LYS 158 126.667  13.520  -0.809
  601   2HD   LYS 158          1HD       LYS 158 128.098  14.054  -1.695
  602   1HE   LYS 158          2HE       LYS 158 126.228  14.968  -3.357
  603   2HE   LYS 158          1HE       LYS 158 125.290  14.993  -1.863
  604   1HZ   LYS 158          1HZ       LYS 158 127.981  16.196  -1.971
  605   2HZ   LYS 158          2HZ       LYS 158 126.714  16.525  -0.901
  606   3HZ   LYS 158          3HZ       LYS 158 126.628  17.064  -2.501
  607    H    GLY 159           H        GLY 159 129.540  10.094  -5.530
  608   1HA   GLY 159          2HA       GLY 159 130.777  11.630  -6.897
  609   2HA   GLY 159          1HA       GLY 159 131.111  12.582  -5.458
  610    H    VAL 160           H        VAL 160 131.683   9.325  -6.775
  611    HA   VAL 160           HA       VAL 160 133.853   8.669  -5.141
  612    HB   VAL 160           HB       VAL 160 133.559   7.745  -7.995
  613   1HG1  VAL 160          1HG1      VAL 160 135.063   6.864  -5.611
  614   2HG1  VAL 160          2HG1      VAL 160 135.462   6.725  -7.324
  615   3HG1  VAL 160          3HG1      VAL 160 134.328   5.592  -6.587
  616   1HG2  VAL 160          1HG2      VAL 160 132.310   5.815  -6.598
  617   2HG2  VAL 160          2HG2      VAL 160 131.467   7.157  -7.372
  618   3HG2  VAL 160          3HG2      VAL 160 131.843   7.228  -5.650
  619    H    GLU 161           H        GLU 161 133.670  10.600  -8.045
  620    HA   GLU 161           HA       GLU 161 136.424  10.614  -8.683
  621   1HB   GLU 161          2HB       GLU 161 134.037  12.194  -9.446
  622   2HB   GLU 161          1HB       GLU 161 135.591  12.986  -9.668
  623   1HG   GLU 161          2HG       GLU 161 136.056  10.528 -10.748
  624   2HG   GLU 161          1HG       GLU 161 134.363  10.797 -11.158
  Start of MODEL   16
    1   1H    MET  81          1HT       MET  81  88.065  12.562  -1.534
    2   2H    MET  81          2HT       MET  81  86.814  13.373  -0.683
    3   3H    MET  81          3HT       MET  81  88.254  12.918   0.133
    4    HA   MET  81           HA       MET  81  88.267  14.740  -2.162
    5   1HB   MET  81          2HB       MET  81  87.559  15.220   0.701
    6   2HB   MET  81          1HB       MET  81  88.486  16.447  -0.151
    7   1HG   MET  81          2HG       MET  81  86.676  16.361  -1.927
    8   2HG   MET  81          1HG       MET  81  85.729  15.437  -0.761
    9   1HE   MET  81          1HE       MET  81  83.985  17.804  -1.401
   10   2HE   MET  81          2HE       MET  81  85.396  18.321  -2.324
   11   3HE   MET  81          3HE       MET  81  84.671  19.409  -1.138
   12    H    VAL  82           H        VAL  82  90.053  12.591  -1.365
   13    HA   VAL  82           HA       VAL  82  92.277  12.195  -1.093
   14    HB   VAL  82           HB       VAL  82  92.660  15.158  -1.528
   15   1HG1  VAL  82          1HG1      VAL  82  94.571  13.177  -2.578
   16   2HG1  VAL  82          2HG1      VAL  82  94.511  13.328  -0.822
   17   3HG1  VAL  82          3HG1      VAL  82  94.857  14.743  -1.817
   18   1HG2  VAL  82          1HG2      VAL  82  91.253  14.250  -3.300
   19   2HG2  VAL  82          2HG2      VAL  82  92.422  12.961  -3.583
   20   3HG2  VAL  82          3HG2      VAL  82  92.860  14.638  -3.913
   21    H    ARG  83           H        ARG  83  92.383  11.603   1.033
   22    HA   ARG  83           HA       ARG  83  92.243  13.407   3.211
   23   1HB   ARG  83          2HB       ARG  83  93.458  10.640   3.099
   24   2HB   ARG  83          1HB       ARG  83  93.044  11.519   4.566
   25   1HG   ARG  83          2HG       ARG  83  90.800  11.302   2.737
   26   2HG   ARG  83          1HG       ARG  83  91.439   9.729   3.219
   27   1HD   ARG  83          2HD       ARG  83  89.892  10.155   4.883
   28   2HD   ARG  83          1HD       ARG  83  91.390  10.730   5.613
   29    HE   ARG  83           HE       ARG  83  90.396  12.949   4.436
   30   1HH1  ARG  83          1HH1      ARG  83  89.027  10.603   6.629
   31   2HH1  ARG  83          2HH1      ARG  83  87.951  11.739   7.368
   32   1HH2  ARG  83          1HH2      ARG  83  88.981  14.444   5.409
   33   2HH2  ARG  83          2HH2      ARG  83  87.924  13.919   6.677
   34    H    CYS  84           H        CYS  84  95.064  11.459   2.234
   35    HA   CYS  84           HA       CYS  84  96.811  13.724   2.207
   36   1HB   CYS  84          2HB       CYS  84  96.568  13.397   4.641
   37   2HB   CYS  84          1HB       CYS  84  97.108  11.733   4.466
   38    HG   CYS  84           HG       CYS  84  98.905  14.220   4.401
   39    H    MET  85           H        MET  85  97.875  13.196   0.411
   40    HA   MET  85           HA       MET  85  99.394  10.708   0.379
   41   1HB   MET  85          2HB       MET  85  97.008  10.818  -0.976
   42   2HB   MET  85          1HB       MET  85  98.160  11.276  -2.223
   43   1HG   MET  85          2HG       MET  85  98.121   9.013  -2.491
   44   2HG   MET  85          1HG       MET  85  99.466   9.181  -1.365
   45   1HE   MET  85          1HE       MET  85  99.213   6.665   0.413
   46   2HE   MET  85          2HE       MET  85  98.640   7.689   1.730
   47   3HE   MET  85          3HE       MET  85  99.771   8.333   0.540
   48    H    LYS  86           H        LYS  86 101.396  11.017  -0.374
   49    HA   LYS  86           HA       LYS  86 101.949  13.093  -2.322
   50   1HB   LYS  86          2HB       LYS  86 103.833  13.974  -0.834
   51   2HB   LYS  86          1HB       LYS  86 102.195  14.461  -0.427
   52   1HG   LYS  86          2HG       LYS  86 102.127  12.717   1.305
   53   2HG   LYS  86          1HG       LYS  86 103.798  12.296   0.919
   54   1HD   LYS  86          2HD       LYS  86 104.640  14.169   1.904
   55   2HD   LYS  86          1HD       LYS  86 103.218  15.141   1.520
   56   1HE   LYS  86          2HE       LYS  86 102.772  12.935   3.418
   57   2HE   LYS  86          1HE       LYS  86 103.820  14.230   3.995
   58   1HZ   LYS  86          1HZ       LYS  86 102.041  15.809   3.342
   59   2HZ   LYS  86          2HZ       LYS  86 101.588  14.753   4.582
   60   3HZ   LYS  86          3HZ       LYS  86 101.035  14.491   3.005
   61    H    ASP  87           H        ASP  87 104.355  13.095  -2.876
   62    HA   ASP  87           HA       ASP  87 105.123  10.386  -3.418
   63   1HB   ASP  87          2HB       ASP  87 105.685  12.950  -4.508
   64   2HB   ASP  87          1HB       ASP  87 107.224  12.225  -4.053
   65    H    ASP  88           H        ASP  88 105.568   9.455  -1.411
   66    HA   ASP  88           HA       ASP  88 107.512  10.624   0.362
   67   1HB   ASP  88          2HB       ASP  88 105.468   8.997   0.854
   68   2HB   ASP  88          1HB       ASP  88 106.700   7.764   0.605
   69    H    SER  89           H        SER  89 107.402   7.778  -1.767
   70    HA   SER  89           HA       SER  89 110.207   7.226  -1.325
   71   1HB   SER  89          2HB       SER  89 108.311   5.934  -3.300
   72   2HB   SER  89          1HB       SER  89 109.871   5.308  -2.768
   73    HG   SER  89           HG       SER  89 107.689   5.789  -1.022
   74    H    LYS  90           H        LYS  90 111.388   8.906  -2.159
   75    HA   LYS  90           HA       LYS  90 110.889  10.004  -4.755
   76   1HB   LYS  90          2HB       LYS  90 113.397  10.274  -3.099
   77   2HB   LYS  90          1HB       LYS  90 112.848  11.345  -4.381
   78   1HG   LYS  90          2HG       LYS  90 111.486  12.478  -3.017
   79   2HG   LYS  90          1HG       LYS  90 110.932  11.018  -2.195
   80   1HD   LYS  90          2HD       LYS  90 112.952  10.973  -0.852
   81   2HD   LYS  90          1HD       LYS  90 113.585  12.374  -1.721
   82   1HE   LYS  90          2HE       LYS  90 112.725  13.457   0.079
   83   2HE   LYS  90          1HE       LYS  90 111.271  13.415  -0.919
   84   1HZ   LYS  90          1HZ       LYS  90 111.917  11.355   1.114
   85   2HZ   LYS  90          2HZ       LYS  90 110.456  11.559   0.287
   86   3HZ   LYS  90          3HZ       LYS  90 110.949  12.706   1.430
   87    H    GLY  91           H        GLY  91 113.279  10.245  -5.990
   88   1HA   GLY  91          2HA       GLY  91 113.559   7.724  -7.275
   89   2HA   GLY  91          1HA       GLY  91 114.541   9.148  -7.570
   90    H    LYS  92           H        LYS  92 116.609   9.063  -6.983
   91    HA   LYS  92           HA       LYS  92 117.489   6.790  -5.368
   92   1HB   LYS  92          2HB       LYS  92 118.916   8.678  -7.229
   93   2HB   LYS  92          1HB       LYS  92 119.794   7.601  -6.151
   94   1HG   LYS  92          2HG       LYS  92 118.991   5.681  -7.235
   95   2HG   LYS  92          1HG       LYS  92 117.728   6.585  -8.075
   96   1HD   LYS  92          2HD       LYS  92 119.164   6.569  -9.803
   97   2HD   LYS  92          1HD       LYS  92 119.975   7.869  -8.927
   98   1HE   LYS  92          2HE       LYS  92 121.700   6.385  -9.406
   99   2HE   LYS  92          1HE       LYS  92 121.263   5.978  -7.747
  100   1HZ   LYS  92          1HZ       LYS  92 121.477   3.958  -8.918
  101   2HZ   LYS  92          2HZ       LYS  92 120.548   4.508 -10.218
  102   3HZ   LYS  92          3HZ       LYS  92 119.815   4.203  -8.725
  103    H    THR  93           H        THR  93 117.039   7.448  -3.283
  104    HA   THR  93           HA       THR  93 118.260   9.944  -2.351
  105    HB   THR  93           HB       THR  93 116.907   9.588  -0.304
  106    HG1  THR  93           HG1      THR  93 115.949   7.761   0.031
  107   1HG2  THR  93          1HG2      THR  93 114.637   9.772  -1.340
  108   2HG2  THR  93          2HG2      THR  93 115.408   9.517  -2.905
  109   3HG2  THR  93          3HG2      THR  93 115.832  10.925  -1.931
  110    H    GLU  94           H        GLU  94 118.839   9.577   0.191
  111    HA   GLU  94           HA       GLU  94 121.276   8.209   0.192
  112   1HB   GLU  94          2HB       GLU  94 119.533   9.347   2.347
  113   2HB   GLU  94          1HB       GLU  94 120.950   8.401   2.781
  114   1HG   GLU  94          2HG       GLU  94 122.206  10.197   2.537
  115   2HG   GLU  94          1HG       GLU  94 121.775  10.254   0.829
  116    H    GLU  95           H        GLU  95 118.051   7.147   0.983
  117    HA   GLU  95           HA       GLU  95 118.638   4.860   2.474
  118   1HB   GLU  95          2HB       GLU  95 116.343   5.769   0.812
  119   2HB   GLU  95          1HB       GLU  95 116.407   4.065   1.239
  120   1HG   GLU  95          2HG       GLU  95 116.387   4.574   3.569
  121   2HG   GLU  95          1HG       GLU  95 116.573   6.297   3.246
  122    H    GLU  96           H        GLU  96 118.886   5.479  -0.937
  123    HA   GLU  96           HA       GLU  96 118.904   2.803  -1.845
  124   1HB   GLU  96          2HB       GLU  96 120.315   5.157  -3.104
  125   2HB   GLU  96          1HB       GLU  96 119.806   3.677  -3.904
  126   1HG   GLU  96          2HG       GLU  96 117.589   4.995  -2.601
  127   2HG   GLU  96          1HG       GLU  96 118.403   6.061  -3.746
  128    H    LEU  97           H        LEU  97 121.560   5.050  -1.089
  129    HA   LEU  97           HA       LEU  97 123.671   3.302  -1.629
  130   1HB   LEU  97          2HB       LEU  97 123.317   5.807  -0.105
  131   2HB   LEU  97          1HB       LEU  97 124.709   4.838   0.341
  132    HG   LEU  97           HG       LEU  97 124.292   5.396  -2.551
  133   1HD1  LEU  97          1HD1      LEU  97 125.045   7.437  -0.492
  134   2HD1  LEU  97          2HD1      LEU  97 123.940   7.587  -1.858
  135   3HD1  LEU  97          3HD1      LEU  97 125.681   7.524  -2.135
  136   1HD2  LEU  97          1HD2      LEU  97 126.640   5.071  -0.700
  137   2HD2  LEU  97          2HD2      LEU  97 126.805   5.613  -2.370
  138   3HD2  LEU  97          3HD2      LEU  97 126.136   4.018  -2.022
  139    H    SER  98           H        SER  98 121.801   3.810   1.323
  140    HA   SER  98           HA       SER  98 123.343   2.261   3.065
  141   1HB   SER  98          2HB       SER  98 120.884   1.895   4.098
  142   2HB   SER  98          1HB       SER  98 121.776   3.407   4.266
  143    HG   SER  98           HG       SER  98 119.436   3.191   3.272
  144    H    ASP  99           H        ASP  99 120.881   1.354   0.730
  145    HA   ASP  99           HA       ASP  99 120.591  -1.336   1.604
  146   1HB   ASP  99          2HB       ASP  99 119.813   0.203  -0.838
  147   2HB   ASP  99          1HB       ASP  99 119.751  -1.556  -0.890
  148    H    LEU 100           H        LEU 100 122.673   0.272  -0.734
  149    HA   LEU 100           HA       LEU 100 123.780  -2.178  -1.748
  150   1HB   LEU 100          2HB       LEU 100 124.426   0.730  -2.104
  151   2HB   LEU 100          1HB       LEU 100 125.506  -0.507  -2.717
  152    HG   LEU 100           HG       LEU 100 122.690  -0.846  -3.504
  153   1HD1  LEU 100          1HD1      LEU 100 124.154   1.666  -4.019
  154   2HD1  LEU 100          2HD1      LEU 100 122.421   1.353  -3.951
  155   3HD1  LEU 100          3HD1      LEU 100 123.338   0.929  -5.397
  156   1HD2  LEU 100          1HD2      LEU 100 125.039  -1.924  -4.266
  157   2HD2  LEU 100          2HD2      LEU 100 124.871  -0.648  -5.473
  158   3HD2  LEU 100          3HD2      LEU 100 123.606  -1.865  -5.293
  159    H    PHE 101           H        PHE 101 124.580   0.138   0.740
  160    HA   PHE 101           HA       PHE 101 127.265  -0.641   1.155
  161   1HB   PHE 101          2HB       PHE 101 126.341   1.474   2.007
  162   2HB   PHE 101          1HB       PHE 101 125.304   0.578   3.110
  163    HD1  PHE 101           HD1      PHE 101 126.147  -0.326   5.144
  164    HD2  PHE 101           HD2      PHE 101 128.774   1.520   2.350
  165    HE1  PHE 101           HE1      PHE 101 127.926  -0.293   6.845
  166    HE2  PHE 101           HE2      PHE 101 130.557   1.557   4.046
  167    HZ   PHE 101           HZ       PHE 101 130.134   0.649   6.296
  168    H    ARG 102           H        ARG 102 124.214  -1.697   2.609
  169    HA   ARG 102           HA       ARG 102 125.282  -3.393   4.562
  170   1HB   ARG 102          2HB       ARG 102 122.671  -3.631   3.058
  171   2HB   ARG 102          1HB       ARG 102 123.071  -4.503   4.531
  172   1HG   ARG 102          2HG       ARG 102 123.476  -1.678   4.893
  173   2HG   ARG 102          1HG       ARG 102 121.842  -2.007   4.311
  174   1HD   ARG 102          2HD       ARG 102 121.425  -3.506   6.128
  175   2HD   ARG 102          1HD       ARG 102 123.111  -3.440   6.638
  176    HE   ARG 102           HE       ARG 102 122.327  -0.862   6.807
  177   1HH1  ARG 102          1HH1      ARG 102 120.987  -3.837   8.046
  178   2HH1  ARG 102          2HH1      ARG 102 120.283  -3.086   9.439
  179   1HH2  ARG 102          1HH2      ARG 102 121.404   0.126   8.638
  180   2HH2  ARG 102          2HH2      ARG 102 120.520  -0.836   9.775
  181    H    MET 103           H        MET 103 124.627  -3.907   1.150
  182    HA   MET 103           HA       MET 103 124.952  -6.711   1.128
  183   1HB   MET 103          2HB       MET 103 124.912  -4.544  -0.899
  184   2HB   MET 103          1HB       MET 103 125.681  -6.051  -1.375
  185   1HG   MET 103          2HG       MET 103 123.053  -6.307  -0.076
  186   2HG   MET 103          1HG       MET 103 123.063  -5.542  -1.664
  187   1HE   MET 103          1HE       MET 103 122.579  -7.785  -3.875
  188   2HE   MET 103          2HE       MET 103 121.687  -6.909  -2.632
  189   3HE   MET 103          3HE       MET 103 121.664  -8.673  -2.658
  190    H    PHE 104           H        PHE 104 127.220  -4.037   0.813
  191    HA   PHE 104           HA       PHE 104 129.464  -5.517  -0.011
  192   1HB   PHE 104          2HB       PHE 104 128.975  -2.839   1.147
  193   2HB   PHE 104          1HB       PHE 104 130.594  -3.486   1.381
  194    HD1  PHE 104           HD1      PHE 104 132.177  -3.218  -0.278
  195    HD2  PHE 104           HD2      PHE 104 128.051  -2.922  -1.277
  196    HE1  PHE 104           HE1      PHE 104 132.783  -2.524  -2.558
  197    HE2  PHE 104           HE2      PHE 104 128.649  -2.229  -3.561
  198    HZ   PHE 104           HZ       PHE 104 131.018  -2.029  -4.205
  199    H    ASP 105           H        ASP 105 128.062  -4.933   3.146
  200    HA   ASP 105           HA       ASP 105 130.274  -5.879   4.664
  201   1HB   ASP 105          2HB       ASP 105 127.984  -4.552   5.285
  202   2HB   ASP 105          1HB       ASP 105 127.582  -6.174   5.840
  203    H    LYS 106           H        LYS 106 130.793  -7.886   5.352
  204    HA   LYS 106           HA       LYS 106 129.534 -10.117   4.037
  205   1HB   LYS 106          2HB       LYS 106 132.023  -9.874   4.423
  206   2HB   LYS 106          1HB       LYS 106 131.715 -10.210   6.122
  207   1HG   LYS 106          2HG       LYS 106 132.393 -12.246   5.149
  208   2HG   LYS 106          1HG       LYS 106 130.648 -12.368   5.385
  209   1HD   LYS 106          2HD       LYS 106 130.842 -11.295   2.864
  210   2HD   LYS 106          1HD       LYS 106 132.218 -12.400   2.921
  211   1HE   LYS 106          2HE       LYS 106 130.752 -13.997   2.382
  212   2HE   LYS 106          1HE       LYS 106 130.200 -13.880   4.052
  213   1HZ   LYS 106          1HZ       LYS 106 129.055 -11.989   2.151
  214   2HZ   LYS 106          2HZ       LYS 106 128.328 -12.788   3.454
  215   3HZ   LYS 106          3HZ       LYS 106 128.577 -13.605   1.994
  216    H    ASN 107           H        ASN 107 130.328  -9.524   7.468
  217    HA   ASN 107           HA       ASN 107 128.120 -11.281   8.231
  218   1HB   ASN 107          2HB       ASN 107 129.110 -11.168  10.499
  219   2HB   ASN 107          1HB       ASN 107 130.259 -11.734   9.290
  220   1HD2  ASN 107          1HD2      ASN 107 131.403 -10.941  11.470
  221   2HD2  ASN 107          2HD2      ASN 107 132.103  -9.368  11.330
  222    H    ALA 108           H        ALA 108 128.052  -8.301   7.320
  223    HA   ALA 108           HA       ALA 108 126.880  -6.411   7.809
  224   1HB   ALA 108          1HB       ALA 108 125.187  -8.345   9.388
  225   2HB   ALA 108          2HB       ALA 108 125.038  -8.017   7.662
  226   3HB   ALA 108          3HB       ALA 108 124.697  -6.743   8.833
  227    H    ASP 109           H        ASP 109 129.017  -6.156   9.194
  228    HA   ASP 109           HA       ASP 109 128.338  -5.839  12.028
  229   1HB   ASP 109          2HB       ASP 109 130.586  -6.869  10.849
  230   2HB   ASP 109          1HB       ASP 109 131.088  -5.216  11.196
  231    H    GLY 110           H        GLY 110 127.644  -4.032   9.617
  232   1HA   GLY 110          2HA       GLY 110 127.309  -1.781   9.330
  233   2HA   GLY 110          1HA       GLY 110 127.760  -1.584  11.016
  234    H    TYR 111           H        TYR 111 130.091  -3.141   9.044
  235    HA   TYR 111           HA       TYR 111 131.433  -0.726   8.223
  236   1HB   TYR 111          2HB       TYR 111 132.699  -2.483  10.336
  237   2HB   TYR 111          1HB       TYR 111 133.470  -1.118   9.534
  238    HD1  TYR 111           HD1      TYR 111 131.514  -2.159  12.315
  239    HD2  TYR 111           HD2      TYR 111 132.348   1.188   9.827
  240    HE1  TYR 111           HE1      TYR 111 130.639  -0.657  14.054
  241    HE2  TYR 111           HE2      TYR 111 131.476   2.701  11.560
  242    HH   TYR 111           HH       TYR 111 129.557   1.977  13.837
  243    H    ILE 112           H        ILE 112 133.436  -1.182   7.031
  244    HA   ILE 112           HA       ILE 112 133.595  -3.950   6.048
  245    HB   ILE 112           HB       ILE 112 133.783  -1.521   4.266
  246   1HG1  ILE 112          2HG1      ILE 112 131.537  -3.499   4.138
  247   2HG1  ILE 112          1HG1      ILE 112 131.470  -2.197   5.320
  248   1HG2  ILE 112          1HG2      ILE 112 134.222  -4.412   3.907
  249   2HG2  ILE 112          2HG2      ILE 112 134.917  -3.038   3.044
  250   3HG2  ILE 112          3HG2      ILE 112 133.300  -3.609   2.634
  251   1HD1  ILE 112          1HD1      ILE 112 131.856  -0.615   3.381
  252   2HD1  ILE 112          2HD1      ILE 112 130.292  -1.424   3.452
  253   3HD1  ILE 112          3HD1      ILE 112 131.528  -1.993   2.332
  254    H    ASP 113           H        ASP 113 135.622  -4.722   5.697
  255    HA   ASP 113           HA       ASP 113 137.865  -2.832   5.875
  256   1HB   ASP 113          2HB       ASP 113 139.066  -4.593   7.254
  257   2HB   ASP 113          1HB       ASP 113 137.764  -3.735   8.071
  258    H    LEU 114           H        LEU 114 139.996  -4.214   5.455
  259    HA   LEU 114           HA       LEU 114 139.901  -5.000   2.766
  260   1HB   LEU 114          2HB       LEU 114 141.880  -4.257   4.378
  261   2HB   LEU 114          1HB       LEU 114 142.096  -5.992   4.514
  262    HG   LEU 114           HG       LEU 114 141.925  -5.677   1.802
  263   1HD1  LEU 114          1HD1      LEU 114 143.821  -3.740   1.726
  264   2HD1  LEU 114          2HD1      LEU 114 142.748  -3.119   2.980
  265   3HD1  LEU 114          3HD1      LEU 114 142.112  -3.481   1.377
  266   1HD2  LEU 114          1HD2      LEU 114 143.674  -6.736   3.523
  267   2HD2  LEU 114          2HD2      LEU 114 144.609  -5.337   2.998
  268   3HD2  LEU 114          3HD2      LEU 114 144.033  -6.508   1.812
  269    H    GLU 115           H        GLU 115 139.554  -6.812   5.723
  270    HA   GLU 115           HA       GLU 115 139.869  -9.379   4.447
  271   1HB   GLU 115          2HB       GLU 115 140.351  -8.721   6.922
  272   2HB   GLU 115          1HB       GLU 115 138.628  -8.989   7.148
  273   1HG   GLU 115          2HG       GLU 115 138.956 -11.276   6.176
  274   2HG   GLU 115          1HG       GLU 115 140.692 -10.978   6.246
  275    H    GLU 116           H        GLU 116 137.143  -7.837   6.164
  276    HA   GLU 116           HA       GLU 116 135.180  -9.642   5.405
  277   1HB   GLU 116          2HB       GLU 116 135.285  -7.023   6.618
  278   2HB   GLU 116          1HB       GLU 116 133.910  -7.140   5.528
  279   1HG   GLU 116          2HG       GLU 116 132.858  -8.709   6.791
  280   2HG   GLU 116          1HG       GLU 116 134.364  -9.379   7.415
  281    H    LEU 117           H        LEU 117 136.622  -7.043   3.597
  282    HA   LEU 117           HA       LEU 117 134.583  -6.987   1.568
  283   1HB   LEU 117          2HB       LEU 117 135.906  -4.995   2.089
  284   2HB   LEU 117          1HB       LEU 117 137.369  -5.824   1.597
  285    HG   LEU 117           HG       LEU 117 136.631  -5.889  -0.701
  286   1HD1  LEU 117          1HD1      LEU 117 134.428  -4.356  -1.004
  287   2HD1  LEU 117          2HD1      LEU 117 134.044  -5.183   0.505
  288   3HD1  LEU 117          3HD1      LEU 117 134.408  -6.119  -0.945
  289   1HD2  LEU 117          1HD2      LEU 117 136.151  -3.133   0.422
  290   2HD2  LEU 117          2HD2      LEU 117 136.674  -3.539  -1.212
  291   3HD2  LEU 117          3HD2      LEU 117 137.742  -3.845   0.157
  292    H    LYS 118           H        LYS 118 137.605  -8.647   2.094
  293    HA   LYS 118           HA       LYS 118 137.921  -9.530  -0.611
  294   1HB   LYS 118          2HB       LYS 118 139.641  -9.351   1.417
  295   2HB   LYS 118          1HB       LYS 118 139.167 -11.029   1.638
  296   1HG   LYS 118          2HG       LYS 118 139.780 -10.414  -1.131
  297   2HG   LYS 118          1HG       LYS 118 141.136 -10.089  -0.046
  298   1HD   LYS 118          2HD       LYS 118 140.736 -12.401   0.916
  299   2HD   LYS 118          1HD       LYS 118 139.656 -12.679  -0.452
  300   1HE   LYS 118          2HE       LYS 118 141.374 -12.640  -1.988
  301   2HE   LYS 118          1HE       LYS 118 142.421 -11.674  -0.948
  302   1HZ   LYS 118          1HZ       LYS 118 141.703 -14.511  -0.442
  303   2HZ   LYS 118          2HZ       LYS 118 142.805 -13.577   0.438
  304   3HZ   LYS 118          3HZ       LYS 118 143.146 -14.000  -1.163
  305    H    ILE 119           H        ILE 119 136.298 -10.728   2.233
  306    HA   ILE 119           HA       ILE 119 135.968 -13.410   1.358
  307    HB   ILE 119           HB       ILE 119 134.204 -11.893   3.283
  308   1HG1  ILE 119          2HG1      ILE 119 136.479 -13.655   4.124
  309   2HG1  ILE 119          1HG1      ILE 119 136.794 -11.980   3.686
  310   1HG2  ILE 119          1HG2      ILE 119 133.446 -14.132   2.356
  311   2HG2  ILE 119          2HG2      ILE 119 133.523 -13.989   4.112
  312   3HG2  ILE 119          3HG2      ILE 119 134.799 -14.838   3.241
  313   1HD1  ILE 119          1HD1      ILE 119 134.639 -11.845   5.422
  314   2HD1  ILE 119          2HD1      ILE 119 136.322 -11.460   5.784
  315   3HD1  ILE 119          3HD1      ILE 119 135.695 -13.076   6.112
  316    H    MET 120           H        MET 120 134.141 -10.451   0.892
  317    HA   MET 120           HA       MET 120 131.858 -11.779  -0.244
  318   1HB   MET 120          2HB       MET 120 131.023  -9.546  -0.705
  319   2HB   MET 120          1HB       MET 120 131.648  -9.626   0.937
  320   1HG   MET 120          2HG       MET 120 133.280  -8.140   0.532
  321   2HG   MET 120          1HG       MET 120 133.576  -8.745  -1.096
  322   1HE   MET 120          1HE       MET 120 130.960  -7.735  -3.149
  323   2HE   MET 120          2HE       MET 120 132.640  -8.249  -2.993
  324   3HE   MET 120          3HE       MET 120 132.264  -6.570  -3.378
  325    H    LEU 121           H        LEU 121 134.847 -10.452  -1.417
  326    HA   LEU 121           HA       LEU 121 134.097 -10.140  -4.132
  327   1HB   LEU 121          2HB       LEU 121 136.547 -10.017  -2.550
  328   2HB   LEU 121          1HB       LEU 121 136.813 -10.668  -4.155
  329    HG   LEU 121           HG       LEU 121 137.167  -8.211  -3.990
  330   1HD1  LEU 121          1HD1      LEU 121 136.492  -7.909  -6.119
  331   2HD1  LEU 121          2HD1      LEU 121 134.846  -8.447  -5.791
  332   3HD1  LEU 121          3HD1      LEU 121 136.131  -9.633  -6.021
  333   1HD2  LEU 121          1HD2      LEU 121 134.276  -7.672  -3.991
  334   2HD2  LEU 121          2HD2      LEU 121 135.603  -6.764  -3.268
  335   3HD2  LEU 121          3HD2      LEU 121 134.949  -8.178  -2.442
  336    H    GLN 122           H        GLN 122 135.188 -12.855  -2.227
  337    HA   GLN 122           HA       GLN 122 136.006 -14.584  -4.262
  338   1HB   GLN 122          2HB       GLN 122 134.691 -15.211  -1.612
  339   2HB   GLN 122          1HB       GLN 122 135.460 -16.406  -2.650
  340   1HG   GLN 122          2HG       GLN 122 137.397 -14.466  -2.353
  341   2HG   GLN 122          1HG       GLN 122 136.634 -14.542  -0.765
  342   1HE2  GLN 122          1HE2      GLN 122 139.306 -15.343  -1.531
  343   2HE2  GLN 122          2HE2      GLN 122 139.445 -17.022  -1.148
  344    H    ALA 123           H        ALA 123 132.822 -13.656  -3.195
  345    HA   ALA 123           HA       ALA 123 131.298 -15.750  -4.230
  346   1HB   ALA 123          1HB       ALA 123 129.477 -13.996  -4.406
  347   2HB   ALA 123          2HB       ALA 123 130.676 -12.835  -3.838
  348   3HB   ALA 123          3HB       ALA 123 130.219 -14.199  -2.818
  349    H    THR 124           H        THR 124 132.815 -13.035  -5.820
  350    HA   THR 124           HA       THR 124 131.386 -13.233  -8.270
  351    HB   THR 124           HB       THR 124 133.073 -11.741  -9.168
  352    HG1  THR 124           HG1      THR 124 134.966 -11.350  -8.130
  353   1HG2  THR 124          1HG2      THR 124 133.150 -10.521  -6.556
  354   2HG2  THR 124          2HG2      THR 124 131.538 -11.115  -6.959
  355   3HG2  THR 124          3HG2      THR 124 132.357  -9.982  -8.035
  356    H    GLY 125           H        GLY 125 132.361 -13.848 -10.352
  357   1HA   GLY 125          2HA       GLY 125 133.568 -16.462 -10.137
  358   2HA   GLY 125          1HA       GLY 125 133.051 -15.668 -11.617
  359    H    GLU 126           H        GLU 126 134.546 -13.284 -11.345
  360    HA   GLU 126           HA       GLU 126 137.007 -14.106 -12.453
  361   1HB   GLU 126          2HB       GLU 126 137.603 -11.710 -12.379
  362   2HB   GLU 126          1HB       GLU 126 136.006 -11.982 -13.062
  363   1HG   GLU 126          2HG       GLU 126 135.000 -11.389 -10.905
  364   2HG   GLU 126          1HG       GLU 126 136.609 -11.072 -10.260
  365    H    THR 127           H        THR 127 139.164 -13.518 -11.645
  366    HA   THR 127           HA       THR 127 139.357 -14.099  -8.779
  367    HB   THR 127           HB       THR 127 141.880 -14.359  -9.537
  368    HG1  THR 127           HG1      THR 127 141.976 -15.100 -11.686
  369   1HG2  THR 127          1HG2      THR 127 141.109 -16.716 -10.527
