*HEADER    CONTRACTILE PROTEIN, STRUCTURAL PROTEIN 10-FEB-04   1SBJ              
*TITLE     NMR STRUCTURE OF THE MG2+-LOADED C TERMINAL DOMAIN OF                 
*TITLE    2 CARDIAC TROPONIN C BOUND TO THE N TERMINAL DOMAIN OF                 
*TITLE    3 CARDIAC TROPONIN I                                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TROPONIN C, SLOW SKELETAL AND CARDIAC MUSCLES;             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: C-TERMINAL DOMAIN (RESIDUES 81 - 161);                     
*COMPND   5 SYNONYM: TN-C;                                                       
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                                  
*SOURCE   3 ORGANISM_COMMON: CHICKEN;                                            
*SOURCE   4 GENE: CTNC;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET-23D+                                  
*KEYWDS    TROPONIN C-TROPONIN I INTERACTION, CARDIAC, MUSCLE PROTEIN,           
*KEYWDS   2 2 MAGNESIUM BINDING PROTEIN                                          
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    N.L.FINLEY, J.W.HOWARTH, P.R.ROSEVEAR                                 
*REVDAT   1   23-NOV-04 1SBJ    0                                                
! Ca site III
! removed because MG is attached to D105
!!!!assi (resi 105 and name OD*)   (resi 162 and name MAG) 3.8 2.0 0.8
assi (resi 107 and name OD1)   (resi 162 and name MAG) 2.5  0.8  0.3
assi (resi 109 and name OD*)   (resi 162 and name MAG) 3.0 1.2 0.6
assi (resi 111 and name O)   (resi 162 and name MAG)   2.5  0.8  0.3
! intervening H20 is ligand from D113
!!!assi (resi 113 and name OD*)   (resi 162 and name MAG) 4.0 3.0 2.0
!assi (resi 116 and name OE1)   (resi 162 and name MAG)  3.0 1.2 0.6
assi (resi 116 and name OE2)   (resi 162 and name MAG) 2.5  0.8  0.3

! Ca site IV
! removed because MG is attached to D141
!!!!assi (resi 141 and name OD*)   (resi 163 and name MAG) 3.8 2.0 0.8
assi (resi 143 and name OD1)   (resi 163 and name MAG) 2.5  0.8  0.3
assi (resi 145 and name OD*)   (resi 163 and name MAG) 3.0 1.2 0.6
assi (resi 147 and name O)   (resi 163 and name MAG)  2.5  0.8  0.3
! intervening H20 is ligand from D149
!!!assi (resi 149 and name  )   (resi 163 and name MAG) 3.8 2.0 0.8
!assi (resi 152 and name  OE1)   (resi 163 and name MAG) 3.0 1.2 0.6 
assi (resi 152 and name  OE2)   (resi 163 and name MAG) 2.5  0.8  0.3

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)     4.0  2.2  1.2 
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 102 and name HA)  (resi 105 and name HA)   4.8  3.0  1.0
assi (resi 104 and name HA)  (resi 103 and name HA)   4.8  3.0  1.0
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 112 and name HA)   4.8  3.0  1.0
assi (resi 113 and name HA)  (resi 114 and name HA)   4.8  3.0  1.0
assi (resi 114 and name HA)  (resi 115 and name HA)   4.8  3.0  1.0
assi (resi 115 and name HA)  (resi 116 and name HA)   4.8  3.0  1.0
assi (resi 116 and name HA)  (resi 118 and name HA)   6.8  5.0  1.4 
assi (resi 116 and name HA)  (resi 119 and name HA)   5.8  4.0  1.2 
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 140 and name HA#) (resi 153 and name HA)   5.8  4.0  1.2
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 141 and name HA) (resi 142 and name HA)   4.8  3.0  1.0
assi (resi 141 and name HA) (resi 148 and name HA)    3.8  2.0  0.8
assi (resi 141 and name HA) (resi 152 and name HA)   5.8  4.0  1.2 
assi (resi 135 and name HA)  (resi 132 and name HA)   5.8  4.0  1.2
assi (resi 135 and name HA)  (resi 136 and name HA)   4.8  3.0  1.0
assi (resi 136 and name HA)  (resi 137 and name HA)   4.8  3.0  1.0
assi (resi 137 and name HA)  (resi 138 and name HA)   4.8  3.0  1.0
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
assi (resi 105 and name HA)  (resi 108 and name HA)   4.8  3.0  1.0
assi (resi 105 and name HA)  (resi 117 and name HA)   5.8  4.0  1.2  