  370   2HG2  THR 127          2HG2      THR 127 139.622 -16.243  -9.705
  371   3HG2  THR 127          3HG2      THR 127 141.134 -16.350  -8.802
  372    H    ILE 128           H        ILE 128 139.687 -12.459  -7.444
  373    HA   ILE 128           HA       ILE 128 141.084 -10.070  -8.455
  374    HB   ILE 128           HB       ILE 128 139.284 -10.187  -6.039
  375   1HG1  ILE 128          2HG1      ILE 128 138.007 -10.778  -8.060
  376   2HG1  ILE 128          1HG1      ILE 128 137.532  -9.202  -7.434
  377   1HG2  ILE 128          1HG2      ILE 128 139.609  -7.965  -5.818
  378   2HG2  ILE 128          2HG2      ILE 128 139.713  -7.696  -7.556
  379   3HG2  ILE 128          3HG2      ILE 128 141.108  -8.318  -6.675
  380   1HD1  ILE 128          1HD1      ILE 128 139.591  -9.378  -9.582
  381   2HD1  ILE 128          2HD1      ILE 128 138.470  -8.071  -9.201
  382   3HD1  ILE 128          3HD1      ILE 128 137.881  -9.540  -9.980
  383    H    THR 129           H        THR 129 142.816  -9.249  -7.364
  384    HA   THR 129           HA       THR 129 143.947 -10.968  -5.279
  385    HB   THR 129           HB       THR 129 146.054  -9.673  -5.750
  386    HG1  THR 129           HG1      THR 129 145.112  -7.822  -6.654
  387   1HG2  THR 129          1HG2      THR 129 145.962 -11.745  -6.834
  388   2HG2  THR 129          2HG2      THR 129 146.386 -10.580  -8.087
  389   3HG2  THR 129          3HG2      THR 129 144.735 -11.190  -7.972
  390    H    GLU 130           H        GLU 130 145.230  -9.822  -3.554
  391    HA   GLU 130           HA       GLU 130 143.549  -8.165  -2.045
  392   1HB   GLU 130          2HB       GLU 130 146.542  -8.457  -1.744
  393   2HB   GLU 130          1HB       GLU 130 145.405  -7.941  -0.506
  394   1HG   GLU 130          2HG       GLU 130 144.353 -10.333  -1.141
  395   2HG   GLU 130          1HG       GLU 130 146.056 -10.640  -1.478
  396    H    ASP 131           H        ASP 131 146.002  -7.431  -4.403
  397    HA   ASP 131           HA       ASP 131 146.589  -4.788  -3.747
  398   1HB   ASP 131          2HB       ASP 131 146.801  -6.486  -6.142
  399   2HB   ASP 131          1HB       ASP 131 146.688  -4.761  -6.481
  400    H    ASP 132           H        ASP 132 144.030  -6.073  -5.852
  401    HA   ASP 132           HA       ASP 132 142.942  -3.599  -6.608
  402   1HB   ASP 132          2HB       ASP 132 142.354  -6.338  -7.034
  403   2HB   ASP 132          1HB       ASP 132 140.876  -5.586  -6.442
  404    H    ILE 133           H        ILE 133 142.270  -5.714  -3.862
  405    HA   ILE 133           HA       ILE 133 140.090  -4.129  -2.890
  406    HB   ILE 133           HB       ILE 133 141.703  -6.169  -1.359
  407   1HG1  ILE 133          2HG1      ILE 133 139.087  -6.940  -2.478
  408   2HG1  ILE 133          1HG1      ILE 133 140.353  -6.688  -3.674
  409   1HG2  ILE 133          1HG2      ILE 133 139.506  -6.415  -0.135
  410   2HG2  ILE 133          2HG2      ILE 133 138.991  -4.938  -0.948
  411   3HG2  ILE 133          3HG2      ILE 133 140.381  -4.907   0.139
  412   1HD1  ILE 133          1HD1      ILE 133 141.608  -8.447  -2.912
  413   2HD1  ILE 133          2HD1      ILE 133 139.970  -9.037  -2.633
  414   3HD1  ILE 133          3HD1      ILE 133 140.912  -8.384  -1.294
  415    H    GLU 134           H        GLU 134 143.540  -4.160  -2.447
  416    HA   GLU 134           HA       GLU 134 143.722  -2.779  -0.014
  417   1HB   GLU 134          2HB       GLU 134 145.523  -3.311  -2.302
  418   2HB   GLU 134          1HB       GLU 134 145.948  -1.938  -1.289
  419   1HG   GLU 134          2HG       GLU 134 145.264  -4.330   0.229
  420   2HG   GLU 134          1HG       GLU 134 146.649  -4.543  -0.841
  421    H    GLU 135           H        GLU 135 143.871  -1.521  -3.345
  422    HA   GLU 135           HA       GLU 135 143.945   1.201  -2.575
  423   1HB   GLU 135          2HB       GLU 135 143.408   1.661  -4.948
  424   2HB   GLU 135          1HB       GLU 135 144.732   0.517  -4.760
  425   1HG   GLU 135          2HG       GLU 135 142.693  -1.204  -4.934
  426   2HG   GLU 135          1HG       GLU 135 142.030   0.129  -5.876
  427    H    LEU 136           H        LEU 136 141.351  -1.065  -3.096
  428    HA   LEU 136           HA       LEU 136 139.224   0.709  -3.481
  429   1HB   LEU 136          2HB       LEU 136 139.500  -2.009  -3.322
  430   2HB   LEU 136          1HB       LEU 136 138.609  -1.657  -1.854
  431    HG   LEU 136           HG       LEU 136 137.640  -0.506  -4.434
  432   1HD1  LEU 136          1HD1      LEU 136 137.688  -2.611  -5.282
  433   2HD1  LEU 136          2HD1      LEU 136 136.183  -2.728  -4.371
  434   3HD1  LEU 136          3HD1      LEU 136 137.675  -3.373  -3.692
  435   1HD2  LEU 136          1HD2      LEU 136 135.488  -0.708  -3.351
  436   2HD2  LEU 136          2HD2      LEU 136 136.617   0.126  -2.283
  437   3HD2  LEU 136          3HD2      LEU 136 136.220  -1.568  -1.995
  438    H    MET 137           H        MET 137 140.721  -0.497  -0.518
  439    HA   MET 137           HA       MET 137 138.842   0.909   1.170
  440   1HB   MET 137          2HB       MET 137 141.427  -0.439   1.965
  441   2HB   MET 137          1HB       MET 137 140.092   0.001   3.023
  442   1HG   MET 137          2HG       MET 137 140.081  -2.106   0.877
  443   2HG   MET 137          1HG       MET 137 140.052  -2.361   2.621
  444   1HE   MET 137          1HE       MET 137 136.869  -0.754   3.722
  445   2HE   MET 137          2HE       MET 137 138.484  -1.358   4.091
  446   3HE   MET 137          3HE       MET 137 137.145  -2.488   3.886
  447    H    LYS 138           H        LYS 138 142.064   1.391  -0.097
  448    HA   LYS 138           HA       LYS 138 142.954   3.410   1.620
  449   1HB   LYS 138          2HB       LYS 138 144.194   2.129  -0.276
  450   2HB   LYS 138          1HB       LYS 138 143.602   3.421  -1.312
  451   1HG   LYS 138          2HG       LYS 138 144.918   4.297   1.168
  452   2HG   LYS 138          1HG       LYS 138 145.956   3.482  -0.004
  453   1HD   LYS 138          2HD       LYS 138 144.839   5.083  -1.718
  454   2HD   LYS 138          1HD       LYS 138 144.409   6.028  -0.290
  455   1HE   LYS 138          2HE       LYS 138 146.620   6.487   0.231
  456   2HE   LYS 138          1HE       LYS 138 147.226   5.110  -0.690
  457   1HZ   LYS 138          1HZ       LYS 138 147.756   7.017  -1.929
  458   2HZ   LYS 138          2HZ       LYS 138 146.217   7.692  -1.734
  459   3HZ   LYS 138          3HZ       LYS 138 146.426   6.335  -2.720
  460    H    ASP 139           H        ASP 139 141.194   3.652  -1.461
  461    HA   ASP 139           HA       ASP 139 140.918   6.511  -1.195
  462   1HB   ASP 139          2HB       ASP 139 139.855   6.460  -3.329
  463   2HB   ASP 139          1HB       ASP 139 141.188   5.315  -3.400
  464    H    GLY 140           H        GLY 140 139.166   3.749  -0.185
  465   1HA   GLY 140          2HA       GLY 140 136.577   4.996  -0.112
  466   2HA   GLY 140          1HA       GLY 140 137.019   3.463   0.625
  467    H    ASP 141           H        ASP 141 139.288   4.748   2.062
  468    HA   ASP 141           HA       ASP 141 137.711   5.756   4.301
  469   1HB   ASP 141          2HB       ASP 141 139.606   3.921   4.366
  470   2HB   ASP 141          1HB       ASP 141 140.666   5.325   4.460
  471    H    LYS 142           H        LYS 142 137.970   7.754   5.216
  472    HA   LYS 142           HA       LYS 142 139.671   9.650   3.732
  473   1HB   LYS 142          2HB       LYS 142 137.088  10.224   5.194
  474   2HB   LYS 142          1HB       LYS 142 138.056  11.395   4.309
  475   1HG   LYS 142          2HG       LYS 142 136.744   8.983   3.074
  476   2HG   LYS 142          1HG       LYS 142 136.064  10.611   3.073
  477   1HD   LYS 142          2HD       LYS 142 138.495  11.150   2.080
  478   2HD   LYS 142          1HD       LYS 142 138.318   9.487   1.517
  479   1HE   LYS 142          2HE       LYS 142 136.178  10.075   0.477
  480   2HE   LYS 142          1HE       LYS 142 136.370  11.738   1.032
  481   1HZ   LYS 142          1HZ       LYS 142 137.913  12.183  -0.537
  482   2HZ   LYS 142          2HZ       LYS 142 137.118  10.943  -1.367
  483   3HZ   LYS 142          3HZ       LYS 142 138.554  10.616  -0.538
  484    H    ASN 143           H        ASN 143 138.437   8.715   6.899
  485    HA   ASN 143           HA       ASN 143 140.138  10.623   8.263
  486   1HB   ASN 143          2HB       ASN 143 139.188   9.539  10.331
  487   2HB   ASN 143          1HB       ASN 143 137.994  10.260   9.256
  488   1HD2  ASN 143          1HD2      ASN 143 136.353   8.967  10.069
  489   2HD2  ASN 143          2HD2      ASN 143 136.233   7.285   9.690
  490    H    ASN 144           H        ASN 144 140.364   7.404   7.140
  491    HA   ASN 144           HA       ASN 144 142.039   5.868   7.228
  492   1HB   ASN 144          2HB       ASN 144 143.428   8.082   7.191
  493   2HB   ASN 144          1HB       ASN 144 143.729   7.712   8.886
  494   1HD2  ASN 144          1HD2      ASN 144 145.712   6.953   9.032
  495   2HD2  ASN 144          2HD2      ASN 144 146.407   5.730   8.029
  496    H    ASP 145           H        ASP 145 140.345   4.935   8.716
  497    HA   ASP 145           HA       ASP 145 141.371   4.698  11.465
  498   1HB   ASP 145          2HB       ASP 145 139.107   3.986  12.096
  499   2HB   ASP 145          1HB       ASP 145 139.086   5.571  11.329
  500    H    GLY 146           H        GLY 146 140.747   2.991   8.535
  501   1HA   GLY 146          2HA       GLY 146 142.071   0.896   8.349
  502   2HA   GLY 146          1HA       GLY 146 141.388   0.452   9.905
  503    H    ARG 147           H        ARG 147 138.750   1.615   9.084
  504    HA   ARG 147           HA       ARG 147 137.935  -0.348   7.058
  505   1HB   ARG 147          2HB       ARG 147 136.385   0.111   9.608
  506   2HB   ARG 147          1HB       ARG 147 136.073  -1.096   8.370
  507   1HG   ARG 147          2HG       ARG 147 138.448  -1.953   8.974
  508   2HG   ARG 147          1HG       ARG 147 138.195  -1.041  10.464
  509   1HD   ARG 147          2HD       ARG 147 136.153  -2.291  10.899
  510   2HD   ARG 147          1HD       ARG 147 136.355  -3.174   9.388
  511    HE   ARG 147           HE       ARG 147 138.667  -3.629  10.774
  512   1HH1  ARG 147          1HH1      ARG 147 135.270  -4.109  11.412
  513   2HH1  ARG 147          2HH1      ARG 147 135.529  -5.479  12.439
  514   1HH2  ARG 147          1HH2      ARG 147 139.010  -5.431  12.122
  515   2HH2  ARG 147          2HH2      ARG 147 137.652  -6.230  12.843
  516    H    ILE 148           H        ILE 148 135.442   0.059   6.615
  517    HA   ILE 148           HA       ILE 148 135.103   2.971   6.304
  518    HB   ILE 148           HB       ILE 148 134.040   0.847   4.440
  519   1HG1  ILE 148          2HG1      ILE 148 136.351   2.729   3.937
  520   2HG1  ILE 148          1HG1      ILE 148 136.565   1.071   4.486
  521   1HG2  ILE 148          1HG2      ILE 148 133.904   3.825   4.528
  522   2HG2  ILE 148          2HG2      ILE 148 132.653   2.650   4.121
  523   3HG2  ILE 148          3HG2      ILE 148 133.933   3.010   2.964
  524   1HD1  ILE 148          1HD1      ILE 148 136.879   1.146   2.123
  525   2HD1  ILE 148          2HD1      ILE 148 135.341   1.981   1.896
  526   3HD1  ILE 148          3HD1      ILE 148 135.363   0.308   2.455
  527    H    ASP 149           H        ASP 149 132.949   3.790   6.358
  528    HA   ASP 149           HA       ASP 149 130.944   1.996   7.534
  529   1HB   ASP 149          2HB       ASP 149 130.325   3.710   9.174
  530   2HB   ASP 149          1HB       ASP 149 132.008   3.229   9.375
  531    H    TYR 150           H        TYR 150 128.852   3.620   7.859
  532    HA   TYR 150           HA       TYR 150 127.903   4.014   5.233
  533   1HB   TYR 150          2HB       TYR 150 126.489   3.490   7.238
  534   2HB   TYR 150          1HB       TYR 150 126.725   5.150   7.774
  535    HD1  TYR 150           HD1      TYR 150 124.871   6.467   7.432
  536    HD2  TYR 150           HD2      TYR 150 125.830   3.508   4.530
  537    HE1  TYR 150           HE1      TYR 150 122.945   7.178   6.079
  538    HE2  TYR 150           HE2      TYR 150 123.907   4.210   3.168
  539    HH   TYR 150           HH       TYR 150 122.474   6.122   2.854
  540    H    ASP 151           H        ASP 151 128.569   6.410   7.796
  541    HA   ASP 151           HA       ASP 151 128.123   8.702   6.303
  542   1HB   ASP 151          2HB       ASP 151 129.682   8.057   8.746
  543   2HB   ASP 151          1HB       ASP 151 130.051   9.584   7.952
  544    H    GLU 152           H        GLU 152 130.902   6.590   6.365
  545    HA   GLU 152           HA       GLU 152 132.604   8.405   4.913
  546   1HB   GLU 152          2HB       GLU 152 132.826   5.635   5.973
  547   2HB   GLU 152          1HB       GLU 152 133.895   6.084   4.651
  548   1HG   GLU 152          2HG       GLU 152 133.682   7.853   7.041
  549   2HG   GLU 152          1HG       GLU 152 134.648   6.381   7.123
  550    H    PHE 153           H        PHE 153 130.962   5.335   4.164
  551    HA   PHE 153           HA       PHE 153 131.692   5.166   1.480
  552   1HB   PHE 153          2HB       PHE 153 130.335   3.546   3.123
  553   2HB   PHE 153          1HB       PHE 153 128.973   4.233   2.244
  554    HD1  PHE 153           HD1      PHE 153 129.166   4.193  -0.352
  555    HD2  PHE 153           HD2      PHE 153 131.438   1.715   2.259
  556    HE1  PHE 153           HE1      PHE 153 129.559   2.614  -2.196
  557    HE2  PHE 153           HE2      PHE 153 131.836   0.133   0.418
  558    HZ   PHE 153           HZ       PHE 153 130.896   0.582  -1.813
  559    H    LEU 154           H        LEU 154 129.181   7.023   3.049
  560    HA   LEU 154           HA       LEU 154 127.611   7.655   0.819
  561   1HB   LEU 154          2HB       LEU 154 128.022   8.752   3.522
  562   2HB   LEU 154          1HB       LEU 154 127.404   9.894   2.346
  563    HG   LEU 154           HG       LEU 154 125.495   8.444   1.895
  564   1HD1  LEU 154          1HD1      LEU 154 125.285   6.319   2.596
  565   2HD1  LEU 154          2HD1      LEU 154 126.028   6.650   4.161
  566   3HD1  LEU 154          3HD1      LEU 154 127.040   6.395   2.740
  567   1HD2  LEU 154          1HD2      LEU 154 125.456   8.483   4.841
  568   2HD2  LEU 154          2HD2      LEU 154 124.324   9.174   3.678
  569   3HD2  LEU 154          3HD2      LEU 154 125.828  10.017   4.053
  570    H    GLU 155           H        GLU 155 130.432   9.307   2.195
  571    HA   GLU 155           HA       GLU 155 130.428  11.378   0.220
  572   1HB   GLU 155          2HB       GLU 155 132.619  10.518   2.118
  573   2HB   GLU 155          1HB       GLU 155 132.598  12.009   1.187
  574   1HG   GLU 155          2HG       GLU 155 130.429  11.334   3.142
  575   2HG   GLU 155          1HG       GLU 155 131.922  12.130   3.637
  576    H    PHE 156           H        PHE 156 132.165   8.342   0.679
  577    HA   PHE 156           HA       PHE 156 134.040   8.621  -1.379
  578   1HB   PHE 156          2HB       PHE 156 134.129   6.851   0.346
  579   2HB   PHE 156          1HB       PHE 156 132.732   6.076  -0.393
  580    HD1  PHE 156           HD1      PHE 156 135.786   7.573  -1.913
  581    HD2  PHE 156           HD2      PHE 156 133.450   4.073  -1.273
  582    HE1  PHE 156           HE1      PHE 156 137.281   6.307  -3.403
  583    HE2  PHE 156           HE2      PHE 156 134.941   2.802  -2.762
  584    HZ   PHE 156           HZ       PHE 156 136.857   3.918  -3.829
  585    H    MET 157           H        MET 157 130.658   7.795  -1.439
  586    HA   MET 157           HA       MET 157 130.809   7.135  -4.291
  587   1HB   MET 157          2HB       MET 157 128.947   6.486  -2.094
  588   2HB   MET 157          1HB       MET 157 128.191   6.799  -3.650
  589   1HG   MET 157          2HG       MET 157 130.515   4.962  -3.594
  590   2HG   MET 157          1HG       MET 157 128.992   4.387  -2.917
  591   1HE   MET 157          1HE       MET 157 129.568   2.453  -5.262
  592   2HE   MET 157          2HE       MET 157 130.923   3.574  -5.396
  593   3HE   MET 157          3HE       MET 157 129.910   3.246  -6.801
  594    H    LYS 158           H        LYS 158 131.005   9.884  -3.017
  595    HA   LYS 158           HA       LYS 158 128.613  11.191  -4.039
  596   1HB   LYS 158          2HB       LYS 158 130.220  11.727  -1.900
  597   2HB   LYS 158          1HB       LYS 158 130.831  12.872  -3.086
  598   1HG   LYS 158          2HG       LYS 158 127.906  12.757  -2.861
  599   2HG   LYS 158          1HG       LYS 158 128.752  13.344  -1.428
  600   1HD   LYS 158          2HD       LYS 158 129.806  15.084  -2.670
  601   2HD   LYS 158          1HD       LYS 158 129.250  14.407  -4.202
  602   1HE   LYS 158          2HE       LYS 158 127.937  16.372  -3.496
  603   2HE   LYS 158          1HE       LYS 158 126.957  14.913  -3.638
  604   1HZ   LYS 158          1HZ       LYS 158 126.342  16.007  -1.643
  605   2HZ   LYS 158          2HZ       LYS 158 127.949  16.176  -1.145
  606   3HZ   LYS 158          3HZ       LYS 158 127.236  14.644  -1.189
  607    H    GLY 159           H        GLY 159 130.563   9.876  -5.861
  608   1HA   GLY 159          2HA       GLY 159 130.835  10.575  -8.140
  609   2HA   GLY 159          1HA       GLY 159 131.054  12.221  -7.569
  610    H    VAL 160           H        VAL 160 132.562   9.024  -7.090
  611    HA   VAL 160           HA       VAL 160 135.182  10.339  -7.038
  612    HB   VAL 160           HB       VAL 160 135.970   8.045  -6.271
  613   1HG1  VAL 160          1HG1      VAL 160 135.718   9.934  -4.753
  614   2HG1  VAL 160          2HG1      VAL 160 135.252   8.427  -3.965
  615   3HG1  VAL 160          3HG1      VAL 160 134.012   9.543  -4.537
  616   1HG2  VAL 160          1HG2      VAL 160 133.031   7.611  -5.771
  617   2HG2  VAL 160          2HG2      VAL 160 134.354   6.508  -5.394
  618   3HG2  VAL 160          3HG2      VAL 160 133.939   6.846  -7.074
  619    H    GLU 161           H        GLU 161 133.657   9.876  -9.506
  620    HA   GLU 161           HA       GLU 161 135.313   7.853 -10.842
  621   1HB   GLU 161          2HB       GLU 161 132.732   9.202 -11.634
  622   2HB   GLU 161          1HB       GLU 161 133.663   8.200 -12.739
  623   1HG   GLU 161          2HG       GLU 161 133.001   7.014 -10.118
  624   2HG   GLU 161          1HG       GLU 161 131.664   7.264 -11.242
  Start of MODEL   17
    1   1H    MET  81          1HT       MET  81  91.700  16.769  -2.049
    2   2H    MET  81          2HT       MET  81  90.603  15.649  -2.747
    3   3H    MET  81          3HT       MET  81  90.852  17.180  -3.480
    4    HA   MET  81           HA       MET  81  92.042  15.726  -4.766
    5   1HB   MET  81          2HB       MET  81  93.932  16.896  -2.713
    6   2HB   MET  81          1HB       MET  81  94.357  16.421  -4.351
    7   1HG   MET  81          2HG       MET  81  93.981  18.531  -4.915
    8   2HG   MET  81          1HG       MET  81  92.267  18.162  -4.737
    9   1HE   MET  81          1HE       MET  81  93.386  21.711  -3.441
   10   2HE   MET  81          2HE       MET  81  94.053  20.654  -4.684
   11   3HE   MET  81          3HE       MET  81  94.931  20.903  -3.175
   12    H    VAL  82           H        VAL  82  93.447  13.930  -5.035
   13    HA   VAL  82           HA       VAL  82  93.911  12.290  -2.645
   14    HB   VAL  82           HB       VAL  82  91.834  11.482  -3.692
   15   1HG1  VAL  82          1HG1      VAL  82  93.199  10.391  -6.056
   16   2HG1  VAL  82          2HG1      VAL  82  92.957  12.138  -6.063
   17   3HG1  VAL  82          3HG1      VAL  82  91.574  11.056  -5.886
   18   1HG2  VAL  82          1HG2      VAL  82  92.674   9.649  -2.696
   19   2HG2  VAL  82          2HG2      VAL  82  94.272   9.869  -3.409
   20   3HG2  VAL  82          3HG2      VAL  82  92.985   9.110  -4.346
   21    H    ARG  83           H        ARG  83  95.996  11.813  -2.541
   22    HA   ARG  83           HA       ARG  83  97.422  11.078  -4.989
   23   1HB   ARG  83          2HB       ARG  83  99.383  12.433  -4.263
   24   2HB   ARG  83          1HB       ARG  83  97.985  13.400  -4.712
   25   1HG   ARG  83          2HG       ARG  83  97.647  13.025  -2.004
   26   2HG   ARG  83          1HG       ARG  83  99.393  13.217  -2.179
   27   1HD   ARG  83          2HD       ARG  83  98.592  15.212  -3.764
   28   2HD   ARG  83          1HD       ARG  83  97.202  15.148  -2.681
   29    HE   ARG  83           HE       ARG  83  99.580  15.146  -1.172
   30   1HH1  ARG  83          1HH1      ARG  83  97.631  17.263  -3.146
   31   2HH1  ARG  83          2HH1      ARG  83  98.134  18.700  -2.322
   32   1HH2  ARG  83          1HH2      ARG  83 100.242  17.036  -0.085
   33   2HH2  ARG  83          2HH2      ARG  83  99.617  18.572  -0.584
   34    H    CYS  84           H        CYS  84  98.078   9.067  -4.622
   35    HA   CYS  84           HA       CYS  84  99.486   8.486  -2.120
   36   1HB   CYS  84          2HB       CYS  84  97.233   6.849  -3.289
   37   2HB   CYS  84          1HB       CYS  84  98.345   6.233  -2.073
   38    HG   CYS  84           HG       CYS  84  97.121   8.706  -0.984
   39    H    MET  85           H        MET  85 101.329   8.738  -3.552
   40    HA   MET  85           HA       MET  85 102.263   6.242  -4.529
   41   1HB   MET  85          2HB       MET  85 100.704   7.249  -6.383
   42   2HB   MET  85          1HB       MET  85 102.086   8.282  -6.713
   43   1HG   MET  85          2HG       MET  85 103.467   6.402  -7.206
   44   2HG   MET  85          1HG       MET  85 102.220   5.280  -6.661
   45   1HE   MET  85          1HE       MET  85 103.612   4.855  -9.464
   46   2HE   MET  85          2HE       MET  85 102.197   4.499 -10.454
   47   3HE   MET  85          3HE       MET  85 102.313   3.855  -8.816
   48    H    LYS  86           H        LYS  86 102.641   9.761  -4.732
   49    HA   LYS  86           HA       LYS  86 105.553   9.407  -4.514
   50   1HB   LYS  86          2HB       LYS  86 104.616  10.717  -6.460
   51   2HB   LYS  86          1HB       LYS  86 104.080  11.922  -5.298
   52   1HG   LYS  86          2HG       LYS  86 106.400  12.268  -4.594
   53   2HG   LYS  86          1HG       LYS  86 106.927  11.079  -5.786
   54   1HD   LYS  86          2HD       LYS  86 105.531  12.665  -7.403
   55   2HD   LYS  86          1HD       LYS  86 105.945  13.854  -6.167
   56   1HE   LYS  86          2HE       LYS  86 108.340  13.103  -6.415
   57   2HE   LYS  86          1HE       LYS  86 107.820  12.181  -7.826
   58   1HZ   LYS  86          1HZ       LYS  86 107.038  14.981  -7.767
   59   2HZ   LYS  86          2HZ       LYS  86 107.584  14.035  -9.058
   60   3HZ   LYS  86          3HZ       LYS  86 108.693  14.681  -7.957
   61    H    ASP  87           H        ASP  87 105.801   9.178  -2.320
   62    HA   ASP  87           HA       ASP  87 104.725  11.291  -0.594
   63   1HB   ASP  87          2HB       ASP  87 104.687   8.611  -0.220
   64   2HB   ASP  87          1HB       ASP  87 106.183   9.018   0.617
   65    H    ASP  88           H        ASP  88 107.760   9.564  -1.268
   66    HA   ASP  88           HA       ASP  88 109.355  11.283   0.346
   67   1HB   ASP  88          2HB       ASP  88 109.985   9.229  -1.765
   68   2HB   ASP  88          1HB       ASP  88 111.252  10.208  -1.030
   69    H    SER  89           H        SER  89 111.440  12.196  -0.931
   70    HA   SER  89           HA       SER  89 110.351  14.294  -2.618
   71   1HB   SER  89          2HB       SER  89 113.211  13.962  -1.694
   72   2HB   SER  89          1HB       SER  89 112.438  15.432  -2.286
   73    HG   SER  89           HG       SER  89 112.002  14.077   0.156
   74    H    LYS  90           H        LYS  90 113.317  12.322  -2.839
   75    HA   LYS  90           HA       LYS  90 112.965  12.304  -5.762
   76   1HB   LYS  90          2HB       LYS  90 115.167  13.053  -4.214
   77   2HB   LYS  90          1HB       LYS  90 115.591  11.470  -4.851
   78   1HG   LYS  90          2HG       LYS  90 115.413  12.198  -7.076
   79   2HG   LYS  90          1HG       LYS  90 114.557  13.670  -6.610
   80   1HD   LYS  90          2HD       LYS  90 116.473  14.723  -5.907
   81   2HD   LYS  90          1HD       LYS  90 117.298  13.208  -5.536
   82   1HE   LYS  90          2HE       LYS  90 117.958  12.875  -7.705
   83   2HE   LYS  90          1HE       LYS  90 116.605  13.790  -8.370
   84   1HZ   LYS  90          1HZ       LYS  90 118.675  15.179  -6.807
   85   2HZ   LYS  90          2HZ       LYS  90 117.668  15.784  -8.025
   86   3HZ   LYS  90          3HZ       LYS  90 118.975  14.786  -8.425
   87    H    GLY  91           H        GLY  91 114.204  10.319  -6.750
   88   1HA   GLY  91          2HA       GLY  91 112.880   7.981  -5.665
   89   2HA   GLY  91          1HA       GLY  91 113.758   8.074  -7.184
   90    H    LYS  92           H        LYS  92 116.208   8.438  -6.856
   91    HA   LYS  92           HA       LYS  92 117.095   6.411  -4.941
   92   1HB   LYS  92          2HB       LYS  92 118.069   7.403  -7.554
   93   2HB   LYS  92          1HB       LYS  92 119.307   6.934  -6.397
   94   1HG   LYS  92          2HG       LYS  92 118.448   4.717  -6.260
   95   2HG   LYS  92          1HG       LYS  92 117.016   5.156  -7.191
   96   1HD   LYS  92          2HD       LYS  92 118.096   4.552  -9.038
   97   2HD   LYS  92          1HD       LYS  92 119.220   5.887  -8.771
   98   1HE   LYS  92          2HE       LYS  92 120.215   4.047  -7.060
   99   2HE   LYS  92          1HE       LYS  92 119.559   2.996  -8.313
  100   1HZ   LYS  92          1HZ       LYS  92 120.806   4.557  -9.902
  101   2HZ   LYS  92          2HZ       LYS  92 121.699   3.414  -9.034
  102   3HZ   LYS  92          3HZ       LYS  92 121.681   5.030  -8.533
  103    H    THR  93           H        THR  93 117.080   7.672  -3.053
  104    HA   THR  93           HA       THR  93 118.897   9.970  -2.977
  105    HB   THR  93           HB       THR  93 117.841   9.900  -0.492
  106    HG1  THR  93           HG1      THR  93 115.779   9.149  -0.548
  107   1HG2  THR  93          1HG2      THR  93 117.229  11.888  -1.242
  108   2HG2  THR  93          2HG2      THR  93 115.798  11.114  -1.924
  109   3HG2  THR  93          3HG2      THR  93 117.240  11.330  -2.916
  110    H    GLU  94           H        GLU  94 119.831  10.069  -0.507
  111    HA   GLU  94           HA       GLU  94 121.938   8.217  -0.472
  112   1HB   GLU  94          2HB       GLU  94 120.902  10.264   1.439
  113   2HB   GLU  94          1HB       GLU  94 122.094   9.105   2.012
  114   1HG   GLU  94          2HG       GLU  94 123.536   9.794   0.073
  115   2HG   GLU  94          1HG       GLU  94 122.388  11.101  -0.214
  116    H    GLU  95           H        GLU  95 118.736   8.028   0.794
  117    HA   GLU  95           HA       GLU  95 119.113   6.196   2.882
  118   1HB   GLU  95          2HB       GLU  95 116.732   5.662   2.597
  119   2HB   GLU  95          1HB       GLU  95 117.015   7.397   2.569
  120   1HG   GLU  95          2HG       GLU  95 116.939   7.313   0.091
  121   2HG   GLU  95          1HG       GLU  95 116.498   5.610   0.205
  122    H    GLU  96           H        GLU  96 118.534   5.688  -0.576
  123    HA   GLU  96           HA       GLU  96 118.360   2.873  -0.450
  124   1HB   GLU  96          2HB       GLU  96 118.601   2.908  -2.854
  125   2HB   GLU  96          1HB       GLU  96 117.556   4.233  -2.361
  126   1HG   GLU  96          2HG       GLU  96 118.864   5.695  -3.373
  127   2HG   GLU  96          1HG       GLU  96 120.257   5.153  -2.436
  128    H    LEU  97           H        LEU  97 121.059   5.070  -0.568
  129    HA   LEU  97           HA       LEU  97 123.063   3.359  -1.490
  130   1HB   LEU  97          2HB       LEU  97 122.905   5.909  -0.112
  131   2HB   LEU  97          1HB       LEU  97 124.276   4.967   0.441
  132    HG   LEU  97           HG       LEU  97 123.748   5.519  -2.473
  133   1HD1  LEU  97          1HD1      LEU  97 125.482   7.056  -0.547
  134   2HD1  LEU  97          2HD1      LEU  97 124.023   7.645  -1.342
  135   3HD1  LEU  97          3HD1      LEU  97 125.458   7.269  -2.297
  136   1HD2  LEU  97          1HD2      LEU  97 126.231   5.051  -2.562
  137   2HD2  LEU  97          2HD2      LEU  97 125.195   3.669  -2.209
  138   3HD2  LEU  97          3HD2      LEU  97 126.088   4.457  -0.908
  139    H    SER  98           H        SER  98 121.520   3.601   1.629
  140    HA   SER  98           HA       SER  98 123.427   2.163   3.136
  141   1HB   SER  98          2HB       SER  98 121.469   3.593   3.989
  142   2HB   SER  98          1HB       SER  98 120.467   2.167   3.709
  143    HG   SER  98           HG       SER  98 122.830   2.079   5.259
  144    H    ASP  99           H        ASP  99 120.813   1.180   1.040
  145    HA   ASP  99           HA       ASP  99 120.569  -1.492   1.888
  146   1HB   ASP  99          2HB       ASP  99 119.080  -0.082   0.273
  147   2HB   ASP  99          1HB       ASP  99 120.167  -0.686  -0.975
  148    H    LEU 100           H        LEU 100 122.466  -0.066  -0.765
  149    HA   LEU 100           HA       LEU 100 123.660  -2.473  -1.604
  150   1HB   LEU 100          2HB       LEU 100 124.048   0.398  -2.091
  151   2HB   LEU 100          1HB       LEU 100 125.498  -0.567  -2.281
  152    HG   LEU 100           HG       LEU 100 122.929  -1.276  -3.675
  153   1HD1  LEU 100          1HD1      LEU 100 123.434   0.048  -5.488
  154   2HD1  LEU 100          2HD1      LEU 100 125.134   0.200  -5.041
  155   3HD1  LEU 100          3HD1      LEU 100 123.903   1.094  -4.146
  156   1HD2  LEU 100          1HD2      LEU 100 125.805  -2.083  -3.904
  157   2HD2  LEU 100          2HD2      LEU 100 124.699  -2.264  -5.266
  158   3HD2  LEU 100          3HD2      LEU 100 124.371  -3.098  -3.748
  159    H    PHE 101           H        PHE 101 124.464  -0.196   0.918
  160    HA   PHE 101           HA       PHE 101 127.120  -0.942   1.391
  161   1HB   PHE 101          2HB       PHE 101 126.088   1.053   2.387
  162   2HB   PHE 101          1HB       PHE 101 125.054   0.028   3.377
  163    HD1  PHE 101           HD1      PHE 101 125.820  -0.871   5.411
  164    HD2  PHE 101           HD2      PHE 101 128.557   1.029   2.762
  165    HE1  PHE 101           HE1      PHE 101 127.543  -0.912   7.168
  166    HE2  PHE 101           HE2      PHE 101 130.284   0.992   4.513
  167    HZ   PHE 101           HZ       PHE 101 129.779   0.019   6.719
  168    H    ARG 102           H        ARG 102 124.086  -2.279   2.613
  169    HA   ARG 102           HA       ARG 102 125.170  -4.066   4.480
  170   1HB   ARG 102          2HB       ARG 102 122.672  -3.367   3.874
  171   2HB   ARG 102          1HB       ARG 102 122.741  -4.861   2.952
  172   1HG   ARG 102          2HG       ARG 102 123.778  -5.625   5.362
  173   2HG   ARG 102          1HG       ARG 102 122.558  -4.439   5.830
  174   1HD   ARG 102          2HD       ARG 102 121.971  -6.659   3.893
  175   2HD   ARG 102          1HD       ARG 102 121.817  -6.874   5.636
  176    HE   ARG 102           HE       ARG 102 120.002  -5.515   3.919
  177   1HH1  ARG 102          1HH1      ARG 102 121.330  -5.476   7.147
  178   2HH1  ARG 102          2HH1      ARG 102 119.944  -4.705   7.842
  179   1HH2  ARG 102          1HH2      ARG 102 118.181  -4.498   4.831
  180   2HH2  ARG 102          2HH2      ARG 102 118.157  -4.149   6.528
  181    H    MET 103           H        MET 103 124.810  -4.269   1.010
  182    HA   MET 103           HA       MET 103 125.270  -7.065   0.782
  183   1HB   MET 103          2HB       MET 103 125.244  -4.748  -1.096
  184   2HB   MET 103          1HB       MET 103 125.998  -6.244  -1.631
  185   1HG   MET 103          2HG       MET 103 123.645  -7.149  -0.607
  186   2HG   MET 103          1HG       MET 103 123.175  -5.579  -1.258
  187   1HE   MET 103          1HE       MET 103 124.928  -9.108  -3.609
  188   2HE   MET 103          2HE       MET 103 124.996  -8.849  -1.865
  189   3HE   MET 103          3HE       MET 103 126.070  -7.946  -2.934
  190    H    PHE 104           H        PHE 104 127.344  -4.249   0.924
  191    HA   PHE 104           HA       PHE 104 129.722  -5.610   0.103
  192   1HB   PHE 104          2HB       PHE 104 128.972  -2.913   0.933
  193   2HB   PHE 104          1HB       PHE 104 130.548  -3.396   1.551
  194    HD1  PHE 104           HD1      PHE 104 128.554  -3.199  -1.575
  195    HD2  PHE 104           HD2      PHE 104 132.424  -3.281   0.192
  196    HE1  PHE 104           HE1      PHE 104 129.560  -2.693  -3.764
  197    HE2  PHE 104           HE2      PHE 104 133.438  -2.774  -1.993
  198    HZ   PHE 104           HZ       PHE 104 132.004  -2.479  -3.973
  199    H    ASP 105           H        ASP 105 128.141  -4.960   3.161
  200    HA   ASP 105           HA       ASP 105 130.382  -5.885   4.730
  201   1HB   ASP 105          2HB       ASP 105 128.559  -4.136   5.387
  202   2HB   ASP 105          1HB       ASP 105 127.601  -5.551   5.811
  203    H    LYS 106           H        LYS 106 130.507  -7.797   5.898
  204    HA   LYS 106           HA       LYS 106 128.780  -9.949   4.891
  205   1HB   LYS 106          2HB       LYS 106 131.251 -10.142   4.573
  206   2HB   LYS 106          1HB       LYS 106 131.432 -10.178   6.322
  207   1HG   LYS 106          2HG       LYS 106 131.528 -12.414   5.362
  208   2HG   LYS 106          1HG       LYS 106 130.139 -12.231   6.436
  209   1HD   LYS 106          2HD       LYS 106 128.656 -12.520   4.767
  210   2HD   LYS 106          1HD       LYS 106 129.612 -11.578   3.621
  211   1HE   LYS 106          2HE       LYS 106 130.612 -13.400   2.779
  212   2HE   LYS 106          1HE       LYS 106 130.830 -14.131   4.368
  213   1HZ   LYS 106          1HZ       LYS 106 128.226 -14.077   2.951
  214   2HZ   LYS 106          2HZ       LYS 106 128.636 -14.979   4.323
  215   3HZ   LYS 106          3HZ       LYS 106 129.322 -15.360   2.824
  216    H    ASN 107           H        ASN 107 130.099  -8.569   7.864
  217    HA   ASN 107           HA       ASN 107 128.589 -10.394   9.528
  218   1HB   ASN 107          2HB       ASN 107 130.242  -7.979  10.294
  219   2HB   ASN 107          1HB       ASN 107 129.598  -9.183  11.406
  220   1HD2  ASN 107          1HD2      ASN 107 130.754 -10.950  11.813
  221   2HD2  ASN 107          2HD2      ASN 107 132.211 -11.395  10.996
  222    H    ALA 108           H        ALA 108 128.130  -7.306   8.096
  223    HA   ALA 108           HA       ALA 108 126.401  -5.831   8.133
  224   1HB   ALA 108          1HB       ALA 108 124.283  -6.815   9.427
  225   2HB   ALA 108          2HB       ALA 108 125.176  -8.314   9.174
  226   3HB   ALA 108          3HB       ALA 108 124.721  -7.315   7.794
  227    H    ASP 109           H        ASP 109 128.388  -5.555  10.076
  228    HA   ASP 109           HA       ASP 109 127.001  -4.881  12.556
  229   1HB   ASP 109          2HB       ASP 109 129.342  -4.360  13.363
  230   2HB   ASP 109          1HB       ASP 109 129.058  -6.038  12.908
  231    H    GLY 110           H        GLY 110 128.372  -3.387   9.742
  232   1HA   GLY 110          2HA       GLY 110 127.372  -1.124   9.340
  233   2HA   GLY 110          1HA       GLY 110 127.916  -0.733  10.963
  234    H    TYR 111           H        TYR 111 130.346  -2.570  10.055
  235    HA   TYR 111           HA       TYR 111 131.736  -0.470   8.536
  236   1HB   TYR 111          2HB       TYR 111 132.994  -2.038  10.791
  237   2HB   TYR 111          1HB       TYR 111 133.692  -0.681   9.912
  238    HD1  TYR 111           HD1      TYR 111 133.436   1.495  10.718
  239    HD2  TYR 111           HD2      TYR 111 130.880  -1.577  12.180
  240    HE1  TYR 111           HE1      TYR 111 132.536   3.049  12.398
  241    HE2  TYR 111           HE2      TYR 111 129.972  -0.031  13.863
  242    HH   TYR 111           HH       TYR 111 129.957   2.957  13.799
  243    H    ILE 112           H        ILE 112 133.644  -1.220   7.378
  244    HA   ILE 112           HA       ILE 112 133.610  -4.107   6.813
  245    HB   ILE 112           HB       ILE 112 133.977  -1.989   4.697
  246   1HG1  ILE 112          2HG1      ILE 112 131.534  -3.721   5.058
  247   2HG1  ILE 112          1HG1      ILE 112 131.653  -2.113   5.764
  248   1HG2  ILE 112          1HG2      ILE 112 133.460  -4.948   4.437
  249   2HG2  ILE 112          2HG2      ILE 112 135.049  -4.192   4.316
  250   3HG2  ILE 112          3HG2      ILE 112 133.797  -3.809   3.134
  251   1HD1  ILE 112          1HD1      ILE 112 132.016  -2.633   2.831
  252   2HD1  ILE 112          2HD1      ILE 112 131.753  -1.090   3.642
  253   3HD1  ILE 112          3HD1      ILE 112 130.452  -2.277   3.563
  254    H    ASP 113           H        ASP 113 135.582  -5.038   6.244
  255    HA   ASP 113           HA       ASP 113 137.950  -3.310   6.380
  256   1HB   ASP 113          2HB       ASP 113 139.083  -4.925   7.843
  257   2HB   ASP 113          1HB       ASP 113 137.634  -4.281   8.611
  258    H    LEU 114           H        LEU 114 139.953  -5.011   6.045
  259    HA   LEU 114           HA       LEU 114 139.862  -5.691   3.335
  260   1HB   LEU 114          2HB       LEU 114 141.723  -6.431   5.571
  261   2HB   LEU 114          1HB       LEU 114 141.948  -7.082   3.959
  262    HG   LEU 114           HG       LEU 114 141.827  -4.124   4.513
  263   1HD1  LEU 114          1HD1      LEU 114 144.424  -5.414   3.968
  264   2HD1  LEU 114          2HD1      LEU 114 143.746  -5.662   5.578
  265   3HD1  LEU 114          3HD1      LEU 114 144.032  -4.026   4.984
  266   1HD2  LEU 114          1HD2      LEU 114 142.379  -5.846   2.158
  267   2HD2  LEU 114          2HD2      LEU 114 143.292  -4.346   2.320
  268   3HD2  LEU 114          3HD2      LEU 114 141.530  -4.304   2.260
  269    H    GLU 115           H        GLU 115 139.158  -7.563   6.207
  270    HA   GLU 115           HA       GLU 115 139.138 -10.112   4.953
  271   1HB   GLU 115          2HB       GLU 115 139.244  -9.500   7.477
  272   2HB   GLU 115          1HB       GLU 115 137.490  -9.446   7.373
  273   1HG   GLU 115          2HG       GLU 115 137.306 -11.667   7.334
  274   2HG   GLU 115          1HG       GLU 115 138.647 -11.851   6.203
  275    H    GLU 116           H        GLU 116 136.457  -8.016   6.034
  276    HA   GLU 116           HA       GLU 116 134.426  -9.550   4.821
  277   1HB   GLU 116          2HB       GLU 116 134.587  -6.746   5.871
  278   2HB   GLU 116          1HB       GLU 116 133.154  -7.277   5.003
  279   1HG   GLU 116          2HG       GLU 116 132.414  -8.486   6.724
  280   2HG   GLU 116          1HG       GLU 116 134.013  -9.128   7.088
  281    H    LEU 117           H        LEU 117 136.573  -7.116   3.590
  282    HA   LEU 117           HA       LEU 117 135.020  -6.580   1.225
  283   1HB   LEU 117          2HB       LEU 117 136.428  -4.837   2.119
  284   2HB   LEU 117          1HB       LEU 117 137.844  -5.862   1.999
  285    HG   LEU 117           HG       LEU 117 137.521  -5.863  -0.500
  286   1HD1  LEU 117          1HD1      LEU 117 135.923  -4.645  -1.533
  287   2HD1  LEU 117          2HD1      LEU 117 135.908  -3.398  -0.285
  288   3HD1  LEU 117          3HD1      LEU 117 135.061  -4.921  -0.019
  289   1HD2  LEU 117          1HD2      LEU 117 137.862  -3.031   0.288
  290   2HD2  LEU 117          2HD2      LEU 117 138.889  -4.067  -0.703
  291   3HD2  LEU 117          3HD2      LEU 117 138.928  -4.209   1.054
  292    H    LYS 118           H        LYS 118 137.611  -8.726   2.152
  293    HA   LYS 118           HA       LYS 118 138.382  -9.447  -0.500
  294   1HB   LYS 118          2HB       LYS 118 139.869  -9.693   1.467
  295   2HB   LYS 118          1HB       LYS 118 138.812 -10.954   2.085
  296   1HG   LYS 118          2HG       LYS 118 139.276 -12.283   0.050
  297   2HG   LYS 118          1HG       LYS 118 140.425 -11.040  -0.454
  298   1HD   LYS 118          2HD       LYS 118 141.282 -11.530   2.067
  299   2HD   LYS 118          1HD       LYS 118 140.667 -13.120   1.617
  300   1HE   LYS 118          2HE       LYS 118 142.031 -12.948  -0.480
  301   2HE   LYS 118          1HE       LYS 118 142.759 -11.489   0.189
  302   1HZ   LYS 118          1HZ       LYS 118 144.151 -13.391   0.621
  303   2HZ   LYS 118          2HZ       LYS 118 142.877 -14.208   1.378
  304   3HZ   LYS 118          3HZ       LYS 118 143.523 -12.814   2.083
  305    H    ILE 119           H        ILE 119 136.343 -10.983   1.972
  306    HA   ILE 119           HA       ILE 119 135.724 -13.318   0.585
  307    HB   ILE 119           HB       ILE 119 133.662 -13.403   1.977
  308   1HG1  ILE 119          2HG1      ILE 119 133.848 -11.479   3.843
  309   2HG1  ILE 119          1HG1      ILE 119 134.459 -10.583   2.456
  310   1HG2  ILE 119          1HG2      ILE 119 135.753 -12.609   3.898
  311   2HG2  ILE 119          2HG2      ILE 119 136.212 -13.823   2.703
  312   3HG2  ILE 119          3HG2      ILE 119 134.836 -14.110   3.769
  313   1HD1  ILE 119          1HD1      ILE 119 132.216 -11.787   1.449
  314   2HD1  ILE 119          2HD1      ILE 119 132.326 -10.128   2.036
  315   3HD1  ILE 119          3HD1      ILE 119 131.750 -11.405   3.106
  316    H    MET 120           H        MET 120 134.129 -10.153   0.525
  317    HA   MET 120           HA       MET 120 131.989 -10.936  -1.154
  318   1HB   MET 120          2HB       MET 120 131.619  -8.534  -1.482
  319   2HB   MET 120          1HB       MET 120 131.878  -8.918   0.215
  320   1HG   MET 120          2HG       MET 120 133.907  -7.867   0.291
  321   2HG   MET 120          1HG       MET 120 134.206  -8.080  -1.433
  322   1HE   MET 120          1HE       MET 120 131.737  -5.920  -3.080
  323   2HE   MET 120          2HE       MET 120 132.999  -7.150  -3.160
  324   3HE   MET 120          3HE       MET 120 133.430  -5.441  -3.201
  325    H    LEU 121           H        LEU 121 135.264  -9.912  -1.773
  326    HA   LEU 121           HA       LEU 121 134.885  -9.358  -4.551
  327   1HB   LEU 121          2HB       LEU 121 137.104  -9.396  -2.645
  328   2HB   LEU 121          1HB       LEU 121 137.565  -9.928  -4.252
  329    HG   LEU 121           HG       LEU 121 137.951  -7.522  -3.912
  330   1HD1  LEU 121          1HD1      LEU 121 137.683  -8.043  -6.153
  331   2HD1  LEU 121          2HD1      LEU 121 136.491  -6.768  -5.906
  332   3HD1  LEU 121          3HD1      LEU 121 135.979  -8.455  -5.961
  333   1HD2  LEU 121          1HD2      LEU 121 135.671  -6.186  -4.035
  334   2HD2  LEU 121          2HD2      LEU 121 136.387  -6.658  -2.493
  335   3HD2  LEU 121          3HD2      LEU 121 135.072  -7.609  -3.183
  336    H    GLN 122           H        GLN 122 135.693 -12.186  -2.662
  337    HA   GLN 122           HA       GLN 122 136.725 -13.818  -4.689
  338   1HB   GLN 122          2HB       GLN 122 135.273 -14.422  -2.121
  339   2HB   GLN 122          1HB       GLN 122 135.811 -15.707  -3.197
  340   1HG   GLN 122          2HG       GLN 122 138.121 -14.628  -3.030
  341   2HG   GLN 122          1HG       GLN 122 137.462 -13.742  -1.655
  342   1HE2  GLN 122          1HE2      GLN 122 139.087 -16.462  -2.576
  343   2HE2  GLN 122          2HE2      GLN 122 138.813 -17.442  -1.178
  344    H    ALA 123           H        ALA 123 133.452 -12.929  -3.879
  345    HA   ALA 123           HA       ALA 123 132.040 -14.953  -5.182
  346   1HB   ALA 123          1HB       ALA 123 130.164 -13.436  -5.207
  347   2HB   ALA 123          2HB       ALA 123 131.233 -12.057  -4.947
  348   3HB   ALA 123          3HB       ALA 123 131.032 -13.269  -3.681
  349    H    THR 124           H        THR 124 133.709 -12.160  -6.443
  350    HA   THR 124           HA       THR 124 132.522 -11.973  -8.964
  351    HB   THR 124           HB       THR 124 134.531 -10.801  -9.660
  352    HG1  THR 124           HG1      THR 124 135.667 -11.964  -7.343
  353   1HG2  THR 124          1HG2      THR 124 134.610  -9.903  -6.885
  354   2HG2  THR 124          2HG2      THR 124 132.989  -9.985  -7.575
  355   3HG2  THR 124          3HG2      THR 124 134.234  -9.015  -8.362
  356    H    GLY 125           H        GLY 125 133.373 -12.644 -11.050
  357   1HA   GLY 125          2HA       GLY 125 134.051 -15.444 -11.030
  358   2HA   GLY 125          1HA       GLY 125 133.762 -14.449 -12.449
  359    H    GLU 126           H        GLU 126 135.692 -12.448 -11.949
  360    HA   GLU 126           HA       GLU 126 138.020 -13.793 -12.930
  361   1HB   GLU 126          2HB       GLU 126 139.014 -11.485 -12.914
  362   2HB   GLU 126          1HB       GLU 126 137.534 -11.646 -13.850
  363   1HG   GLU 126          2HG       GLU 126 136.257 -10.534 -12.223
  364   2HG   GLU 126          1HG       GLU 126 137.536 -10.668 -11.018
  365    H    THR 127           H        THR 127 140.025 -14.014 -11.965
  366    HA   THR 127           HA       THR 127 140.025 -14.403  -9.151
  367    HB   THR 127           HB       THR 127 142.363 -15.020  -9.422
  368    HG1  THR 127           HG1      THR 127 143.416 -14.698 -11.367
  369   1HG2  THR 127          1HG2      THR 127 140.997 -16.021 -11.893
  370   2HG2  THR 127          2HG2      THR 127 140.546 -16.569 -10.277
  371   3HG2  THR 127          3HG2      THR 127 142.183 -16.841 -10.876
  372    H    ILE 128           H        ILE 128 139.997 -12.761  -7.760
  373    HA   ILE 128           HA       ILE 128 141.224 -10.219  -8.417
  374    HB   ILE 128           HB       ILE 128 139.912 -11.000  -5.816
  375   1HG1  ILE 128          2HG1      ILE 128 138.386 -11.391  -7.721
  376   2HG1  ILE 128          1HG1      ILE 128 137.845 -10.061  -6.702
  377   1HG2  ILE 128          1HG2      ILE 128 139.686  -8.674  -5.423
  378   2HG2  ILE 128          2HG2      ILE 128 140.181  -8.278  -7.067
  379   3HG2  ILE 128          3HG2      ILE 128 141.354  -8.938  -5.928
  380   1HD1  ILE 128          1HD1      ILE 128 138.978  -8.523  -8.365
  381   2HD1  ILE 128          2HD1      ILE 128 137.516  -9.348  -8.906
  382   3HD1  ILE 128          3HD1      ILE 128 139.099  -9.931  -9.421
  383    H    THR 129           H        THR 129 142.949  -9.273  -7.358
  384    HA   THR 129           HA       THR 129 144.636 -11.134  -5.831
  385    HB   THR 129           HB       THR 129 145.603 -10.265  -7.929
  386    HG1  THR 129           HG1      THR 129 147.275 -10.596  -6.695
  387   1HG2  THR 129          1HG2      THR 129 145.931  -7.566  -6.742
  388   2HG2  THR 129          2HG2      THR 129 144.424  -7.951  -7.571
  389   3HG2  THR 129          3HG2      THR 129 145.958  -8.074  -8.430
  390    H    GLU 130           H        GLU 130 145.896 -10.271  -4.053
  391    HA   GLU 130           HA       GLU 130 144.351  -8.838  -2.208
  392   1HB   GLU 130          2HB       GLU 130 147.354  -9.074  -2.087
  393   2HB   GLU 130          1HB       GLU 130 146.221  -8.954  -0.747
  394   1HG   GLU 130          2HG       GLU 130 145.372 -11.216  -2.026
  395   2HG   GLU 130          1HG       GLU 130 147.119 -11.288  -2.246
  396    H    ASP 131           H        ASP 131 146.747  -7.796  -4.533
  397    HA   ASP 131           HA       ASP 131 147.247  -5.227  -3.500
  398   1HB   ASP 131          2HB       ASP 131 148.192  -6.700  -5.620
  399   2HB   ASP 131          1HB       ASP 131 147.285  -5.426  -6.429
  400    H    ASP 132           H        ASP 132 144.714  -6.485  -5.581
  401    HA   ASP 132           HA       ASP 132 143.637  -3.911  -6.240
  402   1HB   ASP 132          2HB       ASP 132 143.016  -6.721  -6.839
  403   2HB   ASP 132          1HB       ASP 132 141.598  -5.686  -6.713
  404    H    ILE 133           H        ILE 133 142.729  -6.512  -3.999
  405    HA   ILE 133           HA       ILE 133 140.405  -5.295  -2.989
  406    HB   ILE 133           HB       ILE 133 142.238  -7.177  -1.500
  407   1HG1  ILE 133          2HG1      ILE 133 139.815  -8.189  -2.874
  408   2HG1  ILE 133          1HG1      ILE 133 141.160  -7.732  -3.914
  409   1HG2  ILE 133          1HG2      ILE 133 139.269  -6.768  -1.205
  410   2HG2  ILE 133          2HG2      ILE 133 140.478  -5.992  -0.182
  411   3HG2  ILE 133          3HG2      ILE 133 140.326  -7.749  -0.190
  412   1HD1  ILE 133          1HD1      ILE 133 142.574  -9.336  -2.973
  413   2HD1  ILE 133          2HD1      ILE 133 141.022 -10.152  -3.161
  414   3HD1  ILE 133          3HD1      ILE 133 141.524  -9.567  -1.575
  415    H    GLU 134           H        GLU 134 143.786  -4.869  -2.232
  416    HA   GLU 134           HA       GLU 134 143.384  -3.498   0.239
  417   1HB   GLU 134          2HB       GLU 134 145.696  -3.933  -1.606
  418   2HB   GLU 134          1HB       GLU 134 145.817  -2.683  -0.374
  419   1HG   GLU 134          2HG       GLU 134 145.004  -4.628   1.201
  420   2HG   GLU 134          1HG       GLU 134 145.677  -5.636  -0.079
  421    H    GLU 135           H        GLU 135 143.597  -2.544  -3.123
  422    HA   GLU 135           HA       GLU 135 143.884   0.249  -2.633
  423   1HB   GLU 135          2HB       GLU 135 143.094  -1.365  -5.049
  424   2HB   GLU 135          1HB       GLU 135 143.092   0.394  -5.071
  425   1HG   GLU 135          2HG       GLU 135 145.448   0.452  -4.600
  426   2HG   GLU 135          1HG       GLU 135 145.487  -1.299  -4.401
  427    H    LEU 136           H        LEU 136 141.184  -1.935  -2.827
  428    HA   LEU 136           HA       LEU 136 139.108  -0.168  -3.395
  429   1HB   LEU 136          2HB       LEU 136 139.383  -2.829  -2.226
  430   2HB   LEU 136          1HB       LEU 136 138.009  -1.948  -1.588
  431    HG   LEU 136           HG       LEU 136 138.336  -1.982  -4.539
  432   1HD1  LEU 136          1HD1      LEU 136 138.807  -4.277  -4.088
  433   2HD1  LEU 136          2HD1      LEU 136 137.131  -4.165  -4.629
  434   3HD1  LEU 136          3HD1      LEU 136 137.493  -4.374  -2.916
  435   1HD2  LEU 136          1HD2      LEU 136 135.763  -2.510  -4.037
  436   2HD2  LEU 136          2HD2      LEU 136 136.423  -0.875  -4.053
  437   3HD2  LEU 136          3HD2      LEU 136 136.192  -1.717  -2.521
  438    H    MET 137           H        MET 137 140.734  -0.872  -0.350
  439    HA   MET 137           HA       MET 137 138.942   0.806   1.174
  440   1HB   MET 137          2HB       MET 137 141.555  -0.478   1.990
  441   2HB   MET 137          1HB       MET 137 140.388   0.267   3.073
  442   1HG   MET 137          2HG       MET 137 138.887  -1.586   1.694
  443   2HG   MET 137          1HG       MET 137 140.435  -2.397   1.926
  444   1HE   MET 137          1HE       MET 137 137.365  -0.934   4.826
  445   2HE   MET 137          2HE       MET 137 137.003  -2.474   4.046
  446   3HE   MET 137          3HE       MET 137 137.352  -1.049   3.065
  447    H    LYS 138           H        LYS 138 141.992   1.113  -0.456
  448    HA   LYS 138           HA       LYS 138 143.095   3.304   0.862
  449   1HB   LYS 138          2HB       LYS 138 143.996   1.817  -1.101
  450   2HB   LYS 138          1HB       LYS 138 143.288   3.064  -2.118
  451   1HG   LYS 138          2HG       LYS 138 144.694   4.739  -1.177
  452   2HG   LYS 138          1HG       LYS 138 145.268   3.634   0.073
  453   1HD   LYS 138          2HD       LYS 138 147.005   3.347  -1.336
  454   2HD   LYS 138          1HD       LYS 138 145.903   2.237  -2.154
  455   1HE   LYS 138          2HE       LYS 138 146.431   3.496  -3.955
  456   2HE   LYS 138          1HE       LYS 138 145.163   4.540  -3.313
  457   1HZ   LYS 138          1HZ       LYS 138 147.839   4.986  -2.268
  458   2HZ   LYS 138          2HZ       LYS 138 146.643   6.103  -2.694
  459   3HZ   LYS 138          3HZ       LYS 138 147.605   5.397  -3.892
  460    H    ASP 139           H        ASP 139 140.966   3.287  -1.999
  461    HA   ASP 139           HA       ASP 139 140.642   6.157  -1.844
  462   1HB   ASP 139          2HB       ASP 139 139.436   5.989  -3.895
  463   2HB   ASP 139          1HB       ASP 139 140.800   4.884  -4.015
  464    H    GLY 140           H        GLY 140 139.016   3.355  -0.684
  465   1HA   GLY 140          2HA       GLY 140 136.423   4.573  -0.427
  466   2HA   GLY 140          1HA       GLY 140 136.934   3.044   0.273
  467    H    ASP 141           H        ASP 141 139.287   4.360   1.545
  468    HA   ASP 141           HA       ASP 141 137.869   5.311   3.907
  469   1HB   ASP 141          2HB       ASP 141 139.652   3.546   4.058
  470   2HB   ASP 141          1HB       ASP 141 140.826   4.770   3.586
  471    H    LYS 142           H        LYS 142 137.528   7.410   4.151
  472    HA   LYS 142           HA       LYS 142 139.448   9.304   2.975
  473   1HB   LYS 142          2HB       LYS 142 136.547   9.720   3.718
  474   2HB   LYS 142          1HB       LYS 142 137.606  10.949   3.040
  475   1HG   LYS 142          2HG       LYS 142 136.887   8.373   1.661
  476   2HG   LYS 142          1HG       LYS 142 136.083   9.918   1.387
  477   1HD   LYS 142          2HD       LYS 142 138.957  10.172   1.176
  478   2HD   LYS 142          1HD       LYS 142 138.338   8.943   0.071
  479   1HE   LYS 142          2HE       LYS 142 136.523  10.882  -0.337
  480   2HE   LYS 142          1HE       LYS 142 137.920  11.868   0.092
  481   1HZ   LYS 142          1HZ       LYS 142 139.098  10.321  -1.625
  482   2HZ   LYS 142          2HZ       LYS 142 138.200  11.656  -2.150
  483   3HZ   LYS 142          3HZ       LYS 142 137.529  10.105  -2.220
  484    H    ASN 143           H        ASN 143 137.902   8.274   5.907
  485    HA   ASN 143           HA       ASN 143 138.766  10.579   7.427
  486   1HB   ASN 143          2HB       ASN 143 137.488   7.977   8.289
  487   2HB   ASN 143          1HB       ASN 143 137.834   9.324   9.367
  488   1HD2  ASN 143          1HD2      ASN 143 136.300  10.780   9.643
  489   2HD2  ASN 143          2HD2      ASN 143 134.918  10.998   8.629
  490    H    ASN 144           H        ASN 144 140.061   7.545   6.507
  491    HA   ASN 144           HA       ASN 144 142.070   6.561   6.901
  492   1HB   ASN 144          2HB       ASN 144 142.836   9.011   6.874
  493   2HB   ASN 144          1HB       ASN 144 142.832   8.910   8.633
  494   1HD2  ASN 144          1HD2      ASN 144 144.261   7.652   5.698
  495   2HD2  ASN 144          2HD2      ASN 144 145.702   7.043   6.431
  496    H    ASP 145           H        ASP 145 140.051   5.631   8.371
  497    HA   ASP 145           HA       ASP 145 141.016   5.471  11.140
  498   1HB   ASP 145          2HB       ASP 145 138.797   4.564  11.680
  499   2HB   ASP 145          1HB       ASP 145 138.670   6.128  10.879
  500    H    GLY 146           H        GLY 146 140.512   3.618   8.241
  501   1HA   GLY 146          2HA       GLY 146 142.038   1.662   8.068
  502   2HA   GLY 146          1HA       GLY 146 141.475   1.215   9.671
  503    H    ARG 147           H        ARG 147 138.695   2.044   8.956
  504    HA   ARG 147           HA       ARG 147 138.016  -0.126   7.090
  505   1HB   ARG 147          2HB       ARG 147 136.794   0.430   9.792
  506   2HB   ARG 147          1HB       ARG 147 136.014  -0.575   8.579
  507   1HG   ARG 147          2HG       ARG 147 138.137  -1.967   8.585
  508   2HG   ARG 147          1HG       ARG 147 138.581  -1.081  10.046
  509   1HD   ARG 147          2HD       ARG 147 136.208  -1.776  10.857
  510   2HD   ARG 147          1HD       ARG 147 136.332  -3.003   9.598
  511    HE   ARG 147           HE       ARG 147 138.646  -3.293  10.962
  512   1HH1  ARG 147          1HH1      ARG 147 135.302  -3.175  11.954
  513   2HH1  ARG 147          2HH1      ARG 147 135.541  -4.212  13.321
  514   1HH2  ARG 147          1HH2      ARG 147 138.961  -4.658  12.758
  515   2HH2  ARG 147          2HH2      ARG 147 137.618  -5.055  13.777
  516    H    ILE 148           H        ILE 148 135.551   0.035   6.562
  517    HA   ILE 148           HA       ILE 148 134.921   2.873   6.062
  518    HB   ILE 148           HB       ILE 148 134.179   0.543   4.290
  519   1HG1  ILE 148          2HG1      ILE 148 136.280   2.665   3.806
  520   2HG1  ILE 148          1HG1      ILE 148 136.639   1.034   4.360
  521   1HG2  ILE 148          1HG2      ILE 148 133.523   3.414   4.324
  522   2HG2  ILE 148          2HG2      ILE 148 132.625   2.049   3.660
  523   3HG2  ILE 148          3HG2      ILE 148 133.968   2.746   2.753
  524   1HD1  ILE 148          1HD1      ILE 148 136.963   1.381   1.930
  525   2HD1  ILE 148          2HD1      ILE 148 135.229   1.664   1.782
  526   3HD1  ILE 148          3HD1      ILE 148 135.824   0.094   2.322
  527    H    ASP 149           H        ASP 149 132.860   3.571   6.427
  528    HA   ASP 149           HA       ASP 149 130.868   1.591   7.282
  529   1HB   ASP 149          2HB       ASP 149 130.195   3.097   9.139
  530   2HB   ASP 149          1HB       ASP 149 131.831   2.474   9.328
  531    H    TYR 150           H        TYR 150 128.725   3.037   7.787