!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 101 and name HA)  (resi 153 and name HB#)  5.8  4.0  1.2
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 107 and name HA)  (resi 108 and name HB#)  4.8  3.0  1.0 
assi (resi 108 and name HA)  (resi 108 and name HB#)  3.0  1.2  0.6 
assi (resi 109 and name HA)  (resi 107 and name HB#)  5.8  4.0  1.2 
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 113 and name HA)  (resi 114 and name HB#)  5.8  4.0  1.2 
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 140 and name HA1#)(resi 156 and name HB#)  4.8  3.0  1.0 
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 103 and name HA)  (resi 103 and name HG#)  3.0  1.2  0.6 
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 114 and name HA)  (resi 137 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 113 and name HA)  (resi 147 and name HD#)  3.8  2.0  0.8  
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 104 and name HZ)  (resi 136 and name HD2#) 4.8  3.0  1.0
assi (resi 104 and name HZ)  (resi 117 and name HD#)  5.8  4.0  1.2
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 HA#)  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 95 and name HA)    3.8  2.0  0.8
assi (resi 150 and name HE#) (resi 97 and name HB#)   5.8  4.0  1.2  
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 139 and name HB#)  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 HD#) (resi 153 and name HA)   4.8  3.0  1.0
assi (resi 156 and name HD#) (resi 156 and name HA)   3.8  2.0  0.8
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
assi (resi 156 and name HZ)  (resi 148 and name HD1#) 4.8  3.0  1.0

!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 107 and name HB#) (resi 116 and name HG#)  5.8  4.0  1.2
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 
assi (resi 124 and name HG2#) (resi 123 and name HB#) 4.8  3.0  1.0 

!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 137 and name HG#)  (resi 114 and name HB#)  5.8  4.0  1.2
assi (resi 137 and name HG#)  (resi 114 and name HD#)  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
assi (resi 128 and name HD# )  (resi 124 and name HG2#) 5.8  4.0  1.2

!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)   4.8  3.0  1.0 
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 148 and name HD#)   (resi 137 and name HG#)  4.8  3.0  1.0
assi (resi 148 and name HD#)  ( resi 137 and name HE#)  3.8  2.0  0.8  
assi (resi 119 and name HG2#)  (resi 106 and name HB#)  4.8  3.0  1.0