  532    HA   TYR 150           HA       TYR 150 127.738   3.796   5.301
  533   1HB   TYR 150          2HB       TYR 150 126.384   3.158   7.322
  534   2HB   TYR 150          1HB       TYR 150 126.694   4.767   7.965
  535    HD1  TYR 150           HD1      TYR 150 125.547   3.305   4.714
  536    HD2  TYR 150           HD2      TYR 150 124.956   6.252   7.725
  537    HE1  TYR 150           HE1      TYR 150 123.599   4.164   3.483
  538    HE2  TYR 150           HE2      TYR 150 123.007   7.119   6.502
  539    HH   TYR 150           HH       TYR 150 121.294   5.785   4.585
  540    H    ASP 151           H        ASP 151 129.002   5.808   7.930
  541    HA   ASP 151           HA       ASP 151 128.446   8.307   6.798
  542   1HB   ASP 151          2HB       ASP 151 130.484   7.347   8.786
  543   2HB   ASP 151          1HB       ASP 151 130.494   9.018   8.233
  544    H    GLU 152           H        GLU 152 131.376   6.304   6.591
  545    HA   GLU 152           HA       GLU 152 132.767   8.112   4.892
  546   1HB   GLU 152          2HB       GLU 152 133.257   5.154   5.271
  547   2HB   GLU 152          1HB       GLU 152 134.396   6.332   4.634
  548   1HG   GLU 152          2HG       GLU 152 134.598   7.400   6.747
  549   2HG   GLU 152          1HG       GLU 152 133.261   6.464   7.413
  550    H    PHE 153           H        PHE 153 130.865   5.181   4.319
  551    HA   PHE 153           HA       PHE 153 131.362   4.911   1.582
  552   1HB   PHE 153          2HB       PHE 153 130.008   3.431   3.349
  553   2HB   PHE 153          1HB       PHE 153 128.643   4.249   2.593
  554    HD1  PHE 153           HD1      PHE 153 127.702   3.324   0.708
  555    HD2  PHE 153           HD2      PHE 153 131.732   2.372   1.688
  556    HE1  PHE 153           HE1      PHE 153 127.770   1.716  -1.153
  557    HE2  PHE 153           HE2      PHE 153 131.808   0.763  -0.173
  558    HZ   PHE 153           HZ       PHE 153 129.824   0.433  -1.596
  559    H    LEU 154           H        LEU 154 128.963   6.836   3.315
  560    HA   LEU 154           HA       LEU 154 127.448   7.668   1.111
  561   1HB   LEU 154          2HB       LEU 154 127.816   8.512   3.898
  562   2HB   LEU 154          1HB       LEU 154 127.336   9.809   2.821
  563    HG   LEU 154           HG       LEU 154 125.337   8.604   2.177
  564   1HD1  LEU 154          1HD1      LEU 154 126.477   6.333   2.427
  565   2HD1  LEU 154          2HD1      LEU 154 124.780   6.448   2.896
  566   3HD1  LEU 154          3HD1      LEU 154 126.038   6.439   4.132
  567   1HD2  LEU 154          1HD2      LEU 154 124.772   9.867   3.990
  568   2HD2  LEU 154          2HD2      LEU 154 125.925   9.061   5.052
  569   3HD2  LEU 154          3HD2      LEU 154 124.410   8.263   4.626
  570    H    GLU 155           H        GLU 155 130.473   8.848   2.435
  571    HA   GLU 155           HA       GLU 155 130.531  11.199   0.772
  572   1HB   GLU 155          2HB       GLU 155 132.343   9.937   2.771
  573   2HB   GLU 155          1HB       GLU 155 133.062  11.033   1.597
  574   1HG   GLU 155          2HG       GLU 155 131.052  12.577   2.360
  575   2HG   GLU 155          1HG       GLU 155 131.178  11.590   3.816
  576    H    PHE 156           H        PHE 156 132.236   8.082   0.839
  577    HA   PHE 156           HA       PHE 156 133.851   8.502  -1.410
  578   1HB   PHE 156          2HB       PHE 156 134.213   6.662   0.178
  579   2HB   PHE 156          1HB       PHE 156 132.716   5.902  -0.353
  580    HD1  PHE 156           HD1      PHE 156 132.801   4.285  -1.987
  581    HD2  PHE 156           HD2      PHE 156 135.974   7.107  -1.702
  582    HE1  PHE 156           HE1      PHE 156 134.036   3.065  -3.731
  583    HE2  PHE 156           HE2      PHE 156 137.214   5.892  -3.447
  584    HZ   PHE 156           HZ       PHE 156 136.243   3.870  -4.463
  585    H    MET 157           H        MET 157 130.504   7.569  -1.109
  586    HA   MET 157           HA       MET 157 130.260   6.794  -3.883
  587   1HB   MET 157          2HB       MET 157 128.400   6.965  -1.547
  588   2HB   MET 157          1HB       MET 157 127.728   6.901  -3.170
  589   1HG   MET 157          2HG       MET 157 129.762   4.888  -2.347
  590   2HG   MET 157          1HG       MET 157 128.096   4.720  -1.798
  591   1HE   MET 157          1HE       MET 157 129.802   3.698  -5.847
  592   2HE   MET 157          2HE       MET 157 130.536   3.615  -4.246
  593   3HE   MET 157          3HE       MET 157 130.348   5.173  -5.052
  594    H    LYS 158           H        LYS 158 129.819   9.648  -1.954
  595    HA   LYS 158           HA       LYS 158 128.234  11.042  -3.911
  596   1HB   LYS 158          2HB       LYS 158 129.395  11.659  -1.248
  597   2HB   LYS 158          1HB       LYS 158 129.100  13.023  -2.317
  598   1HG   LYS 158          2HG       LYS 158 126.750  12.277  -2.545
  599   2HG   LYS 158          1HG       LYS 158 127.077  11.010  -1.360
  600   1HD   LYS 158          2HD       LYS 158 127.470  12.584   0.358
  601   2HD   LYS 158          1HD       LYS 158 127.569  13.922  -0.788
  602   1HE   LYS 158          2HE       LYS 158 125.038  12.503  -0.955
  603   2HE   LYS 158          1HE       LYS 158 125.338  13.149   0.656
  604   1HZ   LYS 158          1HZ       LYS 158 125.805  15.319  -0.421
  605   2HZ   LYS 158          2HZ       LYS 158 124.208  14.796  -0.610
  606   3HZ   LYS 158          3HZ       LYS 158 125.298  14.662  -1.896
  607    H    GLY 159           H        GLY 159 130.106  10.274  -5.481
  608   1HA   GLY 159          2HA       GLY 159 131.285  11.543  -7.140
  609   2HA   GLY 159          1HA       GLY 159 131.792  12.654  -5.878
  610    H    VAL 160           H        VAL 160 132.127   9.249  -6.861
  611    HA   VAL 160           HA       VAL 160 134.431   8.731  -5.324
  612    HB   VAL 160           HB       VAL 160 133.668   7.375  -7.914
  613   1HG1  VAL 160          1HG1      VAL 160 135.719   6.496  -7.445
  614   2HG1  VAL 160          2HG1      VAL 160 134.720   5.429  -6.458
  615   3HG1  VAL 160          3HG1      VAL 160 135.570   6.782  -5.711
  616   1HG2  VAL 160          1HG2      VAL 160 132.008   6.252  -6.903
  617   2HG2  VAL 160          2HG2      VAL 160 132.025   7.587  -5.752
  618   3HG2  VAL 160          3HG2      VAL 160 132.898   6.099  -5.388
  619    H    GLU 161           H        GLU 161 133.965  10.152  -8.481
  620    HA   GLU 161           HA       GLU 161 136.827  10.110  -9.041
  621   1HB   GLU 161          2HB       GLU 161 136.156  11.156 -11.205
  622   2HB   GLU 161          1HB       GLU 161 135.408   9.592 -10.912
  623   1HG   GLU 161          2HG       GLU 161 133.348  10.444 -10.925
  624   2HG   GLU 161          1HG       GLU 161 133.816  11.836  -9.951
  Start of MODEL   18
    1   1H    MET  81          1HT       MET  81  92.342  16.525  -2.357
    2   2H    MET  81          2HT       MET  81  93.303  16.504  -0.934
    3   3H    MET  81          3HT       MET  81  91.656  16.981  -0.853
    4    HA   MET  81           HA       MET  81  91.681  14.854  -0.042
    5   1HB   MET  81          2HB       MET  81  90.896  15.051  -2.939
    6   2HB   MET  81          1HB       MET  81  90.650  13.560  -2.040
    7   1HG   MET  81          2HG       MET  81  88.940  14.400  -0.844
    8   2HG   MET  81          1HG       MET  81  89.650  16.011  -0.753
    9   1HE   MET  81          1HE       MET  81  87.003  14.032  -1.702
   10   2HE   MET  81          2HE       MET  81  86.173  14.776  -3.069
   11   3HE   MET  81          3HE       MET  81  86.255  15.618  -1.521
   12    H    VAL  82           H        VAL  82  92.856  13.086   0.366
   13    HA   VAL  82           HA       VAL  82  94.443  11.462   0.215
   14    HB   VAL  82           HB       VAL  82  94.438  11.914  -2.768
   15   1HG1  VAL  82          1HG1      VAL  82  96.129  10.429  -2.463
   16   2HG1  VAL  82          2HG1      VAL  82  94.783   9.290  -2.471
   17   3HG1  VAL  82          3HG1      VAL  82  95.475   9.826  -0.940
   18   1HG2  VAL  82          1HG2      VAL  82  92.135  11.610  -1.857
   19   2HG2  VAL  82          2HG2      VAL  82  92.646  10.046  -1.225
   20   3HG2  VAL  82          3HG2      VAL  82  92.647  10.335  -2.964
   21    H    ARG  83           H        ARG  83  95.198  14.224   0.571
   22    HA   ARG  83           HA       ARG  83  97.917  14.140  -0.567
   23   1HB   ARG  83          2HB       ARG  83  96.074  16.070  -1.103
   24   2HB   ARG  83          1HB       ARG  83  96.889  16.768   0.289
   25   1HG   ARG  83          2HG       ARG  83  99.052  16.142  -1.048
   26   2HG   ARG  83          1HG       ARG  83  97.948  16.168  -2.425
   27   1HD   ARG  83          2HD       ARG  83  97.885  18.447  -0.513
   28   2HD   ARG  83          1HD       ARG  83  99.237  18.336  -1.638
   29    HE   ARG  83           HE       ARG  83  97.799  18.778  -3.394
   30   1HH1  ARG  83          1HH1      ARG  83  95.982  18.358  -0.439
   31   2HH1  ARG  83          2HH1      ARG  83  94.519  18.998  -1.105
   32   1HH2  ARG  83          1HH2      ARG  83  95.873  19.617  -4.265
   33   2HH2  ARG  83          2HH2      ARG  83  94.454  19.710  -3.274
   34    H    CYS  84           H        CYS  84  98.916  13.167   1.162
   35    HA   CYS  84           HA       CYS  84  98.741  14.565   3.748
   36   1HB   CYS  84          2HB       CYS  84  99.647  12.431   4.711
   37   2HB   CYS  84          1HB       CYS  84  98.050  12.279   3.987
   38    HG   CYS  84           HG       CYS  84  99.884  10.347   3.335
   39    H    MET  85           H        MET  85 100.962  13.104   1.418
   40    HA   MET  85           HA       MET  85 103.011  14.999   2.138
   41   1HB   MET  85          2HB       MET  85 103.079  12.796   3.651
   42   2HB   MET  85          1HB       MET  85 103.956  12.183   2.257
   43   1HG   MET  85          2HG       MET  85 105.800  13.197   2.924
   44   2HG   MET  85          1HG       MET  85 104.978  14.756   2.923
   45   1HE   MET  85          1HE       MET  85 106.070  15.531   6.366
   46   2HE   MET  85          2HE       MET  85 104.910  16.169   5.203
   47   3HE   MET  85          3HE       MET  85 106.496  15.629   4.658
   48    H    LYS  86           H        LYS  86 102.892  15.671   0.005
   49    HA   LYS  86           HA       LYS  86 104.350  14.010  -1.874
   50   1HB   LYS  86          2HB       LYS  86 101.466  14.721  -2.190
   51   2HB   LYS  86          1HB       LYS  86 102.487  14.680  -3.622
   52   1HG   LYS  86          2HG       LYS  86 103.098  12.361  -3.105
   53   2HG   LYS  86          1HG       LYS  86 102.034  12.408  -1.698
   54   1HD   LYS  86          2HD       LYS  86 100.378  13.264  -3.700
   55   2HD   LYS  86          1HD       LYS  86 101.393  12.086  -4.537
   56   1HE   LYS  86          2HE       LYS  86 100.402  11.250  -1.895
   57   2HE   LYS  86          1HE       LYS  86  99.163  11.463  -3.130
   58   1HZ   LYS  86          1HZ       LYS  86 100.184   9.871  -4.505
   59   2HZ   LYS  86          2HZ       LYS  86 100.181   9.185  -2.959
   60   3HZ   LYS  86          3HZ       LYS  86 101.604   9.849  -3.586
   61    H    ASP  87           H        ASP  87 104.816  16.509  -0.462
   62    HA   ASP  87           HA       ASP  87 104.674  18.542  -2.546
   63   1HB   ASP  87          2HB       ASP  87 105.148  18.531   0.380
   64   2HB   ASP  87          1HB       ASP  87 105.990  19.775  -0.539
   65    H    ASP  88           H        ASP  88 107.249  17.428  -0.338
   66    HA   ASP  88           HA       ASP  88 109.269  18.239  -2.248
   67   1HB   ASP  88          2HB       ASP  88 110.866  17.503  -0.488
   68   2HB   ASP  88          1HB       ASP  88 109.696  18.685   0.093
   69    H    SER  89           H        SER  89 109.440  16.913  -3.961
   70    HA   SER  89           HA       SER  89 109.306  14.027  -3.599
   71   1HB   SER  89          2HB       SER  89 109.225  13.881  -5.996
   72   2HB   SER  89          1HB       SER  89 108.149  15.192  -5.510
   73    HG   SER  89           HG       SER  89 110.060  16.583  -5.914
   74    H    LYS  90           H        LYS  90 111.158  13.278  -2.710
   75    HA   LYS  90           HA       LYS  90 113.720  14.176  -3.810
   76   1HB   LYS  90          2HB       LYS  90 114.722  13.024  -1.873
   77   2HB   LYS  90          1HB       LYS  90 113.544  14.235  -1.389
   78   1HG   LYS  90          2HG       LYS  90 112.081  11.881  -1.614
   79   2HG   LYS  90          1HG       LYS  90 113.599  11.401  -0.856
   80   1HD   LYS  90          2HD       LYS  90 112.063  13.789   0.113
   81   2HD   LYS  90          1HD       LYS  90 111.663  12.160   0.660
   82   1HE   LYS  90          2HE       LYS  90 114.291  12.089   1.073
   83   2HE   LYS  90          1HE       LYS  90 114.049  13.829   1.224
   84   1HZ   LYS  90          1HZ       LYS  90 112.172  12.151   2.675
   85   2HZ   LYS  90          2HZ       LYS  90 112.918  13.595   3.141
   86   3HZ   LYS  90          3HZ       LYS  90 113.766  12.135   3.246
   87    H    GLY  91           H        GLY  91 115.251  12.741  -4.640
   88   1HA   GLY  91          2HA       GLY  91 114.086  10.281  -5.721
   89   2HA   GLY  91          1HA       GLY  91 115.551  11.070  -6.286
   90    H    LYS  92           H        LYS  92 117.474  10.893  -4.953
   91    HA   LYS  92           HA       LYS  92 117.723   8.234  -3.859
   92   1HB   LYS  92          2HB       LYS  92 119.429   9.773  -5.259
   93   2HB   LYS  92          1HB       LYS  92 119.971  10.153  -3.630
   94   1HG   LYS  92          2HG       LYS  92 119.992   7.568  -3.330
   95   2HG   LYS  92          1HG       LYS  92 120.046   7.557  -5.094
   96   1HD   LYS  92          2HD       LYS  92 122.294   7.538  -4.510
   97   2HD   LYS  92          1HD       LYS  92 121.982   9.250  -4.807
   98   1HE   LYS  92          2HE       LYS  92 121.367   9.018  -2.158
   99   2HE   LYS  92          1HE       LYS  92 122.688   7.863  -2.325
  100   1HZ   LYS  92          1HZ       LYS  92 124.086   9.573  -3.209
  101   2HZ   LYS  92          2HZ       LYS  92 123.427  10.129  -1.756
  102   3HZ   LYS  92          3HZ       LYS  92 122.814  10.687  -3.230
  103    H    THR  93           H        THR  93 117.113   7.842  -1.839
  104    HA   THR  93           HA       THR  93 117.404   9.943   0.185
  105    HB   THR  93           HB       THR  93 116.064   8.018   1.493
  106    HG1  THR  93           HG1      THR  93 115.230   7.701  -1.194
  107   1HG2  THR  93          1HG2      THR  93 114.566   9.684  -0.492
  108   2HG2  THR  93          2HG2      THR  93 115.329  10.386   0.934
  109   3HG2  THR  93          3HG2      THR  93 114.069   9.166   1.117
  110    H    GLU  94           H        GLU  94 117.651   8.695   2.497
  111    HA   GLU  94           HA       GLU  94 120.360   7.895   2.566
  112   1HB   GLU  94          2HB       GLU  94 118.268   7.497   4.712
  113   2HB   GLU  94          1HB       GLU  94 120.012   7.522   4.937
  114   1HG   GLU  94          2HG       GLU  94 120.150   9.812   4.629
  115   2HG   GLU  94          1HG       GLU  94 118.603   9.892   3.787
  116    H    GLU  95           H        GLU  95 117.349   6.122   2.436
  117    HA   GLU  95           HA       GLU  95 118.325   3.590   3.189
  118   1HB   GLU  95          2HB       GLU  95 116.315   2.702   2.065
  119   2HB   GLU  95          1HB       GLU  95 115.942   4.059   3.119
  120   1HG   GLU  95          2HG       GLU  95 116.031   5.517   1.060
  121   2HG   GLU  95          1HG       GLU  95 116.071   4.026   0.120
  122    H    GLU  96           H        GLU  96 118.486   5.370   0.203
  123    HA   GLU  96           HA       GLU  96 118.987   3.273  -1.585
  124   1HB   GLU  96          2HB       GLU  96 119.844   6.164  -1.585
  125   2HB   GLU  96          1HB       GLU  96 120.213   5.070  -2.911
  126   1HG   GLU  96          2HG       GLU  96 117.484   5.879  -1.940
  127   2HG   GLU  96          1HG       GLU  96 118.261   6.354  -3.449
  128    H    LEU  97           H        LEU  97 121.292   5.345   0.174
  129    HA   LEU  97           HA       LEU  97 123.554   3.799  -0.671
  130   1HB   LEU  97          2HB       LEU  97 123.131   6.080   1.221
  131   2HB   LEU  97          1HB       LEU  97 124.652   5.206   1.238
  132    HG   LEU  97           HG       LEU  97 123.562   6.380  -1.304
  133   1HD1  LEU  97          1HD1      LEU  97 125.614   7.868   0.221
  134   2HD1  LEU  97          2HD1      LEU  97 123.948   7.986   0.789
  135   3HD1  LEU  97          3HD1      LEU  97 124.353   8.457  -0.862
  136   1HD2  LEU  97          1HD2      LEU  97 126.414   5.931  -0.476
  137   2HD2  LEU  97          2HD2      LEU  97 125.765   6.182  -2.096
  138   3HD2  LEU  97          3HD2      LEU  97 125.446   4.673  -1.242
  139    H    SER  98           H        SER  98 121.507   3.930   2.178
  140    HA   SER  98           HA       SER  98 123.091   2.399   3.913
  141   1HB   SER  98          2HB       SER  98 120.867   3.741   4.322
  142   2HB   SER  98          1HB       SER  98 120.103   2.189   3.979
  143    HG   SER  98           HG       SER  98 120.482   2.308   6.172
  144    H    ASP  99           H        ASP  99 120.916   1.493   1.328
  145    HA   ASP  99           HA       ASP  99 120.903  -1.303   2.015
  146   1HB   ASP  99          2HB       ASP  99 119.082   0.022   0.742
  147   2HB   ASP  99          1HB       ASP  99 120.116  -0.189  -0.667
  148    H    LEU 100           H        LEU 100 122.671   0.800  -0.164
  149    HA   LEU 100           HA       LEU 100 123.916  -1.262  -1.673
  150   1HB   LEU 100          2HB       LEU 100 124.365   1.664  -1.291
  151   2HB   LEU 100          1HB       LEU 100 125.625   0.711  -2.052
  152    HG   LEU 100           HG       LEU 100 122.900   0.364  -3.150
  153   1HD1  LEU 100          1HD1      LEU 100 124.278   2.974  -3.038
  154   2HD1  LEU 100          2HD1      LEU 100 122.563   2.597  -3.197
  155   3HD1  LEU 100          3HD1      LEU 100 123.622   2.493  -4.602
  156   1HD2  LEU 100          1HD2      LEU 100 125.239   1.006  -4.826
  157   2HD2  LEU 100          2HD2      LEU 100 124.016  -0.252  -5.012
  158   3HD2  LEU 100          3HD2      LEU 100 125.349  -0.479  -3.879
  159    H    PHE 101           H        PHE 101 124.684   0.373   1.325
  160    HA   PHE 101           HA       PHE 101 127.373  -0.552   1.502
  161   1HB   PHE 101          2HB       PHE 101 126.641   1.422   2.736
  162   2HB   PHE 101          1HB       PHE 101 125.492   0.451   3.650
  163    HD1  PHE 101           HD1      PHE 101 126.151  -0.718   5.577
  164    HD2  PHE 101           HD2      PHE 101 129.092   1.021   3.042
  165    HE1  PHE 101           HE1      PHE 101 127.872  -1.155   7.281
  166    HE2  PHE 101           HE2      PHE 101 130.819   0.586   4.740
  167    HZ   PHE 101           HZ       PHE 101 130.210  -0.503   6.864
  168    H    ARG 102           H        ARG 102 124.268  -1.869   2.374
  169    HA   ARG 102           HA       ARG 102 125.067  -3.794   4.242
  170   1HB   ARG 102          2HB       ARG 102 122.702  -3.110   3.644
  171   2HB   ARG 102          1HB       ARG 102 122.846  -4.145   2.230
  172   1HG   ARG 102          2HG       ARG 102 122.980  -6.090   3.532
  173   2HG   ARG 102          1HG       ARG 102 123.317  -5.180   5.005
  174   1HD   ARG 102          2HD       ARG 102 120.968  -4.119   4.501
  175   2HD   ARG 102          1HD       ARG 102 120.735  -5.602   3.575
  176    HE   ARG 102           HE       ARG 102 121.698  -6.309   6.095
  177   1HH1  ARG 102          1HH1      ARG 102 118.852  -4.863   4.683
  178   2HH1  ARG 102          2HH1      ARG 102 117.791  -5.441   5.924
  179   1HH2  ARG 102          1HH2      ARG 102 120.304  -7.071   7.726
  180   2HH2  ARG 102          2HH2      ARG 102 118.613  -6.695   7.651
  181    H    MET 103           H        MET 103 124.610  -4.120   0.723
  182    HA   MET 103           HA       MET 103 125.394  -6.786   0.499
  183   1HB   MET 103          2HB       MET 103 125.979  -6.171  -1.882
  184   2HB   MET 103          1HB       MET 103 124.345  -5.778  -1.373
  185   1HG   MET 103          2HG       MET 103 124.943  -3.460  -1.093
  186   2HG   MET 103          1HG       MET 103 126.629  -3.822  -1.464
  187   1HE   MET 103          1HE       MET 103 123.003  -3.866  -4.140
  188   2HE   MET 103          2HE       MET 103 123.203  -4.653  -2.573
  189   3HE   MET 103          3HE       MET 103 123.683  -5.490  -4.049
  190    H    PHE 104           H        PHE 104 127.333  -3.831   0.356
  191    HA   PHE 104           HA       PHE 104 129.788  -4.983  -0.313
  192   1HB   PHE 104          2HB       PHE 104 128.878  -2.441   0.866
  193   2HB   PHE 104          1HB       PHE 104 130.525  -2.894   1.288
  194    HD1  PHE 104           HD1      PHE 104 132.046  -3.603  -0.705
  195    HD2  PHE 104           HD2      PHE 104 128.478  -1.319  -1.105
  196    HE1  PHE 104           HE1      PHE 104 132.834  -2.759  -2.878
  197    HE2  PHE 104           HE2      PHE 104 129.259  -0.472  -3.278
  198    HZ   PHE 104           HZ       PHE 104 131.439  -1.193  -4.168
  199    H    ASP 105           H        ASP 105 128.105  -4.787   2.743
  200    HA   ASP 105           HA       ASP 105 130.369  -5.632   4.308
  201   1HB   ASP 105          2HB       ASP 105 127.874  -4.464   4.852
  202   2HB   ASP 105          1HB       ASP 105 127.825  -6.048   5.621
  203    H    LYS 106           H        LYS 106 129.925  -7.582   5.855
  204    HA   LYS 106           HA       LYS 106 129.058  -9.843   4.176
  205   1HB   LYS 106          2HB       LYS 106 131.547  -9.572   4.867
  206   2HB   LYS 106          1HB       LYS 106 131.001 -10.113   6.448
  207   1HG   LYS 106          2HG       LYS 106 131.837 -11.997   5.245
  208   2HG   LYS 106          1HG       LYS 106 130.084 -12.154   5.378
  209   1HD   LYS 106          2HD       LYS 106 130.384 -10.779   3.021
  210   2HD   LYS 106          1HD       LYS 106 131.772 -11.870   3.009
  211   1HE   LYS 106          2HE       LYS 106 130.172 -13.737   3.542
  212   2HE   LYS 106          1HE       LYS 106 128.859 -12.595   3.255
  213   1HZ   LYS 106          1HZ       LYS 106 130.869 -12.787   1.164
  214   2HZ   LYS 106          2HZ       LYS 106 129.190 -12.636   1.040
  215   3HZ   LYS 106          3HZ       LYS 106 129.882 -14.146   1.363
  216    H    ASN 107           H        ASN 107 129.318  -8.729   7.544
  217    HA   ASN 107           HA       ASN 107 127.067 -10.505   8.214
  218   1HB   ASN 107          2HB       ASN 107 127.906 -10.266  10.592
  219   2HB   ASN 107          1HB       ASN 107 128.959 -11.162   9.501
  220   1HD2  ASN 107          1HD2      ASN 107 129.161  -9.242  11.973
  221   2HD2  ASN 107          2HD2      ASN 107 130.537  -8.277  11.569
  222    H    ALA 108           H        ALA 108 127.407  -7.498   7.297
  223    HA   ALA 108           HA       ALA 108 126.357  -5.512   7.669
  224   1HB   ALA 108          1HB       ALA 108 124.249  -7.012   9.180
  225   2HB   ALA 108          2HB       ALA 108 124.445  -7.221   7.440
  226   3HB   ALA 108          3HB       ALA 108 124.074  -5.629   8.099
  227    H    ASP 109           H        ASP 109 128.341  -5.515   9.311
  228    HA   ASP 109           HA       ASP 109 127.394  -5.177  12.056
  229   1HB   ASP 109          2HB       ASP 109 129.800  -5.010  12.625
  230   2HB   ASP 109          1HB       ASP 109 129.409  -6.506  11.783
  231    H    GLY 110           H        GLY 110 128.547  -3.353   9.322
  232   1HA   GLY 110          2HA       GLY 110 127.691  -1.009   9.325
  233   2HA   GLY 110          1HA       GLY 110 128.358  -0.891  10.946
  234    H    TYR 111           H        TYR 111 130.654  -2.652   9.766
  235    HA   TYR 111           HA       TYR 111 132.030  -0.524   8.285
  236   1HB   TYR 111          2HB       TYR 111 133.390  -2.111  10.460
  237   2HB   TYR 111          1HB       TYR 111 133.987  -0.680   9.628
  238    HD1  TYR 111           HD1      TYR 111 131.432  -1.870  12.037
  239    HD2  TYR 111           HD2      TYR 111 133.516   1.481  10.449
  240    HE1  TYR 111           HE1      TYR 111 130.507  -0.457  13.822
  241    HE2  TYR 111           HE2      TYR 111 132.596   2.905  12.230
  242    HH   TYR 111           HH       TYR 111 130.188   2.545  13.816
  243    H    ILE 112           H        ILE 112 133.810  -1.244   6.988
  244    HA   ILE 112           HA       ILE 112 133.848  -4.144   6.479
  245    HB   ILE 112           HB       ILE 112 133.953  -2.037   4.318
  246   1HG1  ILE 112          2HG1      ILE 112 131.669  -3.932   4.560
  247   2HG1  ILE 112          1HG1      ILE 112 131.711  -2.567   5.671
  248   1HG2  ILE 112          1HG2      ILE 112 135.158  -4.114   3.820
  249   2HG2  ILE 112          2HG2      ILE 112 133.741  -3.914   2.790
  250   3HG2  ILE 112          3HG2      ILE 112 133.692  -5.037   4.149
  251   1HD1  ILE 112          1HD1      ILE 112 131.854  -2.335   2.676
  252   2HD1  ILE 112          2HD1      ILE 112 131.723  -1.016   3.841
  253   3HD1  ILE 112          3HD1      ILE 112 130.386  -2.147   3.636
  254    H    ASP 113           H        ASP 113 135.815  -5.032   5.975
  255    HA   ASP 113           HA       ASP 113 138.118  -3.224   5.760
  256   1HB   ASP 113          2HB       ASP 113 139.402  -4.658   7.302
  257   2HB   ASP 113          1HB       ASP 113 138.009  -3.931   8.095
  258    H    LEU 114           H        LEU 114 140.163  -4.874   5.471
  259    HA   LEU 114           HA       LEU 114 139.930  -5.861   2.868
  260   1HB   LEU 114          2HB       LEU 114 141.954  -5.960   5.012
  261   2HB   LEU 114          1HB       LEU 114 142.074  -7.232   3.812
  262    HG   LEU 114           HG       LEU 114 141.848  -5.107   2.176
  263   1HD1  LEU 114          1HD1      LEU 114 141.783  -3.626   4.237
  264   2HD1  LEU 114          2HD1      LEU 114 142.955  -3.200   2.989
  265   3HD1  LEU 114          3HD1      LEU 114 143.486  -4.031   4.451
  266   1HD2  LEU 114          1HD2      LEU 114 143.950  -5.643   1.571
  267   2HD2  LEU 114          2HD2      LEU 114 143.732  -6.961   2.724
  268   3HD2  LEU 114          3HD2      LEU 114 144.575  -5.491   3.212
  269    H    GLU 115           H        GLU 115 139.417  -7.403   5.959
  270    HA   GLU 115           HA       GLU 115 139.438 -10.084   5.007
  271   1HB   GLU 115          2HB       GLU 115 138.601  -8.710   7.514
  272   2HB   GLU 115          1HB       GLU 115 137.981 -10.329   7.219
  273   1HG   GLU 115          2HG       GLU 115 140.469 -10.917   6.772
  274   2HG   GLU 115          1HG       GLU 115 140.788  -9.433   7.669
  275    H    GLU 116           H        GLU 116 136.763  -7.913   5.930
  276    HA   GLU 116           HA       GLU 116 134.751  -9.678   4.955
  277   1HB   GLU 116          2HB       GLU 116 134.767  -6.817   5.868
  278   2HB   GLU 116          1HB       GLU 116 133.323  -7.526   5.158
  279   1HG   GLU 116          2HG       GLU 116 132.908  -8.835   6.955
  280   2HG   GLU 116          1HG       GLU 116 134.617  -9.044   7.337
  281    H    LEU 117           H        LEU 117 136.697  -7.198   3.519
  282    HA   LEU 117           HA       LEU 117 134.984  -6.774   1.251
  283   1HB   LEU 117          2HB       LEU 117 136.603  -5.088   2.183
  284   2HB   LEU 117          1HB       LEU 117 137.901  -6.067   1.528
  285    HG   LEU 117           HG       LEU 117 137.058  -5.707  -0.739
  286   1HD1  LEU 117          1HD1      LEU 117 135.278  -3.902  -0.994
  287   2HD1  LEU 117          2HD1      LEU 117 134.887  -4.212   0.698
  288   3HD1  LEU 117          3HD1      LEU 117 134.736  -5.504  -0.492
  289   1HD2  LEU 117          1HD2      LEU 117 137.194  -3.015   0.574
  290   2HD2  LEU 117          2HD2      LEU 117 137.835  -3.524  -0.988
  291   3HD2  LEU 117          3HD2      LEU 117 138.604  -4.073   0.501
  292    H    LYS 118           H        LYS 118 137.780  -8.770   1.994
  293    HA   LYS 118           HA       LYS 118 138.331  -9.578  -0.664
  294   1HB   LYS 118          2HB       LYS 118 139.712 -11.307   0.325
  295   2HB   LYS 118          1HB       LYS 118 139.954  -9.791   1.182
  296   1HG   LYS 118          2HG       LYS 118 139.085 -10.579   3.108
  297   2HG   LYS 118          1HG       LYS 118 137.901 -11.597   2.287
  298   1HD   LYS 118          2HD       LYS 118 139.341 -13.361   2.100
  299   2HD   LYS 118          1HD       LYS 118 140.768 -12.324   2.025
  300   1HE   LYS 118          2HE       LYS 118 140.977 -12.218   4.288
  301   2HE   LYS 118          1HE       LYS 118 139.240 -12.339   4.563
  302   1HZ   LYS 118          1HZ       LYS 118 139.988 -14.364   5.304
  303   2HZ   LYS 118          2HZ       LYS 118 141.204 -14.485   4.134
  304   3HZ   LYS 118          3HZ       LYS 118 139.588 -14.743   3.703
  305    H    ILE 119           H        ILE 119 136.040 -10.655   1.727
  306    HA   ILE 119           HA       ILE 119 135.468 -13.171   0.489
  307    HB   ILE 119           HB       ILE 119 133.715 -11.615   2.392
  308   1HG1  ILE 119          2HG1      ILE 119 135.582 -13.821   3.209
  309   2HG1  ILE 119          1HG1      ILE 119 136.166 -12.164   3.093
  310   1HG2  ILE 119          1HG2      ILE 119 132.633 -13.668   2.856
  311   2HG2  ILE 119          2HG2      ILE 119 133.846 -14.590   1.971
  312   3HG2  ILE 119          3HG2      ILE 119 132.725 -13.545   1.100
  313   1HD1  ILE 119          1HD1      ILE 119 135.589 -12.425   5.329
  314   2HD1  ILE 119          2HD1      ILE 119 134.109 -13.303   4.944
  315   3HD1  ILE 119          3HD1      ILE 119 134.214 -11.571   4.632
  316    H    MET 120           H        MET 120 134.261  -9.907   0.179
  317    HA   MET 120           HA       MET 120 131.850 -10.479  -1.163
  318   1HB   MET 120          2HB       MET 120 132.857  -8.236  -0.161
  319   2HB   MET 120          1HB       MET 120 133.380  -8.005  -1.824
  320   1HG   MET 120          2HG       MET 120 130.870  -8.594  -2.341
  321   2HG   MET 120          1HG       MET 120 130.640  -8.045  -0.683
  322   1HE   MET 120          1HE       MET 120 132.233  -5.595  -4.203
  323   2HE   MET 120          2HE       MET 120 132.341  -7.340  -3.968
  324   3HE   MET 120          3HE       MET 120 133.459  -6.266  -3.126
  325    H    LEU 121           H        LEU 121 135.008  -9.465  -2.475
  326    HA   LEU 121           HA       LEU 121 134.289  -9.792  -5.180
  327   1HB   LEU 121          2HB       LEU 121 136.814  -9.428  -3.670
  328   2HB   LEU 121          1HB       LEU 121 136.953 -10.088  -5.289
  329    HG   LEU 121           HG       LEU 121 135.677  -8.105  -6.134
  330   1HD1  LEU 121          1HD1      LEU 121 136.271  -6.757  -3.539
  331   2HD1  LEU 121          2HD1      LEU 121 134.776  -7.673  -3.731
  332   3HD1  LEU 121          3HD1      LEU 121 135.122  -6.313  -4.799
  333   1HD2  LEU 121          1HD2      LEU 121 137.679  -6.491  -5.407
  334   2HD2  LEU 121          2HD2      LEU 121 137.872  -7.784  -6.590
  335   3HD2  LEU 121          3HD2      LEU 121 138.372  -8.038  -4.918
  336    H    GLN 122           H        GLN 122 135.399 -12.029  -2.760
  337    HA   GLN 122           HA       GLN 122 136.403 -14.082  -4.350
  338   1HB   GLN 122          2HB       GLN 122 135.300 -13.849  -1.626
  339   2HB   GLN 122          1HB       GLN 122 135.210 -15.459  -2.328
  340   1HG   GLN 122          2HG       GLN 122 137.685 -15.172  -2.869
  341   2HG   GLN 122          1HG       GLN 122 137.639 -13.801  -1.764
  342   1HE2  GLN 122          1HE2      GLN 122 138.424 -16.935  -1.959
  343   2HE2  GLN 122          2HE2      GLN 122 138.184 -17.422  -0.318
  344    H    ALA 123           H        ALA 123 133.112 -13.117  -3.711
  345    HA   ALA 123           HA       ALA 123 131.825 -15.476  -4.583
  346   1HB   ALA 123          1HB       ALA 123 130.426 -12.921  -5.029
  347   2HB   ALA 123          2HB       ALA 123 130.977 -13.220  -3.380
  348   3HB   ALA 123          3HB       ALA 123 129.902 -14.372  -4.172
  349    H    THR 124           H        THR 124 132.753 -12.496  -6.264
  350    HA   THR 124           HA       THR 124 131.572 -13.072  -8.738
  351    HB   THR 124           HB       THR 124 132.938 -11.342  -9.643
  352    HG1  THR 124           HG1      THR 124 134.657 -11.895  -7.468
  353   1HG2  THR 124          1HG2      THR 124 131.748 -10.960  -7.056
  354   2HG2  THR 124          2HG2      THR 124 131.809  -9.871  -8.442
  355   3HG2  THR 124          3HG2      THR 124 133.135  -9.895  -7.278
  356    H    GLY 125           H        GLY 125 132.949 -13.381 -10.789
  357   1HA   GLY 125          2HA       GLY 125 134.526 -15.817 -10.374
  358   2HA   GLY 125          1HA       GLY 125 133.806 -15.301 -11.891
  359    H    GLU 126           H        GLU 126 135.616 -13.092  -9.893
  360    HA   GLU 126           HA       GLU 126 137.696 -13.018 -11.971
  361   1HB   GLU 126          2HB       GLU 126 136.779 -10.920 -10.000
  362   2HB   GLU 126          1HB       GLU 126 138.193 -10.736 -11.029
  363   1HG   GLU 126          2HG       GLU 126 136.667 -11.091 -12.998
  364   2HG   GLU 126          1HG       GLU 126 135.318 -10.964 -11.871
  365    H    THR 127           H        THR 127 139.838 -13.189 -11.453
  366    HA   THR 127           HA       THR 127 140.419 -14.237  -8.790
  367    HB   THR 127           HB       THR 127 142.595 -14.906  -9.804
  368    HG1  THR 127           HG1      THR 127 142.820 -14.673 -12.047
  369   1HG2  THR 127          1HG2      THR 127 141.824 -16.751 -10.932
  370   2HG2  THR 127          2HG2      THR 127 140.490 -15.870 -11.678
  371   3HG2  THR 127          3HG2      THR 127 140.417 -16.299  -9.969
  372    H    ILE 128           H        ILE 128 140.380 -12.274  -7.625
  373    HA   ILE 128           HA       ILE 128 142.441 -10.303  -8.308
  374    HB   ILE 128           HB       ILE 128 140.334 -10.069  -6.163
  375   1HG1  ILE 128          2HG1      ILE 128 139.489  -8.394  -8.116
  376   2HG1  ILE 128          1HG1      ILE 128 140.189  -9.680  -9.095
  377   1HG2  ILE 128          1HG2      ILE 128 141.896  -8.462  -5.666
  378   2HG2  ILE 128          2HG2      ILE 128 140.843  -7.570  -6.762
  379   3HG2  ILE 128          3HG2      ILE 128 142.364  -8.240  -7.351
  380   1HD1  ILE 128          1HD1      ILE 128 138.418 -10.961  -8.764
  381   2HD1  ILE 128          2HD1      ILE 128 137.651  -9.601  -7.943
  382   3HD1  ILE 128          3HD1      ILE 128 138.559 -10.793  -7.014
  383    H    THR 129           H        THR 129 143.910  -9.540  -6.704
  384    HA   THR 129           HA       THR 129 144.532 -11.577  -4.676
  385    HB   THR 129           HB       THR 129 146.828 -10.535  -4.712
  386    HG1  THR 129           HG1      THR 129 145.873  -9.268  -7.059
  387   1HG2  THR 129          1HG2      THR 129 145.641 -12.202  -6.724
  388   2HG2  THR 129          2HG2      THR 129 147.264 -12.248  -6.035
  389   3HG2  THR 129          3HG2      THR 129 146.921 -11.202  -7.414
  390    H    GLU 130           H        GLU 130 145.669 -10.684  -2.702
  391    HA   GLU 130           HA       GLU 130 143.961  -8.941  -1.334
  392   1HB   GLU 130          2HB       GLU 130 145.775  -8.891   0.398
  393   2HB   GLU 130          1HB       GLU 130 145.271 -10.503  -0.087
  394   1HG   GLU 130          2HG       GLU 130 147.444 -10.920  -0.304
  395   2HG   GLU 130          1HG       GLU 130 147.326 -10.012  -1.812
  396    H    ASP 131           H        ASP 131 146.847  -8.347  -3.206
  397    HA   ASP 131           HA       ASP 131 147.492  -5.785  -2.279
  398   1HB   ASP 131          2HB       ASP 131 148.763  -7.360  -3.917
  399   2HB   ASP 131          1HB       ASP 131 147.816  -6.553  -5.163
  400    H    ASP 132           H        ASP 132 145.132  -6.875  -4.641
  401    HA   ASP 132           HA       ASP 132 144.478  -4.242  -5.564
  402   1HB   ASP 132          2HB       ASP 132 143.503  -6.997  -6.056
  403   2HB   ASP 132          1HB       ASP 132 142.341  -5.702  -6.323
  404    H    ILE 133           H        ILE 133 143.358  -6.363  -3.035
  405    HA   ILE 133           HA       ILE 133 140.877  -5.109  -2.522
  406    HB   ILE 133           HB       ILE 133 142.601  -6.560  -0.515
  407   1HG1  ILE 133          2HG1      ILE 133 142.348  -7.977  -2.463
  408   2HG1  ILE 133          1HG1      ILE 133 141.307  -8.581  -1.177
  409   1HG2  ILE 133          1HG2      ILE 133 139.662  -6.754  -0.463
  410   2HG2  ILE 133          2HG2      ILE 133 140.340  -5.181  -0.044
  411   3HG2  ILE 133          3HG2      ILE 133 140.816  -6.616   0.863
  412   1HD1  ILE 133          1HD1      ILE 133 139.751  -6.784  -2.662
  413   2HD1  ILE 133          2HD1      ILE 133 139.621  -8.542  -2.600
  414   3HD1  ILE 133          3HD1      ILE 133 140.625  -7.774  -3.829
  415    H    GLU 134           H        GLU 134 144.158  -4.417  -1.527
  416    HA   GLU 134           HA       GLU 134 143.525  -2.640   0.591
  417   1HB   GLU 134          2HB       GLU 134 145.995  -2.905  -1.128
  418   2HB   GLU 134          1HB       GLU 134 145.884  -1.836   0.264
  419   1HG   GLU 134          2HG       GLU 134 145.686  -3.638   1.764
  420   2HG   GLU 134          1HG       GLU 134 145.377  -4.786   0.462
  421    H    GLU 135           H        GLU 135 143.792  -2.271  -2.870
  422    HA   GLU 135           HA       GLU 135 144.054   0.513  -3.021
  423   1HB   GLU 135          2HB       GLU 135 142.884  -1.536  -4.885
  424   2HB   GLU 135          1HB       GLU 135 142.881   0.174  -5.290
  425   1HG   GLU 135          2HG       GLU 135 145.476  -0.872  -4.420
  426   2HG   GLU 135          1HG       GLU 135 144.858  -1.567  -5.918
  427    H    LEU 136           H        LEU 136 141.177  -1.541  -2.844
  428    HA   LEU 136           HA       LEU 136 139.249   0.453  -3.208
  429   1HB   LEU 136          2HB       LEU 136 139.320  -2.295  -2.209
  430   2HB   LEU 136          1HB       LEU 136 138.059  -1.325  -1.471
  431    HG   LEU 136           HG       LEU 136 137.639  -0.705  -4.059
  432   1HD1  LEU 136          1HD1      LEU 136 138.086  -2.413  -5.539
  433   2HD1  LEU 136          2HD1      LEU 136 138.289  -3.611  -4.262
  434   3HD1  LEU 136          3HD1      LEU 136 139.544  -2.405  -4.548
  435   1HD2  LEU 136          1HD2      LEU 136 135.897  -1.439  -2.614
  436   2HD2  LEU 136          2HD2      LEU 136 136.595  -3.054  -2.489
  437   3HD2  LEU 136          3HD2      LEU 136 135.897  -2.509  -4.015
  438    H    MET 137           H        MET 137 140.854  -0.703  -0.274
  439    HA   MET 137           HA       MET 137 139.342   0.872   1.533
  440   1HB   MET 137          2HB       MET 137 141.090  -1.164   1.833
  441   2HB   MET 137          1HB       MET 137 142.129   0.188   2.259
  442   1HG   MET 137          2HG       MET 137 141.300   0.017   4.305
  443   2HG   MET 137          1HG       MET 137 139.812   0.701   3.657
  444   1HE   MET 137          1HE       MET 137 137.900  -0.172   3.292
  445   2HE   MET 137          2HE       MET 137 137.264  -1.519   4.237
  446   3HE   MET 137          3HE       MET 137 137.739  -1.767   2.556
  447    H    LYS 138           H        LYS 138 142.169   1.489  -0.415
  448    HA   LYS 138           HA       LYS 138 143.184   3.735   0.908
  449   1HB   LYS 138          2HB       LYS 138 144.203   2.409  -1.034
  450   2HB   LYS 138          1HB       LYS 138 143.205   3.402  -2.086
  451   1HG   LYS 138          2HG       LYS 138 144.481   5.242  -1.788
  452   2HG   LYS 138          1HG       LYS 138 144.861   4.841  -0.112
  453   1HD   LYS 138          2HD       LYS 138 146.360   3.032  -0.972
  454   2HD   LYS 138          1HD       LYS 138 146.080   3.652  -2.601
  455   1HE   LYS 138          2HE       LYS 138 147.072   5.759  -2.035
  456   2HE   LYS 138          1HE       LYS 138 147.178   5.306  -0.335
  457   1HZ   LYS 138          1HZ       LYS 138 148.609   3.372  -1.269
  458   2HZ   LYS 138          2HZ       LYS 138 149.299   4.903  -1.067
  459   3HZ   LYS 138          3HZ       LYS 138 148.808   4.394  -2.604
  460    H    ASP 139           H        ASP 139 141.049   3.660  -1.955
  461    HA   ASP 139           HA       ASP 139 140.407   6.458  -1.597
  462   1HB   ASP 139          2HB       ASP 139 139.266   6.316  -3.686
  463   2HB   ASP 139          1HB       ASP 139 140.743   5.372  -3.852
  464    H    GLY 140           H        GLY 140 139.038   3.388  -0.787
  465   1HA   GLY 140          2HA       GLY 140 136.327   4.168  -0.547
  466   2HA   GLY 140          1HA       GLY 140 137.075   2.789   0.245
  467    H    ASP 141           H        ASP 141 139.083   4.571   1.544
  468    HA   ASP 141           HA       ASP 141 137.365   5.418   3.756
  469   1HB   ASP 141          2HB       ASP 141 139.512   3.878   3.901
  470   2HB   ASP 141          1HB       ASP 141 140.347   5.428   3.943
  471    H    LYS 142           H        LYS 142 137.268   7.485   4.498
  472    HA   LYS 142           HA       LYS 142 138.676   9.514   2.894
  473   1HB   LYS 142          2HB       LYS 142 136.124   9.845   4.479
  474   2HB   LYS 142          1HB       LYS 142 136.858  11.035   3.413
  475   1HG   LYS 142          2HG       LYS 142 136.072   8.367   2.333
  476   2HG   LYS 142          1HG       LYS 142 134.849   9.613   2.590
  477   1HD   LYS 142          2HD       LYS 142 137.369  10.038   0.993
  478   2HD   LYS 142          1HD       LYS 142 135.827   9.558   0.283
  479   1HE   LYS 142          2HE       LYS 142 134.980  11.628   0.440
  480   2HE   LYS 142          1HE       LYS 142 135.638  11.873   2.057
  481   1HZ   LYS 142          1HZ       LYS 142 136.832  13.389   0.859
  482   2HZ   LYS 142          2HZ       LYS 142 136.852  12.452  -0.551
  483   3HZ   LYS 142          3HZ       LYS 142 137.867  12.055   0.743
  484    H    ASN 143           H        ASN 143 137.692   8.622   6.167
  485    HA   ASN 143           HA       ASN 143 139.209  10.801   7.332
  486   1HB   ASN 143          2HB       ASN 143 138.435   9.811   9.499
  487   2HB   ASN 143          1HB       ASN 143 137.128  10.258   8.408
  488   1HD2  ASN 143          1HD2      ASN 143 137.245   8.314  10.615
  489   2HD2  ASN 143          2HD2      ASN 143 136.747   6.808   9.930
  490    H    ASN 144           H        ASN 144 139.792   7.594   6.361
  491    HA   ASN 144           HA       ASN 144 141.636   6.271   6.481
  492   1HB   ASN 144          2HB       ASN 144 142.674   8.785   6.575
  493   2HB   ASN 144          1HB       ASN 144 143.271   8.126   8.094
  494   1HD2  ASN 144          1HD2      ASN 144 144.788   6.515   8.073
  495   2HD2  ASN 144          2HD2      ASN 144 145.610   6.011   6.640
  496    H    ASP 145           H        ASP 145 139.774   5.620   8.219
  497    HA   ASP 145           HA       ASP 145 140.958   5.457  10.887
  498   1HB   ASP 145          2HB       ASP 145 138.771   4.585  11.587
  499   2HB   ASP 145          1HB       ASP 145 138.601   6.117  10.736
  500    H    GLY 146           H        GLY 146 140.480   3.551   8.057
  501   1HA   GLY 146          2HA       GLY 146 141.983   1.572   7.973
  502   2HA   GLY 146          1HA       GLY 146 141.341   1.151   9.554
  503    H    ARG 147           H        ARG 147 138.610   2.016   8.712
  504    HA   ARG 147           HA       ARG 147 137.973  -0.113   6.791
  505   1HB   ARG 147          2HB       ARG 147 136.435   0.366   9.348
  506   2HB   ARG 147          1HB       ARG 147 136.128  -0.886   8.153
  507   1HG   ARG 147          2HG       ARG 147 138.440  -1.767   8.671
  508   2HG   ARG 147          1HG       ARG 147 138.445  -0.665  10.050
  509   1HD   ARG 147          2HD       ARG 147 135.983  -2.054  10.095
  510   2HD   ARG 147          1HD       ARG 147 137.248  -3.250   9.812
  511    HE   ARG 147           HE       ARG 147 138.015  -2.904  11.945
  512   1HH1  ARG 147          1HH1      ARG 147 135.797  -0.344  11.102
  513   2HH1  ARG 147          2HH1      ARG 147 135.738   0.303  12.706
  514   1HH2  ARG 147          1HH2      ARG 147 137.937  -2.055  14.056
  515   2HH2  ARG 147          2HH2      ARG 147 136.952  -0.668  14.384
  516    H    ILE 148           H        ILE 148 135.519   0.053   6.222
  517    HA   ILE 148           HA       ILE 148 134.886   2.907   5.824
  518    HB   ILE 148           HB       ILE 148 134.127   0.650   3.969
  519   1HG1  ILE 148          2HG1      ILE 148 136.269   2.730   3.517
  520   2HG1  ILE 148          1HG1      ILE 148 136.615   1.115   4.126
  521   1HG2  ILE 148          1HG2      ILE 148 134.116   3.601   3.404
  522   2HG2  ILE 148          2HG2      ILE 148 132.717   2.757   4.070
  523   3HG2  ILE 148          3HG2      ILE 148 133.349   2.304   2.487
  524   1HD1  ILE 148          1HD1      ILE 148 137.022   0.918   1.865
  525   2HD1  ILE 148          2HD1      ILE 148 135.661   1.951   1.425
  526   3HD1  ILE 148          3HD1      ILE 148 135.373   0.313   2.011
  527    H    ASP 149           H        ASP 149 132.913   3.609   6.394
  528    HA   ASP 149           HA       ASP 149 130.832   1.630   7.000
  529   1HB   ASP 149          2HB       ASP 149 130.252   2.816   9.064
  530   2HB   ASP 149          1HB       ASP 149 131.918   2.253   9.119
  531    H    TYR 150           H        TYR 150 128.863   3.360   7.875
  532    HA   TYR 150           HA       TYR 150 127.709   4.251   5.533
  533   1HB   TYR 150          2HB       TYR 150 126.712   3.920   7.923
  534   2HB   TYR 150          1HB       TYR 150 127.098   5.627   8.128
  535    HD1  TYR 150           HD1      TYR 150 125.124   6.829   8.049
  536    HD2  TYR 150           HD2      TYR 150 125.741   3.714   5.219
  537    HE1  TYR 150           HE1      TYR 150 123.023   7.440   6.927
  538    HE2  TYR 150           HE2      TYR 150 123.640   4.316   4.088
  539    HH   TYR 150           HH       TYR 150 121.285   5.992   5.357
  540    H    ASP 151           H        ASP 151 129.476   6.190   7.941
  541    HA   ASP 151           HA       ASP 151 129.166   8.678   6.728
  542   1HB   ASP 151          2HB       ASP 151 131.056   7.500   8.684
  543   2HB   ASP 151          1HB       ASP 151 131.590   8.969   7.871
  544    H    GLU 152           H        GLU 152 131.755   6.280   6.301
  545    HA   GLU 152           HA       GLU 152 133.183   7.831   4.388
  546   1HB   GLU 152          2HB       GLU 152 133.283   4.865   4.959
  547   2HB   GLU 152          1HB       GLU 152 134.432   5.738   3.956
  548   1HG   GLU 152          2HG       GLU 152 135.560   5.638   5.940
  549   2HG   GLU 152          1HG       GLU 152 134.754   7.198   6.089
  550    H    PHE 153           H        PHE 153 130.916   5.113   4.129
  551    HA   PHE 153           HA       PHE 153 131.039   4.793   1.351
  552   1HB   PHE 153          2HB       PHE 153 129.858   3.380   3.246
  553   2HB   PHE 153          1HB       PHE 153 128.460   4.350   2.797
  554    HD1  PHE 153           HD1      PHE 153 127.169   3.778   0.947
  555    HD2  PHE 153           HD2      PHE 153 131.044   2.080   1.403
  556    HE1  PHE 153           HE1      PHE 153 126.722   2.263  -0.938
  557    HE2  PHE 153           HE2      PHE 153 130.606   0.562  -0.481
  558    HZ   PHE 153           HZ       PHE 153 128.442   0.652  -1.656
  559    H    LEU 154           H        LEU 154 129.293   7.069   3.342
  560    HA   LEU 154           HA       LEU 154 127.467   7.962   1.368
  561   1HB   LEU 154          2HB       LEU 154 128.152   8.620   4.080
  562   2HB   LEU 154          1HB       LEU 154 128.003  10.092   3.141
  563    HG   LEU 154           HG       LEU 154 125.901   9.450   4.264
  564   1HD1  LEU 154          1HD1      LEU 154 125.511  10.807   2.435
  565   2HD1  LEU 154          2HD1      LEU 154 124.507   9.403   2.080
  566   3HD1  LEU 154          3HD1      LEU 154 126.069   9.594   1.283
  567   1HD2  LEU 154          1HD2      LEU 154 124.679   7.499   3.068
  568   2HD2  LEU 154          2HD2      LEU 154 125.839   7.140   4.346
  569   3HD2  LEU 154          3HD2      LEU 154 126.308   6.963   2.655
  570    H    GLU 155           H        GLU 155 130.665   9.089   2.388
  571    HA   GLU 155           HA       GLU 155 130.669  11.259   0.489
  572   1HB   GLU 155          2HB       GLU 155 132.644  10.165   2.463
  573   2HB   GLU 155          1HB       GLU 155 133.174  11.298   1.227
  574   1HG   GLU 155          2HG       GLU 155 131.181  12.736   2.090
  575   2HG   GLU 155          1HG       GLU 155 131.334  11.729   3.530
  576    H    PHE 156           H        PHE 156 132.133   8.056   0.752
  577    HA   PHE 156           HA       PHE 156 133.834   8.195  -1.462
  578   1HB   PHE 156          2HB       PHE 156 133.783   6.384   0.294
  579   2HB   PHE 156          1HB       PHE 156 132.373   5.723  -0.524
  580    HD1  PHE 156           HD1      PHE 156 132.981   3.752  -1.537
  581    HD2  PHE 156           HD2      PHE 156 135.580   7.111  -1.823
  582    HE1  PHE 156           HE1      PHE 156 134.453   2.480  -3.043
  583    HE2  PHE 156           HE2      PHE 156 137.056   5.844  -3.332
  584    HZ   PHE 156           HZ       PHE 156 136.492   3.526  -3.945
  585    H    MET 157           H        MET 157 130.489   6.999  -1.249
  586    HA   MET 157           HA       MET 157 130.206   6.332  -3.958
  587   1HB   MET 157          2HB       MET 157 128.372   6.819  -1.680
  588   2HB   MET 157          1HB       MET 157 127.669   6.955  -3.286
  589   1HG   MET 157          2HG       MET 157 129.332   4.575  -2.850
  590   2HG   MET 157          1HG       MET 157 127.860   4.656  -1.883
  591   1HE   MET 157          1HE       MET 157 127.587   2.339  -5.272
  592   2HE   MET 157          2HE       MET 157 127.403   2.177  -3.524
  593   3HE   MET 157          3HE       MET 157 128.953   2.671  -4.208
  594    H    LYS 158           H        LYS 158 129.312   9.301  -2.214
  595    HA   LYS 158           HA       LYS 158 128.437  10.656  -4.570
  596   1HB   LYS 158          2HB       LYS 158 128.024  11.065  -1.934
  597   2HB   LYS 158          1HB       LYS 158 129.288  12.252  -2.223
  598   1HG   LYS 158          2HG       LYS 158 127.125  12.260  -4.203
  599   2HG   LYS 158          1HG       LYS 158 126.638  12.698  -2.564
  600   1HD   LYS 158          2HD       LYS 158 129.077  14.032  -3.116
  601   2HD   LYS 158          1HD       LYS 158 128.018  14.270  -4.506
  602   1HE   LYS 158          2HE       LYS 158 127.168  15.959  -3.296
  603   2HE   LYS 158          1HE       LYS 158 126.294  14.684  -2.447
  604   1HZ   LYS 158          1HZ       LYS 158 128.509  16.324  -1.547
  605   2HZ   LYS 158          2HZ       LYS 158 128.600  14.693  -1.111
  606   3HZ   LYS 158          3HZ       LYS 158 127.256  15.615  -0.659
  607    H    GLY 159           H        GLY 159 130.443  10.069  -5.792
  608   1HA   GLY 159          2HA       GLY 159 132.039  11.387  -7.007
  609   2HA   GLY 159          1HA       GLY 159 132.384  12.265  -5.524
  610    H    VAL 160           H        VAL 160 132.958   9.341  -7.338
  611    HA   VAL 160           HA       VAL 160 134.903   8.413  -5.360
  612    HB   VAL 160           HB       VAL 160 134.138   7.015  -7.920
  613   1HG1  VAL 160          1HG1      VAL 160 136.011   5.938  -7.164
  614   2HG1  VAL 160          2HG1      VAL 160 134.762   5.042  -6.300
  615   3HG1  VAL 160          3HG1      VAL 160 135.674   6.304  -5.471
  616   1HG2  VAL 160          1HG2      VAL 160 132.169   7.530  -6.404
  617   2HG2  VAL 160          2HG2      VAL 160 132.926   6.460  -5.223
  618   3HG2  VAL 160          3HG2      VAL 160 132.435   5.830  -6.795
  619    H    GLU 161           H        GLU 161 135.491  10.795  -6.822
  620    HA   GLU 161           HA       GLU 161 137.196  10.295  -9.025
  621   1HB   GLU 161          2HB       GLU 161 136.930  12.624  -7.130
  622   2HB   GLU 161          1HB       GLU 161 138.093  12.617  -8.448
  623   1HG   GLU 161          2HG       GLU 161 136.422  12.617 -10.079
  624   2HG   GLU 161          1HG       GLU 161 135.178  12.121  -8.931
  Start of MODEL   19
    1   1H    MET  81          1HT       MET  81  93.521   9.950   2.747
    2   2H    MET  81          2HT       MET  81  93.457   8.329   3.308
    3   3H    MET  81          3HT       MET  81  92.918   9.610   4.315
    4    HA   MET  81           HA       MET  81  91.007   8.664   3.525
    5   1HB   MET  81          2HB       MET  81  91.607  11.243   3.078
    6   2HB   MET  81          1HB       MET  81  91.296  10.743   1.421
    7   1HG   MET  81          2HG       MET  81  89.086   9.910   2.121
    8   2HG   MET  81          1HG       MET  81  89.402  10.513   3.747
    9   1HE   MET  81          1HE       MET  81  87.086  11.250   3.232
   10   2HE   MET  81          2HE       MET  81  86.630  12.690   2.321
   11   3HE   MET  81          3HE       MET  81  87.394  12.852   3.902
   12    H    VAL  82           H        VAL  82  93.432   8.973   0.999
   13    HA   VAL  82           HA       VAL  82  92.694   6.549  -0.241
   14    HB   VAL  82           HB       VAL  82  90.788   7.864  -1.058
   15   1HG1  VAL  82          1HG1      VAL  82  92.186  10.033  -1.030
   16   2HG1  VAL  82          2HG1      VAL  82  90.966   9.825  -2.287
   17   3HG1  VAL  82          3HG1      VAL  82  92.668   9.556  -2.657
   18   1HG2  VAL  82          1HG2      VAL  82  91.624   6.079  -2.460
   19   2HG2  VAL  82          2HG2      VAL  82  92.815   7.164  -3.179
   20   3HG2  VAL  82          3HG2      VAL  82  91.094   7.426  -3.467
   21    H    ARG  83           H        ARG  83  94.148   9.738  -0.767
   22    HA   ARG  83           HA       ARG  83  96.043   8.875  -2.689
   23   1HB   ARG  83          2HB       ARG  83  97.150  11.028  -2.265
   24   2HB   ARG  83          1HB       ARG  83  95.417  11.221  -2.481
   25   1HG   ARG  83          2HG       ARG  83  95.240  11.202   0.046
   26   2HG   ARG  83          1HG       ARG  83  96.996  11.368   0.065
   27   1HD   ARG  83          2HD       ARG  83  96.620  13.371  -1.498
   28   2HD   ARG  83          1HD       ARG  83  94.937  13.284  -0.980
   29    HE   ARG  83           HE       ARG  83  96.293  13.324   1.356
   30   1HH1  ARG  83          1HH1      ARG  83  96.381  15.355  -1.480
   31   2HH1  ARG  83          2HH1      ARG  83  96.825  16.779  -0.600
   32   1HH2  ARG  83          1HH2      ARG  83  96.878  15.196   2.515
   33   2HH2  ARG  83          2HH2      ARG  83  97.109  16.688   1.668
   34    H    CYS  84           H        CYS  84  95.966   8.825   0.784
   35    HA   CYS  84           HA       CYS  84  97.368   7.940   2.339
   36   1HB   CYS  84          2HB       CYS  84  98.726   6.674  -0.049
   37   2HB   CYS  84          1HB       CYS  84  98.952   6.204   1.631
   38    HG   CYS  84           HG       CYS  84  97.241   4.585   0.522
   39    H    MET  85           H        MET  85  99.815   7.768   2.919
   40    HA   MET  85           HA       MET  85 100.891  10.349   2.840
   41   1HB   MET  85          2HB       MET  85 102.367   7.769   3.390
   42   2HB   MET  85          1HB       MET  85 102.877   9.380   3.869
   43   1HG   MET  85          2HG       MET  85 100.240   8.332   4.783
   44   2HG   MET  85          1HG       MET  85 101.721   7.805   5.581
   45   1HE   MET  85          1HE       MET  85 103.535   9.503   6.391
   46   2HE   MET  85          2HE       MET  85 102.494   9.095   7.756
   47   3HE   MET  85          3HE       MET  85 102.989  10.767   7.494
   48    H    LYS  86           H        LYS  86 103.060  10.946   1.995
   49    HA   LYS  86           HA       LYS  86 103.739   9.600  -0.521
   50   1HB   LYS  86          2HB       LYS  86 102.226  11.745  -0.711
   51   2HB   LYS  86          1HB       LYS  86 103.743  12.590  -0.435
   52   1HG   LYS  86          2HG       LYS  86 104.675  11.219  -2.363
   53   2HG   LYS  86          1HG       LYS  86 103.000  10.791  -2.716
   54   1HD   LYS  86          2HD       LYS  86 103.494  13.660  -2.305
   55   2HD   LYS  86          1HD       LYS  86 104.278  12.965  -3.724
   56   1HE   LYS  86          2HE       LYS  86 101.903  11.893  -4.096
   57   2HE   LYS  86          1HE       LYS  86 101.379  13.246  -3.096
   58   1HZ   LYS  86          1HZ       LYS  86 102.304  14.780  -4.645
   59   2HZ   LYS  86          2HZ       LYS  86 101.342  13.697  -5.518
   60   3HZ   LYS  86          3HZ       LYS  86 103.026  13.542  -5.546
   61    H    ASP  87           H        ASP  87 104.985   9.642   2.120
   62    HA   ASP  87           HA       ASP  87 107.396  11.236   1.708
   63   1HB   ASP  87          2HB       ASP  87 108.000  10.474   3.995
   64   2HB   ASP  87          1HB       ASP  87 106.449  11.304   3.938
   65    H    ASP  88           H        ASP  88 106.312   7.903   1.799
   66    HA   ASP  88           HA       ASP  88 108.963   6.803   1.622
   67   1HB   ASP  88          2HB       ASP  88 106.712   5.745   2.538
   68   2HB   ASP  88          1HB       ASP  88 106.546   5.220   0.865
   69    H    SER  89           H        SER  89 106.507   7.844  -0.600