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET  81          1HT       MET  81  94.205 -13.364   6.533
    2   2H    MET  81          2HT       MET  81  94.824 -12.076   5.584
    3   3H    MET  81          3HT       MET  81  94.065 -13.414   4.824
    4    HA   MET  81           HA       MET  81  92.735 -11.349   4.987
    5   1HB   MET  81          2HB       MET  81  92.031 -14.115   5.761
    6   2HB   MET  81          1HB       MET  81  90.821 -12.895   6.136
    7   1HG   MET  81          2HG       MET  81  90.295 -12.556   3.979
    8   2HG   MET  81          1HG       MET  81  91.956 -12.764   3.428
    9   1HE   MET  81          1HE       MET  81  89.607 -14.262   1.517
   10   2HE   MET  81          2HE       MET  81  90.840 -15.486   1.214
   11   3HE   MET  81          3HE       MET  81  91.306 -13.797   1.425
   12    H    VAL  82           H        VAL  82  92.905 -13.197   8.037
   13    HA   VAL  82           HA       VAL  82  92.009 -10.810   9.480
   14    HB   VAL  82           HB       VAL  82  90.795 -12.898   9.933
   15   1HG1  VAL  82          1HG1      VAL  82  91.880 -14.734  11.124
   16   2HG1  VAL  82          2HG1      VAL  82  93.431 -13.907  10.992
   17   3HG1  VAL  82          3HG1      VAL  82  92.611 -14.477   9.540
   18   1HG2  VAL  82          1HG2      VAL  82  91.094 -11.127  11.675
   19   2HG2  VAL  82          2HG2      VAL  82  92.417 -12.087  12.338
   20   3HG2  VAL  82          3HG2      VAL  82  90.780 -12.740  12.315
   21    H    ARG  83           H        ARG  83  94.653 -13.144   9.349
   22    HA   ARG  83           HA       ARG  83  96.355 -11.211  10.736
   23   1HB   ARG  83          2HB       ARG  83  95.435 -13.689  11.869
   24   2HB   ARG  83          1HB       ARG  83  97.178 -13.755  11.652
   25   1HG   ARG  83          2HG       ARG  83  97.573 -12.210  13.243
   26   2HG   ARG  83          1HG       ARG  83  96.129 -11.276  12.847
   27   1HD   ARG  83          2HD       ARG  83  94.885 -12.334  14.381
   28   2HD   ARG  83          1HD       ARG  83  95.551 -13.912  13.965
   29    HE   ARG  83           HE       ARG  83  97.576 -12.732  15.309
   30   1HH1  ARG  83          1HH1      ARG  83  94.196 -13.208  16.041
   31   2HH1  ARG  83          2HH1      ARG  83  94.449 -13.286  17.751
   32   1HH2  ARG  83          1HH2      ARG  83  97.910 -12.836  17.559
   33   2HH2  ARG  83          2HH2      ARG  83  96.558 -13.074  18.614
   34    H    CYS  84           H        CYS  84  96.251 -14.352   9.072
   35    HA   CYS  84           HA       CYS  84  98.980 -14.047   8.151
   36   1HB   CYS  84          2HB       CYS  84  96.947 -16.195   8.155
   37   2HB   CYS  84          1HB       CYS  84  98.053 -16.198   6.786
   38    HG   CYS  84           HG       CYS  84  99.442 -17.495   8.358
   39    H    MET  85           H        MET  85  99.366 -12.686   6.533
   40    HA   MET  85           HA       MET  85  98.015 -13.024   4.015
   41   1HB   MET  85          2HB       MET  85  96.684 -11.344   5.547
   42   2HB   MET  85          1HB       MET  85  97.949 -10.223   5.062
   43   1HG   MET  85          2HG       MET  85  96.064  -9.966   3.610
   44   2HG   MET  85          1HG       MET  85  97.401 -10.671   2.702
   45   1HE   MET  85          1HE       MET  85  95.224 -10.548   1.336
   46   2HE   MET  85          2HE       MET  85  93.851 -11.644   1.495
   47   3HE   MET  85          3HE       MET  85  95.298 -12.163   0.631
   48    H    LYS  86           H        LYS  86  99.408 -12.684   2.399
   49    HA   LYS  86           HA       LYS  86 101.303 -12.130   1.273
   50   1HB   LYS  86          2HB       LYS  86 100.434  -9.780   2.565
   51   2HB   LYS  86          1HB       LYS  86 102.178  -9.842   2.789
   52   1HG   LYS  86          2HG       LYS  86 102.548  -9.938   0.433
   53   2HG   LYS  86          1HG       LYS  86 100.823 -10.136   0.118
   54   1HD   LYS  86          2HD       LYS  86 100.384  -7.906   0.972
   55   2HD   LYS  86          1HD       LYS  86 102.088  -7.708   1.391
   56   1HE   LYS  86          2HE       LYS  86 102.731  -7.739  -0.904
   57   2HE   LYS  86          1HE       LYS  86 101.115  -8.225  -1.412
   58   1HZ   LYS  86          1HZ       LYS  86 100.554  -5.964  -0.149
   59   2HZ   LYS  86          2HZ       LYS  86 100.923  -6.027  -1.798
   60   3HZ   LYS  86          3HZ       LYS  86 102.119  -5.596  -0.681
   61    H    ASP  87           H        ASP  87 103.738 -11.232   1.857
   62    HA   ASP  87           HA       ASP  87 104.705 -13.203   3.790