   70    HA   SER  89           HA       SER  89 107.696   6.496  -2.868
   71   1HB   SER  89          2HB       SER  89 105.627   8.660  -3.098
   72   2HB   SER  89          1HB       SER  89 105.863   7.236  -4.109
   73    HG   SER  89           HG       SER  89 104.048   7.246  -2.523
   74    H    LYS  90           H        LYS  90 109.736   7.806  -1.969
   75    HA   LYS  90           HA       LYS  90 109.878  10.377  -3.384
   76   1HB   LYS  90          2HB       LYS  90 111.115   9.311  -0.933
   77   2HB   LYS  90          1HB       LYS  90 112.208  10.218  -1.970
   78   1HG   LYS  90          2HG       LYS  90 109.876  11.750  -1.834
   79   2HG   LYS  90          1HG       LYS  90 110.161  11.167  -0.192
   80   1HD   LYS  90          2HD       LYS  90 112.532  12.169  -1.631
   81   2HD   LYS  90          1HD       LYS  90 111.311  13.378  -1.223
   82   1HE   LYS  90          2HE       LYS  90 111.411  12.727   1.111
   83   2HE   LYS  90          1HE       LYS  90 112.562  11.450   0.728
   84   1HZ   LYS  90          1HZ       LYS  90 114.105  13.186  -0.048
   85   2HZ   LYS  90          2HZ       LYS  90 113.727  13.340   1.593
   86   3HZ   LYS  90          3HZ       LYS  90 113.012  14.373   0.459
   87    H    GLY  91           H        GLY  91 112.259  10.814  -4.155
   88   1HA   GLY  91          2HA       GLY  91 112.827   8.727  -6.089
   89   2HA   GLY  91          1HA       GLY  91 113.548  10.329  -6.039
   90    H    LYS  92           H        LYS  92 115.367   8.663  -6.601
   91    HA   LYS  92           HA       LYS  92 116.503   7.062  -4.607
   92   1HB   LYS  92          2HB       LYS  92 117.467   8.303  -7.132
   93   2HB   LYS  92          1HB       LYS  92 118.685   7.719  -6.007
   94   1HG   LYS  92          2HG       LYS  92 118.345   5.617  -6.619
   95   2HG   LYS  92          1HG       LYS  92 116.605   5.759  -6.354
   96   1HD   LYS  92          2HD       LYS  92 117.717   7.043  -8.784
   97   2HD   LYS  92          1HD       LYS  92 117.664   5.280  -8.757
   98   1HE   LYS  92          2HE       LYS  92 115.303   7.057  -8.170
   99   2HE   LYS  92          1HE       LYS  92 115.644   6.358  -9.752
  100   1HZ   LYS  92          1HZ       LYS  92 114.985   4.323  -9.094
  101   2HZ   LYS  92          2HZ       LYS  92 114.099   5.188  -7.941
  102   3HZ   LYS  92          3HZ       LYS  92 115.585   4.496  -7.520
  103    H    THR  93           H        THR  93 116.422   8.218  -2.648
  104    HA   THR  93           HA       THR  93 118.086  10.611  -2.430
  105    HB   THR  93           HB       THR  93 117.169  10.532  -0.014
  106    HG1  THR  93           HG1      THR  93 115.198   9.365   0.126
  107   1HG2  THR  93          1HG2      THR  93 114.937  11.406  -0.700
  108   2HG2  THR  93          2HG2      THR  93 115.359  11.000  -2.364
  109   3HG2  THR  93          3HG2      THR  93 116.312  12.189  -1.477
  110    H    GLU  94           H        GLU  94 119.162  10.624  -0.050
  111    HA   GLU  94           HA       GLU  94 121.354   8.868  -0.234
  112   1HB   GLU  94          2HB       GLU  94 120.395  10.854   1.775
  113   2HB   GLU  94          1HB       GLU  94 121.656   9.727   2.253
  114   1HG   GLU  94          2HG       GLU  94 123.161  10.555   0.670
  115   2HG   GLU  94          1HG       GLU  94 121.889  11.366  -0.242
  116    H    GLU  95           H        GLU  95 118.252   8.465   1.168
  117    HA   GLU  95           HA       GLU  95 118.875   6.637   3.223
  118   1HB   GLU  95          2HB       GLU  95 116.506   6.018   3.133
  119   2HB   GLU  95          1HB       GLU  95 116.710   7.763   3.090
  120   1HG   GLU  95          2HG       GLU  95 115.274   7.684   1.389
  121   2HG   GLU  95          1HG       GLU  95 116.669   7.167   0.443
  122    H    GLU  96           H        GLU  96 118.329   6.245  -0.226
  123    HA   GLU  96           HA       GLU  96 118.178   3.394  -0.151
  124   1HB   GLU  96          2HB       GLU  96 118.272   3.497  -2.562
  125   2HB   GLU  96          1HB       GLU  96 117.198   4.757  -1.973
  126   1HG   GLU  96          2HG       GLU  96 118.392   6.335  -2.963
  127   2HG   GLU  96          1HG       GLU  96 119.881   5.758  -2.214
  128    H    LEU  97           H        LEU  97 120.763   5.711  -0.324
  129    HA   LEU  97           HA       LEU  97 122.791   4.157  -1.443
  130   1HB   LEU  97          2HB       LEU  97 122.651   6.537   0.297
  131   2HB   LEU  97          1HB       LEU  97 124.162   5.649   0.359
  132    HG   LEU  97           HG       LEU  97 122.953   6.575  -2.238
  133   1HD1  LEU  97          1HD1      LEU  97 125.206   8.069  -1.049
  134   2HD1  LEU  97          2HD1      LEU  97 123.613   8.346  -0.348
  135   3HD1  LEU  97          3HD1      LEU  97 123.880   8.630  -2.067
  136   1HD2  LEU  97          1HD2      LEU  97 125.541   5.389  -1.358
  137   2HD2  LEU  97          2HD2      LEU  97 125.528   6.504  -2.725
  138   3HD2  LEU  97          3HD2      LEU  97 124.560   5.030  -2.780
  139    H    SER  98           H        SER  98 121.400   4.120   1.755
  140    HA   SER  98           HA       SER  98 123.439   2.733   3.106
  141   1HB   SER  98          2HB       SER  98 121.778   2.256   4.798
  142   2HB   SER  98          1HB       SER  98 121.509   3.894   4.200
  143    HG   SER  98           HG       SER  98 119.923   1.648   3.989
  144    H    ASP  99           H        ASP  99 120.869   1.662   0.996
  145    HA   ASP  99           HA       ASP  99 120.875  -1.070   1.646
  146   1HB   ASP  99          2HB       ASP  99 119.234   0.273   0.160
  147   2HB   ASP  99          1HB       ASP  99 120.374  -0.057  -1.142
  148    H    LEU 100           H        LEU 100 122.917   0.844  -0.467
  149    HA   LEU 100           HA       LEU 100 124.187  -1.352  -1.754
  150   1HB   LEU 100          2HB       LEU 100 124.887   1.554  -1.435
  151   2HB   LEU 100          1HB       LEU 100 125.965   0.436  -2.249
  152    HG   LEU 100           HG       LEU 100 123.839  -0.111  -3.690
  153   1HD1  LEU 100          1HD1      LEU 100 122.079   1.072  -2.918
  154   2HD1  LEU 100          2HD1      LEU 100 122.763   2.331  -3.946
  155   3HD1  LEU 100          3HD1      LEU 100 123.092   2.332  -2.213
  156   1HD2  LEU 100          1HD2      LEU 100 124.488   2.138  -4.993
  157   2HD2  LEU 100          2HD2      LEU 100 125.518   0.705  -4.969
  158   3HD2  LEU 100          3HD2      LEU 100 125.850   2.047  -3.875
  159    H    PHE 101           H        PHE 101 124.719   0.356   1.236
  160    HA   PHE 101           HA       PHE 101 127.372  -0.588   1.681
  161   1HB   PHE 101          2HB       PHE 101 126.559   1.427   2.786
  162   2HB   PHE 101          1HB       PHE 101 125.315   0.500   3.616
  163    HD1  PHE 101           HD1      PHE 101 129.022   0.445   3.165
  164    HD2  PHE 101           HD2      PHE 101 125.717  -0.060   5.798
  165    HE1  PHE 101           HE1      PHE 101 130.574   0.034   5.028
  166    HE2  PHE 101           HE2      PHE 101 127.264  -0.471   7.666
  167    HZ   PHE 101           HZ       PHE 101 129.697  -0.423   7.283
  168    H    ARG 102           H        ARG 102 124.206  -1.908   2.206
  169    HA   ARG 102           HA       ARG 102 124.825  -3.765   4.232
  170   1HB   ARG 102          2HB       ARG 102 122.594  -3.182   2.486
  171   2HB   ARG 102          1HB       ARG 102 122.825  -4.919   2.637
  172   1HG   ARG 102          2HG       ARG 102 123.029  -4.200   5.218
  173   2HG   ARG 102          1HG       ARG 102 121.941  -2.941   4.630
  174   1HD   ARG 102          2HD       ARG 102 120.457  -4.595   5.248
  175   2HD   ARG 102          1HD       ARG 102 120.672  -4.927   3.530
  176    HE   ARG 102           HE       ARG 102 122.564  -6.456   4.780
  177   1HH1  ARG 102          1HH1      ARG 102 119.094  -6.155   4.994
  178   2HH1  ARG 102          2HH1      ARG 102 118.853  -7.807   5.448
  179   1HH2  ARG 102          1HH2      ARG 102 122.250  -8.631   5.378
  180   2HH2  ARG 102          2HH2      ARG 102 120.645  -9.214   5.667
  181    H    MET 103           H        MET 103 124.470  -4.297   0.722
  182    HA   MET 103           HA       MET 103 125.359  -6.940   0.691
  183   1HB   MET 103          2HB       MET 103 125.939  -6.467  -1.727
  184   2HB   MET 103          1HB       MET 103 124.285  -6.114  -1.252
  185   1HG   MET 103          2HG       MET 103 124.591  -4.144  -2.226
  186   2HG   MET 103          1HG       MET 103 125.551  -3.730  -0.809
  187   1HE   MET 103          1HE       MET 103 125.710  -3.801  -4.706
  188   2HE   MET 103          2HE       MET 103 125.588  -5.482  -4.186
  189   3HE   MET 103          3HE       MET 103 127.061  -4.905  -4.964
  190    H    PHE 104           H        PHE 104 127.185  -3.928   0.321
  191    HA   PHE 104           HA       PHE 104 129.686  -5.054  -0.228
  192   1HB   PHE 104          2HB       PHE 104 128.649  -2.470   0.239
  193   2HB   PHE 104          1HB       PHE 104 129.976  -2.681   1.379
  194    HD1  PHE 104           HD1      PHE 104 132.249  -3.194   0.539
  195    HD2  PHE 104           HD2      PHE 104 129.043  -2.203  -2.078
  196    HE1  PHE 104           HE1      PHE 104 133.866  -2.711  -1.251
  197    HE2  PHE 104           HE2      PHE 104 130.655  -1.718  -3.873
  198    HZ   PHE 104           HZ       PHE 104 133.069  -1.972  -3.461
  199    H    ASP 105           H        ASP 105 128.105  -4.325   2.847
  200    HA   ASP 105           HA       ASP 105 130.361  -5.105   4.434
  201   1HB   ASP 105          2HB       ASP 105 128.341  -3.519   5.015
  202   2HB   ASP 105          1HB       ASP 105 127.575  -5.021   5.527
  203    H    LYS 106           H        LYS 106 131.012  -7.164   4.345
  204    HA   LYS 106           HA       LYS 106 129.381  -9.376   3.759
  205   1HB   LYS 106          2HB       LYS 106 132.012  -9.047   3.791
  206   2HB   LYS 106          1HB       LYS 106 131.847  -9.729   5.402
  207   1HG   LYS 106          2HG       LYS 106 132.267 -11.583   4.090
  208   2HG   LYS 106          1HG       LYS 106 130.508 -11.597   4.234
  209   1HD   LYS 106          2HD       LYS 106 130.668 -10.147   2.032
  210   2HD   LYS 106          1HD       LYS 106 132.223 -10.967   1.883
  211   1HE   LYS 106          2HE       LYS 106 131.271 -12.945   1.398
  212   2HE   LYS 106          1HE       LYS 106 129.983 -12.724   2.581
  213   1HZ   LYS 106          1HZ       LYS 106 130.072 -11.942  -0.239
  214   2HZ   LYS 106          2HZ       LYS 106 129.184 -10.972   0.825
  215   3HZ   LYS 106          3HZ       LYS 106 128.801 -12.610   0.654
  216    H    ASN 107           H        ASN 107 130.764  -8.342   6.880
  217    HA   ASN 107           HA       ASN 107 129.223 -10.256   8.356
  218   1HB   ASN 107          2HB       ASN 107 131.481  -9.363   9.047
  219   2HB   ASN 107          1HB       ASN 107 130.683  -7.847   9.447
  220   1HD2  ASN 107          1HD2      ASN 107 131.260 -11.107  10.375
  221   2HD2  ASN 107          2HD2      ASN 107 130.483 -11.036  11.915
  222    H    ALA 108           H        ALA 108 128.848  -6.918   7.426
  223    HA   ALA 108           HA       ALA 108 127.117  -5.456   7.615
  224   1HB   ALA 108          1HB       ALA 108 124.869  -6.649   8.367
  225   2HB   ALA 108          2HB       ALA 108 125.795  -8.090   7.946
  226   3HB   ALA 108          3HB       ALA 108 125.527  -6.831   6.741
  227    H    ASP 109           H        ASP 109 128.850  -5.581   9.764
  228    HA   ASP 109           HA       ASP 109 127.139  -5.441  12.143
  229   1HB   ASP 109          2HB       ASP 109 129.299  -5.361  13.396
  230   2HB   ASP 109          1HB       ASP 109 129.089  -6.825  12.439
  231    H    GLY 110           H        GLY 110 128.355  -3.415   9.792
  232   1HA   GLY 110          2HA       GLY 110 127.540  -1.068  10.125
  233   2HA   GLY 110          1HA       GLY 110 128.400  -1.124  11.658
  234    H    TYR 111           H        TYR 111 130.595  -2.703  10.335
  235    HA   TYR 111           HA       TYR 111 131.782  -0.577   8.691
  236   1HB   TYR 111          2HB       TYR 111 133.262  -2.051  10.876
  237   2HB   TYR 111          1HB       TYR 111 133.888  -0.751   9.869
  238    HD1  TYR 111           HD1      TYR 111 133.476   1.531  10.411
  239    HD2  TYR 111           HD2      TYR 111 131.514  -1.557  12.581
  240    HE1  TYR 111           HE1      TYR 111 132.733   3.181  12.076
  241    HE2  TYR 111           HE2      TYR 111 130.766   0.084  14.252
  242    HH   TYR 111           HH       TYR 111 131.988   3.287  14.360
  243    H    ILE 112           H        ILE 112 133.645  -1.312   7.411
  244    HA   ILE 112           HA       ILE 112 133.592  -4.206   6.871
  245    HB   ILE 112           HB       ILE 112 133.798  -2.098   4.722
  246   1HG1  ILE 112          2HG1      ILE 112 131.408  -3.785   5.501
  247   2HG1  ILE 112          1HG1      ILE 112 131.565  -2.052   5.769
  248   1HG2  ILE 112          1HG2      ILE 112 133.952  -5.042   4.802
  249   2HG2  ILE 112          2HG2      ILE 112 134.709  -3.893   3.699
  250   3HG2  ILE 112          3HG2      ILE 112 133.019  -4.346   3.478
  251   1HD1  ILE 112          1HD1      ILE 112 130.253  -3.025   3.709
  252   2HD1  ILE 112          2HD1      ILE 112 131.867  -3.064   3.000
  253   3HD1  ILE 112          3HD1      ILE 112 131.198  -1.541   3.586
  254    H    ASP 113           H        ASP 113 135.530  -5.143   6.280
  255    HA   ASP 113           HA       ASP 113 137.890  -3.394   6.190
  256   1HB   ASP 113          2HB       ASP 113 139.083  -5.232   7.520
  257   2HB   ASP 113          1HB       ASP 113 137.984  -4.182   8.409
  258    H    LEU 114           H        LEU 114 139.889  -4.833   5.584
  259    HA   LEU 114           HA       LEU 114 139.501  -5.748   2.972
  260   1HB   LEU 114          2HB       LEU 114 141.781  -6.477   4.809
  261   2HB   LEU 114          1HB       LEU 114 141.796  -6.507   3.056
  262    HG   LEU 114           HG       LEU 114 141.137  -3.884   4.209
  263   1HD1  LEU 114          1HD1      LEU 114 143.334  -3.341   4.959
  264   2HD1  LEU 114          2HD1      LEU 114 143.947  -4.927   4.490
  265   3HD1  LEU 114          3HD1      LEU 114 142.811  -4.782   5.831
  266   1HD2  LEU 114          1HD2      LEU 114 143.235  -4.705   2.212
  267   2HD2  LEU 114          2HD2      LEU 114 142.548  -3.099   2.455
  268   3HD2  LEU 114          3HD2      LEU 114 141.549  -4.395   1.797
  269    H    GLU 115           H        GLU 115 139.868  -7.552   6.004
  270    HA   GLU 115           HA       GLU 115 139.888 -10.129   4.928
  271   1HB   GLU 115          2HB       GLU 115 138.774  -9.234   7.592
  272   2HB   GLU 115          1HB       GLU 115 139.209 -10.882   7.163
  273   1HG   GLU 115          2HG       GLU 115 141.515  -9.530   6.620
  274   2HG   GLU 115          1HG       GLU 115 140.891  -8.656   8.017
  275    H    GLU 116           H        GLU 116 137.162  -8.137   6.026
  276    HA   GLU 116           HA       GLU 116 135.190 -10.111   5.445
  277   1HB   GLU 116          2HB       GLU 116 135.251  -7.351   6.425
  278   2HB   GLU 116          1HB       GLU 116 133.844  -7.709   5.435
  279   1HG   GLU 116          2HG       GLU 116 132.988  -9.196   6.932
  280   2HG   GLU 116          1HG       GLU 116 134.572  -9.634   7.571
  281    H    LEU 117           H        LEU 117 136.554  -7.393   3.675
  282    HA   LEU 117           HA       LEU 117 134.667  -7.438   1.549
  283   1HB   LEU 117          2HB       LEU 117 136.510  -5.663   2.329
  284   2HB   LEU 117          1HB       LEU 117 137.422  -6.455   1.059
  285    HG   LEU 117           HG       LEU 117 135.686  -5.902  -0.568
  286   1HD1  LEU 117          1HD1      LEU 117 133.915  -4.245   0.190
  287   2HD1  LEU 117          2HD1      LEU 117 134.299  -4.756   1.835
  288   3HD1  LEU 117          3HD1      LEU 117 133.689  -5.928   0.668
  289   1HD2  LEU 117          1HD2      LEU 117 135.827  -3.264  -0.035
  290   2HD2  LEU 117          2HD2      LEU 117 137.152  -4.198  -0.727
  291   3HD2  LEU 117          3HD2      LEU 117 137.117  -3.866   1.005
  292    H    LYS 118           H        LYS 118 137.891  -8.857   1.967
  293    HA   LYS 118           HA       LYS 118 138.291  -9.833  -0.593
  294   1HB   LYS 118          2HB       LYS 118 139.874 -11.366   0.354
  295   2HB   LYS 118          1HB       LYS 118 139.964  -9.860   1.255
  296   1HG   LYS 118          2HG       LYS 118 139.525 -10.904   3.157
  297   2HG   LYS 118          1HG       LYS 118 138.067 -11.631   2.483
  298   1HD   LYS 118          2HD       LYS 118 139.950 -13.146   1.288
  299   2HD   LYS 118          1HD       LYS 118 140.779 -12.751   2.796
  300   1HE   LYS 118          2HE       LYS 118 137.983 -13.866   2.666
  301   2HE   LYS 118          1HE       LYS 118 139.425 -14.865   2.841
  302   1HZ   LYS 118          1HZ       LYS 118 138.037 -13.906   4.896
  303   2HZ   LYS 118          2HZ       LYS 118 139.174 -12.667   4.722
  304   3HZ   LYS 118          3HZ       LYS 118 139.690 -14.258   4.976
  305    H    ILE 119           H        ILE 119 136.152 -10.993   1.888
  306    HA   ILE 119           HA       ILE 119 135.764 -13.614   0.868
  307    HB   ILE 119           HB       ILE 119 133.818 -11.986   2.504
  308   1HG1  ILE 119          2HG1      ILE 119 135.738 -13.980   3.658
  309   2HG1  ILE 119          1HG1      ILE 119 136.273 -12.329   3.355
  310   1HG2  ILE 119          1HG2      ILE 119 132.832 -14.042   3.134
  311   2HG2  ILE 119          2HG2      ILE 119 134.143 -14.974   2.410
  312   3HG2  ILE 119          3HG2      ILE 119 133.011 -14.097   1.380
  313   1HD1  ILE 119          1HD1      ILE 119 134.161 -11.674   4.707
  314   2HD1  ILE 119          2HD1      ILE 119 135.601 -12.242   5.552
  315   3HD1  ILE 119          3HD1      ILE 119 134.242 -13.336   5.292
  316    H    MET 120           H        MET 120 133.798 -10.653   0.597
  317    HA   MET 120           HA       MET 120 131.851 -11.724  -1.114
  318   1HB   MET 120          2HB       MET 120 131.276  -9.396  -1.629
  319   2HB   MET 120          1HB       MET 120 131.519  -9.631   0.097
  320   1HG   MET 120          2HG       MET 120 133.384  -8.340   0.156
  321   2HG   MET 120          1HG       MET 120 133.846  -8.735  -1.498
  322   1HE   MET 120          1HE       MET 120 132.136  -6.891  -3.792
  323   2HE   MET 120          2HE       MET 120 133.623  -7.676  -3.259
  324   3HE   MET 120          3HE       MET 120 133.495  -5.915  -3.236
  325    H    LEU 121           H        LEU 121 135.041 -10.465  -1.734
  326    HA   LEU 121           HA       LEU 121 134.721 -10.098  -4.539
  327   1HB   LEU 121          2HB       LEU 121 137.054 -10.251  -2.675
  328   2HB   LEU 121          1HB       LEU 121 137.328 -10.317  -4.406
  329    HG   LEU 121           HG       LEU 121 135.625  -8.097  -3.435
  330   1HD1  LEU 121          1HD1      LEU 121 138.407  -8.528  -2.542
  331   2HD1  LEU 121          2HD1      LEU 121 137.100  -7.612  -1.792
  332   3HD1  LEU 121          3HD1      LEU 121 138.008  -6.916  -3.135
  333   1HD2  LEU 121          1HD2      LEU 121 136.421  -8.613  -5.828
  334   2HD2  LEU 121          2HD2      LEU 121 137.973  -7.969  -5.292
  335   3HD2  LEU 121          3HD2      LEU 121 136.532  -6.953  -5.246
  336    H    GLN 122           H        GLN 122 135.607 -12.793  -2.497
  337    HA   GLN 122           HA       GLN 122 136.762 -14.476  -4.409
  338   1HB   GLN 122          2HB       GLN 122 135.132 -15.174  -1.961
  339   2HB   GLN 122          1HB       GLN 122 136.085 -16.327  -2.884
  340   1HG   GLN 122          2HG       GLN 122 137.883 -14.317  -2.328
  341   2HG   GLN 122          1HG       GLN 122 136.911 -14.419  -0.862
  342   1HE2  GLN 122          1HE2      GLN 122 136.732 -16.500   0.173
  343   2HE2  GLN 122          2HE2      GLN 122 138.026 -17.638   0.035
  344    H    ALA 123           H        ALA 123 133.429 -13.686  -3.758
  345    HA   ALA 123           HA       ALA 123 132.141 -15.826  -4.998
  346   1HB   ALA 123          1HB       ALA 123 130.957 -13.133  -5.341
  347   2HB   ALA 123          2HB       ALA 123 131.272 -13.669  -3.690
  348   3HB   ALA 123          3HB       ALA 123 130.232 -14.627  -4.744
  349    H    THR 124           H        THR 124 133.389 -12.806  -6.373
  350    HA   THR 124           HA       THR 124 132.400 -13.136  -8.973
  351    HB   THR 124           HB       THR 124 134.119 -11.526  -9.647
  352    HG1  THR 124           HG1      THR 124 135.646 -10.846  -8.077
  353   1HG2  THR 124          1HG2      THR 124 133.421  -9.702  -8.437
  354   2HG2  THR 124          2HG2      THR 124 133.330 -10.605  -6.925
  355   3HG2  THR 124          3HG2      THR 124 132.105 -10.846  -8.171
  356    H    GLY 125           H        GLY 125 133.823 -13.488 -10.930
  357   1HA   GLY 125          2HA       GLY 125 135.094 -16.072 -10.651
  358   2HA   GLY 125          1HA       GLY 125 134.787 -15.214 -12.154
  359    H    GLU 126           H        GLU 126 136.085 -12.770 -11.369
  360    HA   GLU 126           HA       GLU 126 138.738 -13.401 -12.143
  361   1HB   GLU 126          2HB       GLU 126 137.772 -10.803 -10.943
  362   2HB   GLU 126          1HB       GLU 126 139.178 -11.044 -11.974
  363   1HG   GLU 126          2HG       GLU 126 137.155 -12.007 -13.533
  364   2HG   GLU 126          1HG       GLU 126 136.367 -10.682 -12.676
  365    H    THR 127           H        THR 127 140.535 -13.743 -10.977
  366    HA   THR 127           HA       THR 127 140.289 -14.128  -8.139
  367    HB   THR 127           HB       THR 127 142.779 -14.689  -8.365
  368    HG1  THR 127           HG1      THR 127 142.972 -13.499 -10.386
  369   1HG2  THR 127          1HG2      THR 127 142.332 -16.778  -9.727
  370   2HG2  THR 127          2HG2      THR 127 140.674 -16.196  -9.873
  371   3HG2  THR 127          3HG2      THR 127 141.350 -16.538  -8.281
  372    H    ILE 128           H        ILE 128 140.352 -12.460  -6.789
  373    HA   ILE 128           HA       ILE 128 142.053 -10.155  -7.437
  374    HB   ILE 128           HB       ILE 128 139.951 -10.318  -5.278
  375   1HG1  ILE 128          2HG1      ILE 128 138.954 -10.709  -7.510
  376   2HG1  ILE 128          1HG1      ILE 128 138.441  -9.175  -6.814
  377   1HG2  ILE 128          1HG2      ILE 128 141.555  -8.564  -4.915
  378   2HG2  ILE 128          2HG2      ILE 128 140.035  -7.848  -5.449
  379   3HG2  ILE 128          3HG2      ILE 128 141.380  -8.005  -6.579
  380   1HD1  ILE 128          1HD1      ILE 128 140.455  -9.615  -8.998
  381   2HD1  ILE 128          2HD1      ILE 128 140.199  -8.063  -8.200
  382   3HD1  ILE 128          3HD1      ILE 128 138.889  -8.813  -9.113
  383    H    THR 129           H        THR 129 143.763  -9.597  -6.209
  384    HA   THR 129           HA       THR 129 144.520 -11.420  -4.060
  385    HB   THR 129           HB       THR 129 146.706 -10.058  -4.211
  386    HG1  THR 129           HG1      THR 129 146.957  -8.994  -6.215
  387   1HG2  THR 129          1HG2      THR 129 147.186 -12.008  -5.184
  388   2HG2  THR 129          2HG2      THR 129 147.027 -11.102  -6.690
  389   3HG2  THR 129          3HG2      THR 129 145.668 -12.050  -6.084
  390    H    GLU 130           H        GLU 130 145.952 -10.142  -2.320
  391    HA   GLU 130           HA       GLU 130 144.094  -8.629  -0.803
  392   1HB   GLU 130          2HB       GLU 130 146.901  -9.539  -0.467
  393   2HB   GLU 130          1HB       GLU 130 146.388  -8.172   0.513
  394   1HG   GLU 130          2HG       GLU 130 144.718  -9.431   1.585
  395   2HG   GLU 130          1HG       GLU 130 144.833 -10.734   0.405
  396    H    ASP 131           H        ASP 131 146.950  -7.773  -2.699
  397    HA   ASP 131           HA       ASP 131 147.119  -5.075  -1.969
  398   1HB   ASP 131          2HB       ASP 131 148.215  -6.794  -4.067
  399   2HB   ASP 131          1HB       ASP 131 147.977  -5.130  -4.598
  400    H    ASP 132           H        ASP 132 145.233  -6.689  -4.480
  401    HA   ASP 132           HA       ASP 132 144.285  -4.386  -5.781
  402   1HB   ASP 132          2HB       ASP 132 143.459  -7.241  -5.636
  403   2HB   ASP 132          1HB       ASP 132 142.268  -6.089  -6.232
  404    H    ILE 133           H        ILE 133 143.163  -6.105  -2.931
  405    HA   ILE 133           HA       ILE 133 140.694  -4.687  -2.705
  406    HB   ILE 133           HB       ILE 133 142.173  -6.133  -0.507
  407   1HG1  ILE 133          2HG1      ILE 133 139.997  -7.357  -2.176
  408   2HG1  ILE 133          1HG1      ILE 133 141.668  -7.412  -2.722
  409   1HG2  ILE 133          1HG2      ILE 133 139.233  -6.114  -0.617
  410   2HG2  ILE 133          2HG2      ILE 133 139.991  -4.557  -0.288
  411   3HG2  ILE 133          3HG2      ILE 133 140.322  -5.937   0.760
  412   1HD1  ILE 133          1HD1      ILE 133 142.129  -8.387  -0.361
  413   2HD1  ILE 133          2HD1      ILE 133 141.446  -9.415  -1.622
  414   3HD1  ILE 133          3HD1      ILE 133 140.401  -8.737  -0.375
  415    H    GLU 134           H        GLU 134 143.960  -4.183  -1.573
  416    HA   GLU 134           HA       GLU 134 143.489  -2.334   0.468
  417   1HB   GLU 134          2HB       GLU 134 145.813  -2.646  -1.431
  418   2HB   GLU 134          1HB       GLU 134 145.817  -1.506  -0.092
  419   1HG   GLU 134          2HG       GLU 134 145.448  -3.403   1.458
  420   2HG   GLU 134          1HG       GLU 134 145.596  -4.501   0.086
  421    H    GLU 135           H        GLU 135 143.480  -1.969  -3.003
  422    HA   GLU 135           HA       GLU 135 143.600   0.882  -3.021
  423   1HB   GLU 135          2HB       GLU 135 143.236  -1.273  -4.986
  424   2HB   GLU 135          1HB       GLU 135 142.384   0.213  -5.386
  425   1HG   GLU 135          2HG       GLU 135 145.225   0.415  -4.552
  426   2HG   GLU 135          1HG       GLU 135 144.866  -0.224  -6.156
  427    H    LEU 136           H        LEU 136 140.985  -1.492  -3.078
  428    HA   LEU 136           HA       LEU 136 138.859   0.259  -3.577
  429   1HB   LEU 136          2HB       LEU 136 139.076  -2.396  -2.204
  430   2HB   LEU 136          1HB       LEU 136 137.551  -1.530  -2.210
  431    HG   LEU 136           HG       LEU 136 138.241  -1.474  -4.864
  432   1HD1  LEU 136          1HD1      LEU 136 140.056  -3.209  -3.948
  433   2HD1  LEU 136          2HD1      LEU 136 139.325  -3.336  -5.547
  434   3HD1  LEU 136          3HD1      LEU 136 138.711  -4.317  -4.217
  435   1HD2  LEU 136          1HD2      LEU 136 136.061  -1.996  -4.504
  436   2HD2  LEU 136          2HD2      LEU 136 136.427  -3.085  -3.167
  437   3HD2  LEU 136          3HD2      LEU 136 136.665  -3.621  -4.830
  438    H    MET 137           H        MET 137 140.477  -0.630  -0.575
  439    HA   MET 137           HA       MET 137 138.635   0.886   1.052
  440   1HB   MET 137          2HB       MET 137 141.286  -0.355   1.809
  441   2HB   MET 137          1HB       MET 137 140.059   0.237   2.920
  442   1HG   MET 137          2HG       MET 137 139.831  -2.112   1.057
  443   2HG   MET 137          1HG       MET 137 139.951  -2.153   2.815
  444   1HE   MET 137          1HE       MET 137 138.285  -1.271   4.405
  445   2HE   MET 137          2HE       MET 137 137.638  -2.871   4.042
  446   3HE   MET 137          3HE       MET 137 136.555  -1.482   4.137
  447    H    LYS 138           H        LYS 138 141.714   1.379  -0.494
  448    HA   LYS 138           HA       LYS 138 142.702   3.525   0.985
  449   1HB   LYS 138          2HB       LYS 138 143.301   2.237  -1.490
  450   2HB   LYS 138          1HB       LYS 138 143.296   3.974  -1.766
  451   1HG   LYS 138          2HG       LYS 138 144.902   4.278   0.041
  452   2HG   LYS 138          1HG       LYS 138 144.895   2.539   0.345
  453   1HD   LYS 138          2HD       LYS 138 145.792   2.118  -1.867
  454   2HD   LYS 138          1HD       LYS 138 145.715   3.838  -2.253
  455   1HE   LYS 138          2HE       LYS 138 147.176   3.930   0.003
  456   2HE   LYS 138          1HE       LYS 138 147.652   2.343  -0.600
  457   1HZ   LYS 138          1HZ       LYS 138 148.375   3.312  -2.639
  458   2HZ   LYS 138          2HZ       LYS 138 149.080   4.189  -1.377
  459   3HZ   LYS 138          3HZ       LYS 138 147.759   4.831  -2.216
  460    H    ASP 139           H        ASP 139 140.668   3.591  -1.939
  461    HA   ASP 139           HA       ASP 139 140.238   6.436  -1.653
  462   1HB   ASP 139          2HB       ASP 139 139.101   6.330  -3.747
  463   2HB   ASP 139          1HB       ASP 139 140.506   5.278  -3.878
  464    H    GLY 140           H        GLY 140 138.715   3.550  -0.614
  465   1HA   GLY 140          2HA       GLY 140 136.046   4.591  -0.443
  466   2HA   GLY 140          1HA       GLY 140 136.638   3.110   0.296
  467    H    ASP 141           H        ASP 141 138.842   4.606   1.634
  468    HA   ASP 141           HA       ASP 141 137.277   5.470   3.934
  469   1HB   ASP 141          2HB       ASP 141 139.362   3.881   3.938
  470   2HB   ASP 141          1HB       ASP 141 140.274   5.386   3.896
  471    H    LYS 142           H        LYS 142 137.330   7.495   4.822
  472    HA   LYS 142           HA       LYS 142 138.593   9.581   3.174
  473   1HB   LYS 142          2HB       LYS 142 136.268   9.879   5.081
  474   2HB   LYS 142          1HB       LYS 142 136.890  11.104   3.984
  475   1HG   LYS 142          2HG       LYS 142 135.693   8.490   3.095
  476   2HG   LYS 142          1HG       LYS 142 134.801  10.009   3.213
  477   1HD   LYS 142          2HD       LYS 142 137.299   9.699   1.562
  478   2HD   LYS 142          1HD       LYS 142 135.683   9.408   0.917
  479   1HE   LYS 142          2HE       LYS 142 135.625  11.897   2.264
  480   2HE   LYS 142          1HE       LYS 142 137.064  11.882   1.247
  481   1HZ   LYS 142          1HZ       LYS 142 135.626  11.215  -0.625
  482   2HZ   LYS 142          2HZ       LYS 142 135.225  12.735   0.001
  483   3HZ   LYS 142          3HZ       LYS 142 134.271  11.389   0.373
  484    H    ASN 143           H        ASN 143 138.003   8.525   6.490
  485    HA   ASN 143           HA       ASN 143 139.714  10.609   7.566
  486   1HB   ASN 143          2HB       ASN 143 139.161   9.582   9.760
  487   2HB   ASN 143          1HB       ASN 143 137.733  10.035   8.835
  488   1HD2  ASN 143          1HD2      ASN 143 138.504   7.906  10.930
  489   2HD2  ASN 143          2HD2      ASN 143 137.794   6.464  10.299
  490    H    ASN 144           H        ASN 144 140.107   7.488   6.321
  491    HA   ASN 144           HA       ASN 144 141.907   6.111   6.161
  492   1HB   ASN 144          2HB       ASN 144 143.120   8.346   5.958
  493   2HB   ASN 144          1HB       ASN 144 143.512   8.177   7.666
  494   1HD2  ASN 144          1HD2      ASN 144 143.458   5.965   4.889
  495   2HD2  ASN 144          2HD2      ASN 144 145.072   5.388   5.102
  496    H    ASP 145           H        ASP 145 140.421   5.047   7.837
  497    HA   ASP 145           HA       ASP 145 141.835   4.753  10.401
  498   1HB   ASP 145          2HB       ASP 145 139.714   3.895  11.301
  499   2HB   ASP 145          1HB       ASP 145 139.516   5.509  10.625
  500    H    GLY 146           H        GLY 146 140.635   3.074   7.587
  501   1HA   GLY 146          2HA       GLY 146 141.998   1.083   6.989
  502   2HA   GLY 146          1HA       GLY 146 141.796   0.574   8.658
  503    H    ARG 147           H        ARG 147 138.927   1.659   8.440
  504    HA   ARG 147           HA       ARG 147 137.810  -0.561   6.863
  505   1HB   ARG 147          2HB       ARG 147 136.754   0.367   9.537
  506   2HB   ARG 147          1HB       ARG 147 136.162  -0.985   8.581
  507   1HG   ARG 147          2HG       ARG 147 138.602  -1.869   8.846
  508   2HG   ARG 147          1HG       ARG 147 138.638  -0.765  10.223
  509   1HD   ARG 147          2HD       ARG 147 136.407  -1.894  10.883
  510   2HD   ARG 147          1HD       ARG 147 136.907  -3.167   9.772
  511    HE   ARG 147           HE       ARG 147 139.071  -2.836  11.368
  512   1HH1  ARG 147          1HH1      ARG 147 135.688  -3.419  11.997
  513   2HH1  ARG 147          2HH1      ARG 147 135.981  -4.285  13.467
  514   1HH2  ARG 147          1HH2      ARG 147 139.459  -3.976  13.302
  515   2HH2  ARG 147          2HH2      ARG 147 138.123  -4.602  14.208
  516    H    ILE 148           H        ILE 148 135.456  -0.253   6.388
  517    HA   ILE 148           HA       ILE 148 134.871   2.603   5.941
  518    HB   ILE 148           HB       ILE 148 133.971   0.300   4.206
  519   1HG1  ILE 148          2HG1      ILE 148 136.138   2.344   3.668
  520   2HG1  ILE 148          1HG1      ILE 148 136.429   0.665   4.113
  521   1HG2  ILE 148          1HG2      ILE 148 133.795   3.289   3.840
  522   2HG2  ILE 148          2HG2      ILE 148 132.454   2.186   4.149
  523   3HG2  ILE 148          3HG2      ILE 148 133.344   2.087   2.629
  524   1HD1  ILE 148          1HD1      ILE 148 135.234  -0.034   2.064
  525   2HD1  ILE 148          2HD1      ILE 148 136.689   0.913   1.748
  526   3HD1  ILE 148          3HD1      ILE 148 135.099   1.665   1.608
  527    H    ASP 149           H        ASP 149 132.795   3.335   6.296
  528    HA   ASP 149           HA       ASP 149 130.844   1.407   7.344
  529   1HB   ASP 149          2HB       ASP 149 130.256   2.994   9.152
  530   2HB   ASP 149          1HB       ASP 149 131.914   2.413   9.286
  531    H    TYR 150           H        TYR 150 128.735   2.926   7.882
  532    HA   TYR 150           HA       TYR 150 127.653   3.550   5.385
  533   1HB   TYR 150          2HB       TYR 150 126.292   2.976   7.354
  534   2HB   TYR 150          1HB       TYR 150 126.738   4.503   8.107
  535    HD1  TYR 150           HD1      TYR 150 125.551   3.573   4.682
  536    HD2  TYR 150           HD2      TYR 150 124.932   5.934   8.169
  537    HE1  TYR 150           HE1      TYR 150 123.632   4.662   3.597
  538    HE2  TYR 150           HE2      TYR 150 123.011   7.028   7.093
  539    HH   TYR 150           HH       TYR 150 121.392   6.551   5.288
  540    H    ASP 151           H        ASP 151 128.977   5.674   7.898
  541    HA   ASP 151           HA       ASP 151 128.379   8.120   6.678
  542   1HB   ASP 151          2HB       ASP 151 130.544   7.291   8.605
  543   2HB   ASP 151          1HB       ASP 151 130.381   8.953   8.045
  544    H    GLU 152           H        GLU 152 131.329   6.144   6.501
  545    HA   GLU 152           HA       GLU 152 132.685   7.870   4.709
  546   1HB   GLU 152          2HB       GLU 152 133.140   4.909   5.103
  547   2HB   GLU 152          1HB       GLU 152 134.285   6.077   4.457
  548   1HG   GLU 152          2HG       GLU 152 133.261   6.711   7.128
  549   2HG   GLU 152          1HG       GLU 152 134.216   5.232   7.027
  550    H    PHE 153           H        PHE 153 130.731   4.953   4.245
  551    HA   PHE 153           HA       PHE 153 131.139   4.651   1.492
  552   1HB   PHE 153          2HB       PHE 153 129.944   3.102   3.225
  553   2HB   PHE 153          1HB       PHE 153 128.501   3.995   2.760
  554    HD1  PHE 153           HD1      PHE 153 127.190   2.713   1.384
  555    HD2  PHE 153           HD2      PHE 153 131.410   2.667   0.837
  556    HE1  PHE 153           HE1      PHE 153 126.915   1.250  -0.574
  557    HE2  PHE 153           HE2      PHE 153 131.143   1.204  -1.124
  558    HZ   PHE 153           HZ       PHE 153 128.894   0.495  -1.832
  559    H    LEU 154           H        LEU 154 129.012   6.754   3.300
  560    HA   LEU 154           HA       LEU 154 127.326   7.512   1.156
  561   1HB   LEU 154          2HB       LEU 154 127.592   8.116   3.910
  562   2HB   LEU 154          1HB       LEU 154 127.626   9.643   3.050
  563    HG   LEU 154           HG       LEU 154 125.361   9.107   3.736
  564   1HD1  LEU 154          1HD1      LEU 154 125.906   8.958   0.784
  565   2HD1  LEU 154          2HD1      LEU 154 125.462  10.369   1.744
  566   3HD1  LEU 154          3HD1      LEU 154 124.279   9.094   1.451
  567   1HD2  LEU 154          1HD2      LEU 154 125.175   6.794   1.893
  568   2HD2  LEU 154          2HD2      LEU 154 124.305   7.126   3.391
  569   3HD2  LEU 154          3HD2      LEU 154 125.965   6.534   3.448
  570    H    GLU 155           H        GLU 155 130.223   9.014   2.566
  571    HA   GLU 155           HA       GLU 155 130.286  11.208   0.772
  572   1HB   GLU 155          2HB       GLU 155 132.538   9.973   2.370
  573   2HB   GLU 155          1HB       GLU 155 132.578  11.552   1.598
  574   1HG   GLU 155          2HG       GLU 155 130.896  12.391   3.064
  575   2HG   GLU 155          1HG       GLU 155 130.601  10.786   3.729
  576    H    PHE 156           H        PHE 156 131.787   8.015   0.753
  577    HA   PHE 156           HA       PHE 156 133.496   8.394  -1.438
  578   1HB   PHE 156          2HB       PHE 156 133.567   6.459   0.145
  579   2HB   PHE 156          1HB       PHE 156 132.125   5.820  -0.640
  580    HD1  PHE 156           HD1      PHE 156 135.423   7.193  -1.737
  581    HD2  PHE 156           HD2      PHE 156 132.522   4.100  -2.088
  582    HE1  PHE 156           HE1      PHE 156 136.837   6.062  -3.404
  583    HE2  PHE 156           HE2      PHE 156 133.930   2.964  -3.754
  584    HZ   PHE 156           HZ       PHE 156 136.090   3.944  -4.413
  585    H    MET 157           H        MET 157 130.133   7.301  -1.268
  586    HA   MET 157           HA       MET 157 129.889   6.800  -4.060
  587   1HB   MET 157          2HB       MET 157 127.931   7.102  -1.802
  588   2HB   MET 157          1HB       MET 157 127.368   6.984  -3.463
  589   1HG   MET 157          2HG       MET 157 129.305   4.934  -2.646
  590   2HG   MET 157          1HG       MET 157 127.745   4.877  -1.827
  591   1HE   MET 157          1HE       MET 157 128.446   2.418  -5.109
  592   2HE   MET 157          2HE       MET 157 127.844   2.138  -3.474
  593   3HE   MET 157          3HE       MET 157 129.385   2.960  -3.717
  594    H    LYS 158           H        LYS 158 129.140   9.552  -1.976
  595    HA   LYS 158           HA       LYS 158 128.056  11.096  -4.165
  596   1HB   LYS 158          2HB       LYS 158 127.399  11.211  -1.656
  597   2HB   LYS 158          1HB       LYS 158 128.822  12.229  -1.490
  598   1HG   LYS 158          2HG       LYS 158 127.870  13.973  -2.565
  599   2HG   LYS 158          1HG       LYS 158 126.943  12.939  -3.654
  600   1HD   LYS 158          2HD       LYS 158 126.226  12.937  -0.767
  601   2HD   LYS 158          1HD       LYS 158 125.776  14.343  -1.734
  602   1HE   LYS 158          2HE       LYS 158 125.181  11.739  -2.962
  603   2HE   LYS 158          1HE       LYS 158 124.276  12.094  -1.490
  604   1HZ   LYS 158          1HZ       LYS 158 123.181  12.839  -3.567
  605   2HZ   LYS 158          2HZ       LYS 158 124.444  13.938  -3.809
  606   3HZ   LYS 158          3HZ       LYS 158 123.441  14.087  -2.454
  607    H    GLY 159           H        GLY 159 130.070  10.810  -5.453
  608   1HA   GLY 159          2HA       GLY 159 131.591  12.363  -6.469
  609   2HA   GLY 159          1HA       GLY 159 131.903  13.039  -4.876
  610    H    VAL 160           H        VAL 160 132.195   9.947  -6.626
  611    HA   VAL 160           HA       VAL 160 134.139   8.807  -4.974
  612    HB   VAL 160           HB       VAL 160 133.932   8.329  -7.945
  613   1HG1  VAL 160          1HG1      VAL 160 135.840   7.281  -6.882
  614   2HG1  VAL 160          2HG1      VAL 160 134.649   6.057  -7.326
  615   3HG1  VAL 160          3HG1      VAL 160 134.795   6.577  -5.647
  616   1HG2  VAL 160          1HG2      VAL 160 132.380   6.412  -7.069
  617   2HG2  VAL 160          2HG2      VAL 160 131.727   8.023  -7.361
  618   3HG2  VAL 160          3HG2      VAL 160 132.120   7.516  -5.719
  619    H    GLU 161           H        GLU 161 134.529  10.667  -7.983
  620    HA   GLU 161           HA       GLU 161 137.385  10.606  -7.866
  621   1HB   GLU 161          2HB       GLU 161 137.282  12.201  -9.733
  622   2HB   GLU 161          1HB       GLU 161 136.229  10.818 -10.003
  623   1HG   GLU 161          2HG       GLU 161 134.475  12.481  -8.860
  624   2HG   GLU 161          1HG       GLU 161 135.564  13.662  -9.587
  Start of MODEL   20
    1   1H    MET  81          1HT       MET  81  96.190   9.086   3.544
    2   2H    MET  81          2HT       MET  81  95.702   9.179   1.902
    3   3H    MET  81          3HT       MET  81  94.579   8.699   3.107
    4    HA   MET  81           HA       MET  81  94.464  10.788   4.019
    5   1HB   MET  81          2HB       MET  81  97.066  11.075   2.620
    6   2HB   MET  81          1HB       MET  81  96.083  12.528   2.745
    7   1HG   MET  81          2HG       MET  81  96.095  12.445   5.107
    8   2HG   MET  81          1HG       MET  81  96.770  10.818   5.115
    9   1HE   MET  81          1HE       MET  81  97.622  13.189   6.787
   10   2HE   MET  81          2HE       MET  81  99.322  13.604   6.561
   11   3HE   MET  81          3HE       MET  81  98.864  11.948   6.955
   12    H    VAL  82           H        VAL  82  93.088   9.489   1.985
   13    HA   VAL  82           HA       VAL  82  91.495   9.938   0.418
   14    HB   VAL  82           HB       VAL  82  92.300  12.842   0.591
   15   1HG1  VAL  82          1HG1      VAL  82  90.745  11.865  -1.254
   16   2HG1  VAL  82          2HG1      VAL  82  90.285  13.347  -0.414
   17   3HG1  VAL  82          3HG1      VAL  82  89.550  11.811   0.043
   18   1HG2  VAL  82          1HG2      VAL  82  91.827  11.961   2.833
   19   2HG2  VAL  82          2HG2      VAL  82  90.266  11.367   2.266
   20   3HG2  VAL  82          3HG2      VAL  82  90.590  13.100   2.305
   21    H    ARG  83           H        ARG  83  94.013  12.365  -0.297
   22    HA   ARG  83           HA       ARG  83  94.222  11.202  -2.994
   23   1HB   ARG  83          2HB       ARG  83  95.123  13.441  -3.656
   24   2HB   ARG  83          1HB       ARG  83  93.451  13.469  -3.114
   25   1HG   ARG  83          2HG       ARG  83  94.120  14.335  -0.963
   26   2HG   ARG  83          1HG       ARG  83  95.823  14.213  -1.414
   27   1HD   ARG  83          2HD       ARG  83  95.605  15.911  -3.047
   28   2HD   ARG  83          1HD       ARG  83  93.844  15.868  -2.961
   29    HE   ARG  83           HE       ARG  83  95.106  16.582  -0.479
   30   1HH1  ARG  83          1HH1      ARG  83  93.910  17.786  -3.529
   31   2HH1  ARG  83          2HH1      ARG  83  93.665  19.396  -2.940
   32   1HH2  ARG  83          1HH2      ARG  83  94.784  18.699   0.297
   33   2HH2  ARG  83          2HH2      ARG  83  94.163  19.915  -0.768
   34    H    CYS  84           H        CYS  84  96.026  12.364  -0.212
   35    HA   CYS  84           HA       CYS  84  98.581  11.758  -1.441
   36   1HB   CYS  84          2HB       CYS  84  97.673  13.037   1.085
   37   2HB   CYS  84          1HB       CYS  84  99.253  12.263   1.100
   38    HG   CYS  84           HG       CYS  84  98.750  14.365  -1.102
   39    H    MET  85           H        MET  85  99.913  10.063  -0.938
   40    HA   MET  85           HA       MET  85  99.351   8.245   1.201
   41   1HB   MET  85          2HB       MET  85  98.098   7.774  -1.324
   42   2HB   MET  85          1HB       MET  85  99.314   6.530  -1.070
   43   1HG   MET  85          2HG       MET  85  98.130   6.548   1.350
   44   2HG   MET  85          1HG       MET  85  96.772   7.011   0.325
   45   1HE   MET  85          1HE       MET  85  95.565   4.023  -1.271
   46   2HE   MET  85          2HE       MET  85  95.468   5.744  -0.907
   47   3HE   MET  85          3HE       MET  85  95.189   4.557   0.367
   48    H    LYS  86           H        LYS  86 101.557   9.849   0.172
   49    HA   LYS  86           HA       LYS  86 103.809   9.718  -0.117
   50   1HB   LYS  86          2HB       LYS  86 103.553   6.839   0.752
   51   2HB   LYS  86          1HB       LYS  86 104.966   7.877   0.885
   52   1HG   LYS  86          2HG       LYS  86 103.101   9.286   2.291
   53   2HG   LYS  86          1HG       LYS  86 102.652   7.617   2.645
   54   1HD   LYS  86          2HD       LYS  86 104.506   7.248   3.871
   55   2HD   LYS  86          1HD       LYS  86 105.534   8.174   2.775
   56   1HE   LYS  86          2HE       LYS  86 105.290  10.080   3.954
   57   2HE   LYS  86          1HE       LYS  86 103.595   9.760   4.316
   58   1HZ   LYS  86          1HZ       LYS  86 104.766   7.895   5.798
   59   2HZ   LYS  86          2HZ       LYS  86 104.416   9.446   6.373
   60   3HZ   LYS  86          3HZ       LYS  86 105.977   9.077   5.834
   61    H    ASP  87           H        ASP  87 102.041   9.062  -2.337
   62    HA   ASP  87           HA       ASP  87 103.016   6.873  -3.822
   63   1HB   ASP  87          2HB       ASP  87 101.931   7.957  -5.754
   64   2HB   ASP  87          1HB       ASP  87 100.879   7.935  -4.342
   65    H    ASP  88           H        ASP  88 104.185  10.120  -3.376
   66    HA   ASP  88           HA       ASP  88 106.121   9.827  -5.544
   67   1HB   ASP  88          2HB       ASP  88 104.717  12.005  -4.649
   68   2HB   ASP  88          1HB       ASP  88 106.281  12.241  -3.874
   69    H    SER  89           H        SER  89 106.465   8.040  -3.430
   70    HA   SER  89           HA       SER  89 108.714   9.124  -1.891
   71   1HB   SER  89          2HB       SER  89 106.780   6.908  -1.484
   72   2HB   SER  89          1HB       SER  89 108.416   6.645  -0.884
   73    HG   SER  89           HG       SER  89 106.946   8.989  -0.302
   74    H    LYS  90           H        LYS  90 108.911   8.505  -4.734
   75    HA   LYS  90           HA       LYS  90 110.738   6.203  -4.697
   76   1HB   LYS  90          2HB       LYS  90 108.750   6.439  -6.364
   77   2HB   LYS  90          1HB       LYS  90 109.805   7.572  -7.199
   78   1HG   LYS  90          2HG       LYS  90 111.485   5.484  -6.876
   79   2HG   LYS  90          1HG       LYS  90 109.941   4.643  -7.012
   80   1HD   LYS  90          2HD       LYS  90 110.306   4.803  -9.226
   81   2HD   LYS  90          1HD       LYS  90 109.736   6.460  -9.024
   82   1HE   LYS  90          2HE       LYS  90 112.367   6.707  -8.374
   83   2HE   LYS  90          1HE       LYS  90 112.428   5.442  -9.601
   84   1HZ   LYS  90          1HZ       LYS  90 111.755   8.253  -9.868
   85   2HZ   LYS  90          2HZ       LYS  90 110.797   7.189 -10.769
   86   3HZ   LYS  90          3HZ       LYS  90 112.475   7.199 -10.980
   87    H    GLY  91           H        GLY  91 111.604   8.620  -3.558
   88   1HA   GLY  91          2HA       GLY  91 113.405   9.761  -5.582
   89   2HA   GLY  91          1HA       GLY  91 113.018  10.491  -4.032
   90    H    LYS  92           H        LYS  92 115.471   9.207  -5.655
   91    HA   LYS  92           HA       LYS  92 116.587   7.359  -3.806
   92   1HB   LYS  92          2HB       LYS  92 117.220   8.323  -6.373
   93   2HB   LYS  92          1HB       LYS  92 118.602   8.721  -5.361
   94   1HG   LYS  92          2HG       LYS  92 117.941   6.098  -4.686
   95   2HG   LYS  92          1HG       LYS  92 117.784   6.181  -6.441
   96   1HD   LYS  92          2HD       LYS  92 120.174   7.482  -5.308
   97   2HD   LYS  92          1HD       LYS  92 120.114   5.725  -5.150
   98   1HE   LYS  92          2HE       LYS  92 121.212   6.150  -7.193
   99   2HE   LYS  92          1HE       LYS  92 119.575   5.657  -7.622
  100   1HZ   LYS  92          1HZ       LYS  92 120.120   7.529  -8.939
  101   2HZ   LYS  92          2HZ       LYS  92 120.683   8.407  -7.607
  102   3HZ   LYS  92          3HZ       LYS  92 119.031   8.076  -7.764
  103    H    THR  93           H        THR  93 116.793   8.087  -1.752
  104    HA   THR  93           HA       THR  93 118.132  10.655  -1.296
  105    HB   THR  93           HB       THR  93 117.452  10.021   1.163
  106    HG1  THR  93           HG1      THR  93 115.747   8.644   1.295
  107   1HG2  THR  93          1HG2      THR  93 115.223  10.988   0.867
  108   2HG2  THR  93          2HG2      THR  93 115.397  10.828  -0.881
  109   3HG2  THR  93          3HG2      THR  93 116.467  11.904   0.017
  110    H    GLU  94           H        GLU  94 119.411  10.484   0.966
  111    HA   GLU  94           HA       GLU  94 121.762   9.060   0.387
  112   1HB   GLU  94          2HB       GLU  94 120.787  10.808   2.511
  113   2HB   GLU  94          1HB       GLU  94 121.875   9.565   3.110
  114   1HG   GLU  94          2HG       GLU  94 123.528  10.921   2.526
  115   2HG   GLU  94          1HG       GLU  94 123.158  10.486   0.858
  116    H    GLU  95           H        GLU  95 118.957   8.270   2.328
  117    HA   GLU  95           HA       GLU  95 119.988   6.124   3.790
  118   1HB   GLU  95          2HB       GLU  95 117.665   5.390   4.036
  119   2HB   GLU  95          1HB       GLU  95 117.812   7.126   4.268
  120   1HG   GLU  95          2HG       GLU  95 116.175   7.377   2.805
  121   2HG   GLU  95          1HG       GLU  95 117.289   6.823   1.557
  122    H    GLU  96           H        GLU  96 119.090   6.367   0.449
  123    HA   GLU  96           HA       GLU  96 118.590   3.703  -0.182
  124   1HB   GLU  96          2HB       GLU  96 119.984   5.773  -1.888
  125   2HB   GLU  96          1HB       GLU  96 119.240   4.291  -2.474
  126   1HG   GLU  96          2HG       GLU  96 117.601   6.247  -0.936
  127   2HG   GLU  96          1HG       GLU  96 117.973   6.557  -2.631
  128    H    LEU  97           H        LEU  97 121.654   5.432   0.116
  129    HA   LEU  97           HA       LEU  97 123.357   3.465  -0.895
  130   1HB   LEU  97          2HB       LEU  97 123.679   5.730   1.021
  131   2HB   LEU  97          1HB       LEU  97 124.984   4.568   0.867
  132    HG   LEU  97           HG       LEU  97 123.833   6.234  -1.374
  133   1HD1  LEU  97          1HD1      LEU  97 126.429   6.413   0.143
  134   2HD1  LEU  97          2HD1      LEU  97 125.124   7.597   0.122
  135   3HD1  LEU  97          3HD1      LEU  97 126.071   7.301  -1.337
  136   1HD2  LEU  97          1HD2      LEU  97 126.004   4.152  -1.308
  137   2HD2  LEU  97          2HD2      LEU  97 125.857   5.347  -2.596
  138   3HD2  LEU  97          3HD2      LEU  97 124.558   4.188  -2.317
  139    H    SER  98           H        SER  98 121.703   3.683   2.151
  140    HA   SER  98           HA       SER  98 123.264   2.000   3.729
  141   1HB   SER  98          2HB       SER  98 121.331   3.358   4.542
  142   2HB   SER  98          1HB       SER  98 120.243   2.204   3.769
  143    HG   SER  98           HG       SER  98 120.385   1.304   5.686
  144    H    ASP  99           H        ASP  99 121.016   1.268   1.164
  145    HA   ASP  99           HA       ASP  99 120.839  -1.536   1.772
  146   1HB   ASP  99          2HB       ASP  99 119.200   0.039   0.414
  147   2HB   ASP  99          1HB       ASP  99 120.202  -0.465  -0.944
  148    H    LEU 100           H        LEU 100 122.682   0.482  -0.462
  149    HA   LEU 100           HA       LEU 100 123.887  -1.679  -1.866
  150   1HB   LEU 100          2HB       LEU 100 124.323   1.261  -1.679
  151   2HB   LEU 100          1HB       LEU 100 125.620   0.281  -2.336
  152    HG   LEU 100           HG       LEU 100 122.933  -0.193  -3.481
  153   1HD1  LEU 100          1HD1      LEU 100 124.263   2.442  -3.516
  154   2HD1  LEU 100          2HD1      LEU 100 122.560   2.024  -3.697
  155   3HD1  LEU 100          3HD1      LEU 100 123.663   1.840  -5.060
  156   1HD2  LEU 100          1HD2      LEU 100 125.376   0.360  -5.069
  157   2HD2  LEU 100          2HD2      LEU 100 124.108  -0.842  -5.317
  158   3HD2  LEU 100          3HD2      LEU 100 125.349  -1.107  -4.092
  159    H    PHE 101           H        PHE 101 124.675   0.096   1.038
  160    HA   PHE 101           HA       PHE 101 127.366  -0.816   1.252
  161   1HB   PHE 101          2HB       PHE 101 126.638   1.212   2.390
  162   2HB   PHE 101          1HB       PHE 101 125.485   0.289   3.348
  163    HD1  PHE 101           HD1      PHE 101 129.124   0.050   2.531
  164    HD2  PHE 101           HD2      PHE 101 126.102  -0.011   5.526
  165    HE1  PHE 101           HE1      PHE 101 130.844  -0.306   4.253
  166    HE2  PHE 101           HE2      PHE 101 127.817  -0.365   7.255
  167    HZ   PHE 101           HZ       PHE 101 130.192  -0.512   6.619
  168    H    ARG 102           H        ARG 102 124.269  -2.113   2.155
  169    HA   ARG 102           HA       ARG 102 125.082  -3.943   4.120
  170   1HB   ARG 102          2HB       ARG 102 122.720  -3.571   2.390
  171   2HB   ARG 102          1HB       ARG 102 122.974  -5.212   2.967
  172   1HG   ARG 102          2HG       ARG 102 122.495  -4.682   5.111
  173   2HG   ARG 102          1HG       ARG 102 123.181  -3.062   4.980
  174   1HD   ARG 102          2HD       ARG 102 120.958  -2.543   5.126
  175   2HD   ARG 102          1HD       ARG 102 121.126  -2.687   3.378
  176    HE   ARG 102           HE       ARG 102 119.775  -4.535   3.433
  177   1HH1  ARG 102          1HH1      ARG 102 120.848  -3.822   6.676
  178   2HH1  ARG 102          2HH1      ARG 102 119.796  -4.983   7.413
  179   1HH2  ARG 102          1HH2      ARG 102 118.390  -6.061   4.400
  180   2HH2  ARG 102          2HH2      ARG 102 118.401  -6.253   6.121
  181    H    MET 103           H        MET 103 124.566  -4.444   0.625
  182    HA   MET 103           HA       MET 103 125.297  -7.114   0.497
  183   1HB   MET 103          2HB       MET 103 125.998  -6.541  -1.898
  184   2HB   MET 103          1HB       MET 103 124.332  -6.220  -1.441
  185   1HG   MET 103          2HG       MET 103 124.757  -3.886  -1.242
  186   2HG   MET 103          1HG       MET 103 126.492  -4.131  -1.423
  187   1HE   MET 103          1HE       MET 103 126.906  -5.323  -4.988
  188   2HE   MET 103          2HE       MET 103 127.430  -5.435  -3.308
  189   3HE   MET 103          3HE       MET 103 127.610  -3.919  -4.189
  190    H    PHE 104           H        PHE 104 127.341  -4.236   0.308
  191    HA   PHE 104           HA       PHE 104 129.760  -5.502  -0.293
  192   1HB   PHE 104          2HB       PHE 104 128.953  -2.890   0.837
  193   2HB   PHE 104          1HB       PHE 104 130.604  -3.397   1.180
  194    HD1  PHE 104           HD1      PHE 104 132.214  -3.694  -0.627
  195    HD2  PHE 104           HD2      PHE 104 128.263  -2.302  -1.382
  196    HE1  PHE 104           HE1      PHE 104 132.915  -2.927  -2.857
  197    HE2  PHE 104           HE2      PHE 104 128.957  -1.532  -3.613
  198    HZ   PHE 104           HZ       PHE 104 131.284  -1.844  -4.354
  199    H    ASP 105           H        ASP 105 128.159  -4.918   2.792
  200    HA   ASP 105           HA       ASP 105 130.341  -5.895   4.369
  201   1HB   ASP 105          2HB       ASP 105 128.110  -4.395   4.909
  202   2HB   ASP 105          1HB       ASP 105 127.668  -5.957   5.594
  203    H    LYS 106           H        LYS 106 130.316  -7.821   5.664
  204    HA   LYS 106           HA       LYS 106 129.202 -10.077   4.217
  205   1HB   LYS 106          2HB       LYS 106 131.596  -9.769   5.364
  206   2HB   LYS 106          1HB       LYS 106 130.740 -10.465   6.733
  207   1HG   LYS 106          2HG       LYS 106 131.891 -12.170   5.429
  208   2HG   LYS 106          1HG       LYS 106 130.144 -12.406   5.399
  209   1HD   LYS 106          2HD       LYS 106 131.038 -10.715   3.221
  210   2HD   LYS 106          1HD       LYS 106 131.847 -12.281   3.206
  211   1HE   LYS 106          2HE       LYS 106 129.635 -13.380   3.351
  212   2HE   LYS 106          1HE       LYS 106 128.872 -11.792   3.249
  213   1HZ   LYS 106          1HZ       LYS 106 129.664 -11.494   1.067
  214   2HZ   LYS 106          2HZ       LYS 106 129.048 -13.068   1.110
  215   3HZ   LYS 106          3HZ       LYS 106 130.719 -12.814   1.171
  216    H    ASN 107           H        ASN 107 129.224  -8.960   7.604
  217    HA   ASN 107           HA       ASN 107 126.784 -10.534   8.056
  218   1HB   ASN 107          2HB       ASN 107 127.326 -10.317  10.467
  219   2HB   ASN 107          1HB       ASN 107 128.595 -11.126   9.553
  220   1HD2  ASN 107          1HD2      ASN 107 128.395  -9.372  12.075
  221   2HD2  ASN 107          2HD2      ASN 107 129.704  -8.260  11.882
  222    H    ALA 108           H        ALA 108 127.517  -7.506   7.180
  223    HA   ALA 108           HA       ALA 108 126.493  -5.481   7.318
  224   1HB   ALA 108          1HB       ALA 108 124.093  -6.844   8.487
  225   2HB   ALA 108          2HB       ALA 108 124.553  -7.089   6.802
  226   3HB   ALA 108          3HB       ALA 108 124.166  -5.470   7.384
  227    H    ASP 109           H        ASP 109 128.169  -5.421   9.206
  228    HA   ASP 109           HA       ASP 109 126.841  -5.052  11.788
  229   1HB   ASP 109          2HB       ASP 109 129.112  -4.953  12.723
  230   2HB   ASP 109          1HB       ASP 109 128.872  -6.421  11.781
  231    H    GLY 110           H        GLY 110 128.263  -3.273   9.184
  232   1HA   GLY 110          2HA       GLY 110 127.426  -0.909   9.141
  233   2HA   GLY 110          1HA       GLY 110 128.043  -0.796  10.781
  234    H    TYR 111           H        TYR 111 130.382  -2.534   9.894
  235    HA   TYR 111           HA       TYR 111 131.838  -0.503   8.344
  236   1HB   TYR 111          2HB       TYR 111 132.950  -1.988  10.733
  237   2HB   TYR 111          1HB       TYR 111 133.783  -0.767   9.777
  238    HD1  TYR 111           HD1      TYR 111 133.788   1.421  10.532
  239    HD2  TYR 111           HD2      TYR 111 130.694  -1.192  11.834
  240    HE1  TYR 111           HE1      TYR 111 132.944   3.178  12.033
  241    HE2  TYR 111           HE2      TYR 111 129.842   0.556  13.337
  242    HH   TYR 111           HH       TYR 111 129.922   3.053  13.492
  243    H    ILE 112           H        ILE 112 133.538  -1.269   7.042
  244    HA   ILE 112           HA       ILE 112 133.687  -4.194   6.743
  245    HB   ILE 112           HB       ILE 112 133.708  -2.272   4.419
  246   1HG1  ILE 112          2HG1      ILE 112 131.438  -4.032   5.372
  247   2HG1  ILE 112          1HG1      ILE 112 131.501  -2.282   5.548
  248   1HG2  ILE 112          1HG2      ILE 112 134.880  -4.482   4.206
  249   2HG2  ILE 112          2HG2      ILE 112 133.584  -4.207   3.042
  250   3HG2  ILE 112          3HG2      ILE 112 133.311  -5.256   4.433
  251   1HD1  ILE 112          1HD1      ILE 112 131.322  -1.950   3.222
  252   2HD1  ILE 112          2HD1      ILE 112 130.115  -3.163   3.646
  253   3HD1  ILE 112          3HD1      ILE 112 131.628  -3.652   2.882
  254    H    ASP 113           H        ASP 113 135.674  -5.036   6.143
  255    HA   ASP 113           HA       ASP 113 137.898  -3.135   5.884
  256   1HB   ASP 113          2HB       ASP 113 139.275  -4.531   7.367
  257   2HB   ASP 113          1HB       ASP 113 137.859  -3.909   8.208
  258    H    LEU 114           H        LEU 114 139.996  -4.591   5.421
  259    HA   LEU 114           HA       LEU 114 139.684  -5.597   2.837
  260   1HB   LEU 114          2HB       LEU 114 141.801  -4.770   4.004
  261   2HB   LEU 114          1HB       LEU 114 141.922  -6.379   4.690
  262    HG   LEU 114           HG       LEU 114 141.652  -6.964   2.042
  263   1HD1  LEU 114          1HD1      LEU 114 143.254  -4.417   2.225
  264   2HD1  LEU 114          2HD1      LEU 114 141.722  -4.628   1.378
  265   3HD1  LEU 114          3HD1      LEU 114 143.165  -5.475   0.818
  266   1HD2  LEU 114          1HD2      LEU 114 144.288  -6.365   3.368
  267   2HD2  LEU 114          2HD2      LEU 114 143.959  -7.545   2.100
  268   3HD2  LEU 114          3HD2      LEU 114 143.317  -7.793   3.725
  269    H    GLU 115           H        GLU 115 139.529  -7.184   5.946
  270    HA   GLU 115           HA       GLU 115 139.740  -9.849   5.003
  271   1HB   GLU 115          2HB       GLU 115 139.887  -8.832   7.434
  272   2HB   GLU 115          1HB       GLU 115 138.165  -9.185   7.454
  273   1HG   GLU 115          2HG       GLU 115 139.019 -11.538   6.591
  274   2HG   GLU 115          1HG       GLU 115 140.484 -11.027   7.425
  275    H    GLU 116           H        GLU 116 136.880  -8.033   6.127
  276    HA   GLU 116           HA       GLU 116 134.982  -9.924   5.332
  277   1HB   GLU 116          2HB       GLU 116 134.985  -7.255   6.385
  278   2HB   GLU 116          1HB       GLU 116 133.802  -7.361   5.089
  279   1HG   GLU 116          2HG       GLU 116 132.391  -8.242   6.542
  280   2HG   GLU 116          1HG       GLU 116 133.426  -9.669   6.603
  281    H    LEU 117           H        LEU 117 136.585  -7.381   3.538
  282    HA   LEU 117           HA       LEU 117 134.848  -7.460   1.278
  283   1HB   LEU 117          2HB       LEU 117 136.725  -5.724   2.112
  284   2HB   LEU 117          1HB       LEU 117 137.664  -6.607   0.925
  285    HG   LEU 117           HG       LEU 117 135.913  -6.086  -0.773
  286   1HD1  LEU 117          1HD1      LEU 117 134.035  -4.927  -0.324
  287   2HD1  LEU 117          2HD1      LEU 117 134.822  -3.912   0.886
  288   3HD1  LEU 117          3HD1      LEU 117 134.294  -5.542   1.310
  289   1HD2  LEU 117          1HD2      LEU 117 136.845  -3.504   0.401
  290   2HD2  LEU 117          2HD2      LEU 117 136.810  -4.026  -1.284
  291   3HD2  LEU 117          3HD2      LEU 117 138.024  -4.678  -0.184
  292    H    LYS 118           H        LYS 118 137.843  -9.087   2.159
  293    HA   LYS 118           HA       LYS 118 138.429 -10.226  -0.339
  294   1HB   LYS 118          2HB       LYS 118 139.590 -10.236   2.168
  295   2HB   LYS 118          1HB       LYS 118 139.126 -11.916   1.941
  296   1HG   LYS 118          2HG       LYS 118 140.519 -10.570  -0.301
  297   2HG   LYS 118          1HG       LYS 118 141.463 -10.962   1.137
  298   1HD   LYS 118          2HD       LYS 118 140.122 -13.280   0.779
  299   2HD   LYS 118          1HD       LYS 118 140.269 -12.733  -0.892
  300   1HE   LYS 118          2HE       LYS 118 142.760 -12.305  -0.214
  301   2HE   LYS 118          1HE       LYS 118 142.401 -13.462   1.066
  302   1HZ   LYS 118          1HZ       LYS 118 142.191 -13.915  -1.859
  303   2HZ   LYS 118          2HZ       LYS 118 141.642 -15.011  -0.694
  304   3HZ   LYS 118          3HZ       LYS 118 143.289 -14.635  -0.791
  305    H    ILE 119           H        ILE 119 136.143 -11.103   2.131
  306    HA   ILE 119           HA       ILE 119 135.698 -13.779   1.263
  307    HB   ILE 119           HB       ILE 119 133.783 -12.017   2.794
  308   1HG1  ILE 119          2HG1      ILE 119 135.919 -13.866   3.880
  309   2HG1  ILE 119          1HG1      ILE 119 136.043 -12.110   3.839
  310   1HG2  ILE 119          1HG2      ILE 119 133.122 -14.285   3.744
  311   2HG2  ILE 119          2HG2      ILE 119 134.022 -14.984   2.398
  312   3HG2  ILE 119          3HG2      ILE 119 132.637 -13.939   2.084
  313   1HD1  ILE 119          1HD1      ILE 119 134.236 -11.883   5.380
  314   2HD1  ILE 119          2HD1      ILE 119 135.383 -13.051   6.039
  315   3HD1  ILE 119          3HD1      ILE 119 133.883 -13.609   5.297
  316    H    MET 120           H        MET 120 133.754 -10.807   0.892
  317    HA   MET 120           HA       MET 120 131.814 -11.904  -0.798
  318   1HB   MET 120          2HB       MET 120 131.322  -9.562  -1.434
  319   2HB   MET 120          1HB       MET 120 131.458  -9.778   0.305
  320   1HG   MET 120          2HG       MET 120 133.370  -8.554   0.452
  321   2HG   MET 120          1HG       MET 120 133.883  -8.951  -1.187
  322   1HE   MET 120          1HE       MET 120 133.158  -6.429  -3.310
  323   2HE   MET 120          2HE       MET 120 131.634  -7.314  -3.395
  324   3HE   MET 120          3HE       MET 120 133.147  -8.183  -3.131
  325    H    LEU 121           H        LEU 121 135.006 -10.651  -1.463
  326    HA   LEU 121           HA       LEU 121 134.675 -10.459  -4.292
  327   1HB   LEU 121          2HB       LEU 121 137.103 -10.536  -2.512
  328   2HB   LEU 121          1HB       LEU 121 137.216 -10.406  -4.257
  329    HG   LEU 121           HG       LEU 121 135.689  -8.424  -2.579
  330   1HD1  LEU 121          1HD1      LEU 121 138.340  -8.777  -2.284
  331   2HD1  LEU 121          2HD1      LEU 121 137.539  -7.211  -2.155
  332   3HD1  LEU 121          3HD1      LEU 121 138.325  -7.679  -3.664
  333   1HD2  LEU 121          1HD2      LEU 121 136.927  -7.710  -5.156
  334   2HD2  LEU 121          2HD2      LEU 121 135.363  -7.255  -4.480
  335   3HD2  LEU 121          3HD2      LEU 121 135.571  -8.835  -5.236
  336    H    GLN 122           H        GLN 122 135.557 -12.998  -2.081
  337    HA   GLN 122           HA       GLN 122 136.842 -14.745  -3.863
  338   1HB   GLN 122          2HB       GLN 122 135.240 -15.257  -1.358
  339   2HB   GLN 122          1HB       GLN 122 136.077 -16.532  -2.233
  340   1HG   GLN 122          2HG       GLN 122 137.814 -14.282  -1.693
  341   2HG   GLN 122          1HG       GLN 122 137.108 -14.941  -0.218
  342   1HE2  GLN 122          1HE2      GLN 122 137.348 -17.252   0.141
  343   2HE2  GLN 122          2HE2      GLN 122 138.765 -18.050  -0.441
  344    H    ALA 123           H        ALA 123 133.466 -14.055  -3.308
  345    HA   ALA 123           HA       ALA 123 132.380 -16.340  -4.569
  346   1HB   ALA 123          1HB       ALA 123 130.303 -15.263  -4.443
  347   2HB   ALA 123          2HB       ALA 123 131.033 -13.659  -4.495
  348   3HB   ALA 123          3HB       ALA 123 131.203 -14.658  -3.052
  349    H    THR 124           H        THR 124 133.121 -13.081  -5.774
  350    HA   THR 124           HA       THR 124 132.128 -13.401  -8.367
  351    HB   THR 124           HB       THR 124 133.692 -11.556  -8.973
  352    HG1  THR 124           HG1      THR 124 135.382 -12.221  -7.523
  353   1HG2  THR 124          1HG2      THR 124 131.553 -11.421  -7.199
  354   2HG2  THR 124          2HG2      THR 124 132.274 -10.096  -8.113
  355   3HG2  THR 124          3HG2      THR 124 132.825 -10.438  -6.473
  356    H    GLY 125           H        GLY 125 133.139 -13.899 -10.343
  357   1HA   GLY 125          2HA       GLY 125 135.313 -15.841 -10.058
  358   2HA   GLY 125          1HA       GLY 125 134.251 -15.674 -11.448
  359    H    GLU 126           H        GLU 126 135.836 -12.945  -9.939
  360    HA   GLU 126           HA       GLU 126 137.291 -12.484 -12.434
  361   1HB   GLU 126          2HB       GLU 126 136.853 -10.630 -10.085
  362   2HB   GLU 126          1HB       GLU 126 137.590 -10.195 -11.621
  363   1HG   GLU 126          2HG       GLU 126 135.160 -11.270 -12.356
  364   2HG   GLU 126          1HG       GLU 126 134.792 -10.377 -10.881
  365    H    THR 127           H        THR 127 139.424 -11.093 -11.865
  366    HA   THR 127           HA       THR 127 141.018 -12.856 -10.129
  367    HB   THR 127           HB       THR 127 142.945 -12.247 -11.480
  368    HG1  THR 127           HG1      THR 127 141.154 -10.633 -12.971
  369   1HG2  THR 127          1HG2      THR 127 141.724 -12.755 -13.863
  370   2HG2  THR 127          2HG2      THR 127 140.585 -13.439 -12.701
  371   3HG2  THR 127          3HG2      THR 127 142.266 -13.972 -12.708
  372    H    ILE 128           H        ILE 128 140.867 -11.837  -8.172
  373    HA   ILE 128           HA       ILE 128 141.769  -9.035  -8.054
  374    HB   ILE 128           HB       ILE 128 140.237 -10.501  -5.911
  375   1HG1  ILE 128          2HG1      ILE 128 138.897 -10.343  -7.982
  376   2HG1  ILE 128          1HG1      ILE 128 138.240  -9.339  -6.693
  377   1HG2  ILE 128          1HG2      ILE 128 139.829  -8.281  -5.020
  378   2HG2  ILE 128          2HG2      ILE 128 140.727  -7.561  -6.356
  379   3HG2  ILE 128          3HG2      ILE 128 141.561  -8.573  -5.178
  380   1HD1  ILE 128          1HD1      ILE 128 140.078  -8.191  -8.753
  381   2HD1  ILE 128          2HD1      ILE 128 138.898  -7.371  -7.731
  382   3HD1  ILE 128          3HD1      ILE 128 138.354  -8.383  -9.068
  383    H    THR 129           H        THR 129 143.270  -8.423  -6.460
  384    HA   THR 129           HA       THR 129 144.704 -10.636  -5.153
  385    HB   THR 129           HB       THR 129 146.826  -9.611  -5.668
  386    HG1  THR 129           HG1      THR 129 147.009  -7.670  -6.599
  387   1HG2  THR 129          1HG2      THR 129 146.971 -10.434  -7.720
  388   2HG2  THR 129          2HG2      THR 129 145.821  -9.261  -8.360
  389   3HG2  THR 129          3HG2      THR 129 145.239 -10.746  -7.607
  390    H    GLU 130           H        GLU 130 146.151  -9.847  -3.366
  391    HA   GLU 130           HA       GLU 130 144.667  -8.445  -1.460
  392   1HB   GLU 130          2HB       GLU 130 147.483  -9.389  -1.664
  393   2HB   GLU 130          1HB       GLU 130 147.107  -8.214  -0.411
  394   1HG   GLU 130          2HG       GLU 130 145.094 -10.134  -0.240
  395   2HG   GLU 130          1HG       GLU 130 146.582 -11.041  -0.500
  396    H    ASP 131           H        ASP 131 146.985  -7.341  -3.825
  397    HA   ASP 131           HA       ASP 131 147.323  -4.737  -2.672
  398   1HB   ASP 131          2HB       ASP 131 148.362  -6.214  -4.966
  399   2HB   ASP 131          1HB       ASP 131 148.054  -4.520  -5.337
  400    H    ASP 132           H        ASP 132 145.193  -6.198  -5.026
  401    HA   ASP 132           HA       ASP 132 144.168  -3.719  -6.037
  402   1HB   ASP 132          2HB       ASP 132 143.867  -6.527  -6.621
  403   2HB   ASP 132          1HB       ASP 132 142.284  -5.761  -6.525
  404    H    ILE 133           H        ILE 133 143.167  -6.061  -3.596
  405    HA   ILE 133           HA       ILE 133 140.621  -4.959  -3.074
  406    HB   ILE 133           HB       ILE 133 142.372  -6.460  -1.125
  407   1HG1  ILE 133          2HG1      ILE 133 140.239  -7.820  -2.694
  408   2HG1  ILE 133          1HG1      ILE 133 141.739  -7.441  -3.534
  409   1HG2  ILE 133          1HG2      ILE 133 139.839  -7.202  -0.578
  410   2HG2  ILE 133          2HG2      ILE 133 139.572  -5.546  -1.124
  411   3HG2  ILE 133          3HG2      ILE 133 140.666  -5.866   0.222
  412   1HD1  ILE 133          1HD1      ILE 133 142.945  -8.946  -2.340
  413   2HD1  ILE 133          2HD1      ILE 133 141.365  -9.728  -2.268
  414   3HD1  ILE 133          3HD1      ILE 133 141.941  -8.777  -0.900
  415    H    GLU 134           H        GLU 134 143.833  -4.157  -1.958
  416    HA   GLU 134           HA       GLU 134 143.022  -2.527   0.232
  417   1HB   GLU 134          2HB       GLU 134 145.525  -3.228  -1.119
  418   2HB   GLU 134          1HB       GLU 134 145.500  -1.577  -0.513
  419   1HG   GLU 134          2HG       GLU 134 145.010  -2.356   1.714
  420   2HG   GLU 134          1HG       GLU 134 144.890  -4.018   1.138
  421    H    GLU 135           H        GLU 135 143.506  -1.989  -3.185
  422    HA   GLU 135           HA       GLU 135 143.679   0.810  -3.185
  423   1HB   GLU 135          2HB       GLU 135 142.837  -1.235  -5.201
  424   2HB   GLU 135          1HB       GLU 135 142.580   0.470  -5.547
  425   1HG   GLU 135          2HG       GLU 135 145.115   0.637  -4.844
  426   2HG   GLU 135          1HG       GLU 135 145.111  -1.063  -5.310
  427    H    LEU 136           H        LEU 136 140.883  -1.352  -3.256
  428    HA   LEU 136           HA       LEU 136 138.900   0.574  -3.695
  429   1HB   LEU 136          2HB       LEU 136 138.971  -2.162  -2.531
  430   2HB   LEU 136          1HB       LEU 136 137.537  -1.194  -2.240
  431    HG   LEU 136           HG       LEU 136 137.744  -0.864  -4.900
  432   1HD1  LEU 136          1HD1      LEU 136 139.312  -3.277  -4.222
  433   2HD1  LEU 136          2HD1      LEU 136 139.451  -2.178  -5.593
  434   3HD1  LEU 136          3HD1      LEU 136 138.187  -3.408  -5.574
  435   1HD2  LEU 136          1HD2      LEU 136 135.833  -2.076  -4.998
  436   2HD2  LEU 136          2HD2      LEU 136 135.964  -1.971  -3.242
  437   3HD2  LEU 136          3HD2      LEU 136 136.509  -3.423  -4.080
  438    H    MET 137           H        MET 137 140.415  -0.560  -0.714
  439    HA   MET 137           HA       MET 137 138.719   0.998   0.994
  440   1HB   MET 137          2HB       MET 137 141.394  -0.248   1.642
  441   2HB   MET 137          1HB       MET 137 140.171   0.274   2.790
  442   1HG   MET 137          2HG       MET 137 138.874  -1.523   1.093
  443   2HG   MET 137          1HG       MET 137 140.451  -2.238   1.425
  444   1HE   MET 137          1HE       MET 137 137.182  -1.059   4.325
  445   2HE   MET 137          2HE       MET 137 136.766  -2.287   3.128
  446   3HE   MET 137          3HE       MET 137 137.343  -0.704   2.605
  447    H    LYS 138           H        LYS 138 141.719   1.510  -0.686
  448    HA   LYS 138           HA       LYS 138 142.818   3.594   0.796
  449   1HB   LYS 138          2HB       LYS 138 143.524   2.293  -1.475
  450   2HB   LYS 138          1HB       LYS 138 143.014   3.837  -2.144
  451   1HG   LYS 138          2HG       LYS 138 144.584   4.994  -0.666
  452   2HG   LYS 138          1HG       LYS 138 145.101   3.440  -0.009
  453   1HD   LYS 138          2HD       LYS 138 145.452   2.953  -2.621
  454   2HD   LYS 138          1HD       LYS 138 145.704   4.700  -2.617
  455   1HE   LYS 138          2HE       LYS 138 147.200   4.027  -0.496
  456   2HE   LYS 138          1HE       LYS 138 147.333   2.536  -1.429
  457   1HZ   LYS 138          1HZ       LYS 138 148.525   3.545  -3.043
  458   2HZ   LYS 138          2HZ       LYS 138 148.946   4.592  -1.784
  459   3HZ   LYS 138          3HZ       LYS 138 147.734   5.033  -2.877
  460    H    ASP 139           H        ASP 139 140.842   3.923  -2.160
  461    HA   ASP 139           HA       ASP 139 140.395   6.712  -1.675
  462   1HB   ASP 139          2HB       ASP 139 139.163   6.715  -3.716
  463   2HB   ASP 139          1HB       ASP 139 140.536   5.641  -3.956
  464    H    GLY 140           H        GLY 140 138.855   3.814  -0.685
  465   1HA   GLY 140          2HA       GLY 140 136.221   4.893  -0.353
  466   2HA   GLY 140          1HA       GLY 140 136.820   3.384   0.318
  467    H    ASP 141           H        ASP 141 139.100   4.753   1.614
  468    HA   ASP 141           HA       ASP 141 137.735   5.456   4.052
  469   1HB   ASP 141          2HB       ASP 141 140.036   4.185   3.657
  470   2HB   ASP 141          1HB       ASP 141 140.680   5.820   3.751
  471    H    LYS 142           H        LYS 142 137.706   7.436   5.078
  472    HA   LYS 142           HA       LYS 142 138.528   9.728   3.420
  473   1HB   LYS 142          2HB       LYS 142 136.315   9.691   5.474
  474   2HB   LYS 142          1HB       LYS 142 136.694  10.986   4.346
  475   1HG   LYS 142          2HG       LYS 142 135.735   8.241   3.565
  476   2HG   LYS 142          1HG       LYS 142 134.721   9.681   3.680
  477   1HD   LYS 142          2HD       LYS 142 137.133   9.985   2.027
  478   2HD   LYS 142          1HD       LYS 142 135.945   8.837   1.408
  479   1HE   LYS 142          2HE       LYS 142 134.384  10.446   1.029
  480   2HE   LYS 142          1HE       LYS 142 134.926  11.444   2.377
  481   1HZ   LYS 142          1HZ       LYS 142 137.007  11.753   0.866
  482   2HZ   LYS 142          2HZ       LYS 142 135.617  12.678   0.600
  483   3HZ   LYS 142          3HZ       LYS 142 135.936  11.334  -0.375
  484    H    ASN 143           H        ASN 143 138.443   8.370   6.655
  485    HA   ASN 143           HA       ASN 143 140.227  10.538   7.551
  486   1HB   ASN 143          2HB       ASN 143 139.442   9.830   9.889
  487   2HB   ASN 143          1HB       ASN 143 138.294  10.710   8.884
  488   1HD2  ASN 143          1HD2      ASN 143 136.758   9.369   7.642
  489   2HD2  ASN 143          2HD2      ASN 143 136.150   7.932   8.386
  490    H    ASN 144           H        ASN 144 140.862   7.952   6.197
  491    HA   ASN 144           HA       ASN 144 142.229   6.129   6.398
  492   1HB   ASN 144          2HB       ASN 144 144.432   6.673   7.302
  493   2HB   ASN 144          1HB       ASN 144 143.811   8.013   6.345
  494   1HD2  ASN 144          1HD2      ASN 144 144.953   6.998   9.378
  495   2HD2  ASN 144          2HD2      ASN 144 144.740   8.489  10.222
  496    H    ASP 145           H        ASP 145 140.221   5.531   7.970
  497    HA   ASP 145           HA       ASP 145 141.162   4.978  10.668
  498   1HB   ASP 145          2HB       ASP 145 138.879   4.155  11.068
  499   2HB   ASP 145          1HB       ASP 145 138.863   5.776  10.379
  500    H    GLY 146           H        GLY 146 140.598   3.336   7.644
  501   1HA   GLY 146          2HA       GLY 146 141.944   1.321   7.266
  502   2HA   GLY 146          1HA       GLY 146 141.542   0.835   8.906
  503    H    ARG 147           H        ARG 147 138.725   1.823   8.446
  504    HA   ARG 147           HA       ARG 147 137.794  -0.343   6.686
  505   1HB   ARG 147          2HB       ARG 147 136.525   0.441   9.316
  506   2HB   ARG 147          1HB       ARG 147 136.007  -0.857   8.248
  507   1HG   ARG 147          2HG       ARG 147 138.212  -1.957   8.637
  508   2HG   ARG 147          1HG       ARG 147 138.553  -0.717   9.843
  509   1HD   ARG 147          2HD       ARG 147 136.047  -1.613  10.555
  510   2HD   ARG 147          1HD       ARG 147 136.858  -3.081  10.014
  511    HE   ARG 147           HE       ARG 147 137.425  -1.557  12.381
  512   1HH1  ARG 147          1HH1      ARG 147 138.729  -3.797  10.046
  513   2HH1  ARG 147          2HH1      ARG 147 139.941  -4.408  11.122
  514   1HH2  ARG 147          1HH2      ARG 147 139.018  -2.357  13.798
  515   2HH2  ARG 147          2HH2      ARG 147 140.105  -3.591  13.252
  516    H    ILE 148           H        ILE 148 135.317  -0.044   6.305
  517    HA   ILE 148           HA       ILE 148 134.773   2.815   5.830
  518    HB   ILE 148           HB       ILE 148 133.953   0.583   3.974
  519   1HG1  ILE 148          2HG1      ILE 148 136.238   2.548   3.686
  520   2HG1  ILE 148          1HG1      ILE 148 136.406   0.823   3.998
  521   1HG2  ILE 148          1HG2      ILE 148 132.480   2.436   3.789
  522   2HG2  ILE 148          2HG2      ILE 148 133.582   2.519   2.414
  523   3HG2  ILE 148          3HG2      ILE 148 133.818   3.585   3.799
  524   1HD1  ILE 148          1HD1      ILE 148 135.509   0.287   1.849
  525   2HD1  ILE 148          2HD1      ILE 148 136.795   1.475   1.641
  526   3HD1  ILE 148          3HD1      ILE 148 135.107   1.977   1.544
  527    H    ASP 149           H        ASP 149 132.744   3.531   6.276
  528    HA   ASP 149           HA       ASP 149 130.708   1.544   7.003
  529   1HB   ASP 149          2HB       ASP 149 130.092   2.840   8.986
  530   2HB   ASP 149          1HB       ASP 149 131.773   2.324   9.079
  531    H    TYR 150           H        TYR 150 128.641   3.115   7.690
  532    HA   TYR 150           HA       TYR 150 127.576   3.962   5.274
  533   1HB   TYR 150          2HB       TYR 150 126.298   3.403   7.363
  534   2HB   TYR 150          1HB       TYR 150 126.749   4.982   7.995
  535    HD1  TYR 150           HD1      TYR 150 125.161   6.635   7.806
  536    HD2  TYR 150           HD2      TYR 150 125.271   3.570   4.860
  537    HE1  TYR 150           HE1      TYR 150 123.208   7.639   6.699
  538    HE2  TYR 150           HE2      TYR 150 123.319   4.564   3.743
  539    HH   TYR 150           HH       TYR 150 122.148   6.637   3.580
  540    H    ASP 151           H        ASP 151 129.085   5.897   7.838
  541    HA   ASP 151           HA       ASP 151 128.625   8.422   6.735
  542   1HB   ASP 151          2HB       ASP 151 130.597   7.304   8.674
  543   2HB   ASP 151          1HB       ASP 151 130.895   8.912   8.023
  544    H    GLU 152           H        GLU 152 131.443   6.278   6.377
  545    HA   GLU 152           HA       GLU 152 132.820   8.006   4.591
  546   1HB   GLU 152          2HB       GLU 152 133.157   5.033   5.021
  547   2HB   GLU 152          1HB       GLU 152 134.299   6.087   4.198
  548   1HG   GLU 152          2HG       GLU 152 134.756   7.275   6.227
  549   2HG   GLU 152          1HG       GLU 152 133.482   6.401   7.076
  550    H    PHE 153           H        PHE 153 130.782   5.145   4.120
  551    HA   PHE 153           HA       PHE 153 131.099   4.909   1.349
  552   1HB   PHE 153          2HB       PHE 153 129.842   3.422   3.190
  553   2HB   PHE 153          1HB       PHE 153 128.445   4.257   2.518
  554    HD1  PHE 153           HD1      PHE 153 127.950   4.046   0.083
  555    HD2  PHE 153           HD2      PHE 153 130.901   1.674   2.022
  556    HE1  PHE 153           HE1      PHE 153 127.897   2.455  -1.794
  557    HE2  PHE 153           HE2      PHE 153 130.856   0.078   0.150
  558    HZ   PHE 153           HZ       PHE 153 129.352   0.468  -1.761
  559    H    LEU 154           H        LEU 154 129.084   7.018   3.271
  560    HA   LEU 154           HA       LEU 154 127.375   7.850   1.150
  561   1HB   LEU 154          2HB       LEU 154 127.790   8.504   3.959
  562   2HB   LEU 154          1HB       LEU 154 127.403   9.917   2.996
  563    HG   LEU 154           HG       LEU 154 125.337   8.891   2.242
  564   1HD1  LEU 154          1HD1      LEU 154 124.633   6.735   2.816
  565   2HD1  LEU 154          2HD1      LEU 154 125.876   6.563   4.055
  566   3HD1  LEU 154          3HD1      LEU 154 126.322   6.539   2.349
  567   1HD2  LEU 154          1HD2      LEU 154 124.156   8.778   4.396
  568   2HD2  LEU 154          2HD2      LEU 154 125.260  10.151   4.312
  569   3HD2  LEU 154          3HD2      LEU 154 125.708   8.713   5.230
  570    H    GLU 155           H        GLU 155 130.318   9.186   2.606
  571    HA   GLU 155           HA       GLU 155 130.350  11.496   0.918
  572   1HB   GLU 155          2HB       GLU 155 132.228  10.277   2.897
  573   2HB   GLU 155          1HB       GLU 155 132.840  11.495   1.787
  574   1HG   GLU 155          2HG       GLU 155 130.610  12.723   2.677
  575   2HG   GLU 155          1HG       GLU 155 131.040  11.764   4.093
  576    H    PHE 156           H        PHE 156 131.950   8.349   0.890
  577    HA   PHE 156           HA       PHE 156 133.714   8.852  -1.242
  578   1HB   PHE 156          2HB       PHE 156 133.970   6.927   0.252
  579   2HB   PHE 156          1HB       PHE 156 132.468   6.239  -0.359
  580    HD1  PHE 156           HD1      PHE 156 132.757   4.467  -1.770
  581    HD2  PHE 156           HD2      PHE 156 135.602   7.631  -1.846
  582    HE1  PHE 156           HE1      PHE 156 134.009   3.294  -3.532
  583    HE2  PHE 156           HE2      PHE 156 136.859   6.462  -3.609
  584    HZ   PHE 156           HZ       PHE 156 136.061   4.290  -4.455
  585    H    MET 157           H        MET 157 130.465   7.410  -1.196
  586    HA   MET 157           HA       MET 157 130.309   6.964  -3.980
  587   1HB   MET 157          2HB       MET 157 128.390   7.008  -1.713
  588   2HB   MET 157          1HB       MET 157 127.718   7.176  -3.329
  589   1HG   MET 157          2HG       MET 157 129.565   4.944  -2.534
  590   2HG   MET 157          1HG       MET 157 127.809   4.842  -2.419
  591   1HE   MET 157          1HE       MET 157 129.465   2.827  -5.624
  592   2HE   MET 157          2HE       MET 157 128.727   2.522  -4.051
  593   3HE   MET 157          3HE       MET 157 130.307   3.298  -4.147
  594    H    LYS 158           H        LYS 158 129.239   9.649  -1.933
  595    HA   LYS 158           HA       LYS 158 128.207  11.132  -4.183
  596   1HB   LYS 158          2HB       LYS 158 127.595  11.156  -1.554
  597   2HB   LYS 158          1HB       LYS 158 128.704  12.519  -1.614
  598   1HG   LYS 158          2HG       LYS 158 126.818  12.650  -3.785
  599   2HG   LYS 158          1HG       LYS 158 125.986  12.509  -2.236
  600   1HD   LYS 158          2HD       LYS 158 128.235  14.396  -2.250
  601   2HD   LYS 158          1HD       LYS 158 126.895  14.842  -3.307
  602   1HE   LYS 158          2HE       LYS 158 125.614  15.418  -1.577
  603   2HE   LYS 158          1HE       LYS 158 125.958  13.910  -0.731
  604   1HZ   LYS 158          1HZ       LYS 158 128.254  15.197  -0.385
  605   2HZ   LYS 158          2HZ       LYS 158 126.962  15.302   0.702
  606   3HZ   LYS 158          3HZ       LYS 158 127.200  16.520  -0.448
  607    H    GLY 159           H        GLY 159 130.272  11.041  -5.378
  608   1HA   GLY 159          2HA       GLY 159 131.733  12.719  -6.275
  609   2HA   GLY 159          1HA       GLY 159 131.936  13.358  -4.650
  610    H    VAL 160           H        VAL 160 132.640  10.536  -6.679
  611    HA   VAL 160           HA       VAL 160 134.731   9.653  -4.878
  612    HB   VAL 160           HB       VAL 160 134.060   8.564  -7.614
  613   1HG1  VAL 160          1HG1      VAL 160 136.249   8.057  -6.118
  614   2HG1  VAL 160          2HG1      VAL 160 135.514   6.888  -7.215
  615   3HG1  VAL 160          3HG1      VAL 160 135.142   6.834  -5.492
  616   1HG2  VAL 160          1HG2      VAL 160 133.126   7.272  -5.095
  617   2HG2  VAL 160          2HG2      VAL 160 132.456   7.183  -6.724
  618   3HG2  VAL 160          3HG2      VAL 160 132.213   8.632  -5.749
  619    H    GLU 161           H        GLU 161 135.537  12.055  -5.447
  620    HA   GLU 161           HA       GLU 161 137.452  11.835  -7.672
  621   1HB   GLU 161          2HB       GLU 161 136.435  14.324  -6.287
  622   2HB   GLU 161          1HB       GLU 161 137.551  14.284  -7.646
  623   1HG   GLU 161          2HG       GLU 161 135.812  13.274  -9.040
  624   2HG   GLU 161          1HG       GLU 161 134.695  13.334  -7.677