   63   1HB   ASP  87          2HB       ASP  87 106.935 -12.746   2.732
   64   2HB   ASP  87          1HB       ASP  87 105.725 -13.383   1.623
   65    H    ASP  88           H        ASP  88 106.614 -12.587   5.124
   66    HA   ASP  88           HA       ASP  88 106.013 -10.395   6.766
   67   1HB   ASP  88          2HB       ASP  88 107.637 -12.588   6.977
   68   2HB   ASP  88          1HB       ASP  88 108.815 -11.288   6.830
   69    H    SER  89           H        SER  89 106.319  -8.302   6.444
   70    HA   SER  89           HA       SER  89 108.580  -7.449   4.757
   71   1HB   SER  89          2HB       SER  89 106.326  -7.222   3.637
   72   2HB   SER  89          1HB       SER  89 105.904  -6.045   4.882
   73    HG   SER  89           HG       SER  89 106.711  -4.876   3.211
   74    H    LYS  90           H        LYS  90 109.721  -7.253   6.806
   75    HA   LYS  90           HA       LYS  90 108.881  -5.539   8.878
   76   1HB   LYS  90          2HB       LYS  90 111.172  -7.136   8.267
   77   2HB   LYS  90          1HB       LYS  90 111.722  -5.540   8.758
   78   1HG   LYS  90          2HG       LYS  90 111.619  -6.516  10.797
   79   2HG   LYS  90          1HG       LYS  90 109.953  -5.943  10.694
   80   1HD   LYS  90          2HD       LYS  90 109.779  -8.176  11.398
   81   2HD   LYS  90          1HD       LYS  90 109.414  -8.219   9.672
   82   1HE   LYS  90          2HE       LYS  90 112.243  -8.518  10.122
   83   2HE   LYS  90          1HE       LYS  90 111.339  -9.716  11.047
   84   1HZ   LYS  90          1HZ       LYS  90 111.127  -9.233   8.124
   85   2HZ   LYS  90          2HZ       LYS  90 110.190 -10.340   8.993
   86   3HZ   LYS  90          3HZ       LYS  90 111.861 -10.563   8.869
   87    H    GLY  91           H        GLY  91 110.596  -3.656   9.464
   88   1HA   GLY  91          2HA       GLY  91 110.030  -1.593   7.565
   89   2HA   GLY  91          1HA       GLY  91 110.944  -1.412   9.054
   90    H    LYS  92           H        LYS  92 113.035  -0.975   8.853
   91    HA   LYS  92           HA       LYS  92 114.261  -1.150   6.224
   92   1HB   LYS  92          2HB       LYS  92 115.241   0.046   8.821
   93   2HB   LYS  92          1HB       LYS  92 116.132   0.098   7.306
   94   1HG   LYS  92          2HG       LYS  92 114.291   1.362   6.285
   95   2HG   LYS  92          1HG       LYS  92 113.443   1.346   7.833
   96   1HD   LYS  92          2HD       LYS  92 116.166   2.555   7.343
   97   2HD   LYS  92          1HD       LYS  92 114.653   3.457   7.445
   98   1HE   LYS  92          2HE       LYS  92 114.970   3.611   9.640
   99   2HE   LYS  92          1HE       LYS  92 114.735   1.867   9.745
  100   1HZ   LYS  92          1HZ       LYS  92 117.183   3.418   9.880
  101   2HZ   LYS  92          2HZ       LYS  92 117.285   1.978   8.999
  102   3HZ   LYS  92          3HZ       LYS  92 116.791   1.945  10.616
  103    H    THR  93           H        THR  93 115.297  -2.935   5.638
  104    HA   THR  93           HA       THR  93 116.638  -4.534   7.715
  105    HB   THR  93           HB       THR  93 114.815  -5.708   6.547
  106    HG1  THR  93           HG1      THR  93 116.053  -7.516   5.941
  107   1HG2  THR  93          1HG2      THR  93 116.460  -5.542   4.043
  108   2HG2  THR  93          2HG2      THR  93 115.077  -4.497   4.363
  109   3HG2  THR  93          3HG2      THR  93 114.855  -6.243   4.253
  110    H    GLU  94           H        GLU  94 118.253  -6.097   6.147
  111    HA   GLU  94           HA       GLU  94 120.520  -4.522   5.801
  112   1HB   GLU  94          2HB       GLU  94 119.755  -7.276   4.915
  113   2HB   GLU  94          1HB       GLU  94 121.254  -6.568   4.330
  114   1HG   GLU  94          2HG       GLU  94 122.172  -7.424   6.164
  115   2HG   GLU  94          1HG       GLU  94 121.401  -6.083   7.013
  116    H    GLU  95           H        GLU  95 118.343  -5.855   3.323
  117    HA   GLU  95           HA       GLU  95 119.512  -5.018   1.024
  118   1HB   GLU  95          2HB       GLU  95 117.375  -6.288   1.202
  119   2HB   GLU  95          1HB       GLU  95 116.554  -4.783   1.591
  120   1HG   GLU  95          2HG       GLU  95 117.450  -3.911  -0.624
  121   2HG   GLU  95          1HG       GLU  95 117.842  -5.590  -0.991
  122    H    GLU  96           H        GLU  96 117.936  -3.014   3.398
  123    HA   GLU  96           HA       GLU  96 117.462  -0.707   1.914
  124   1HB   GLU  96          2HB       GLU  96 118.311  -0.962   4.804
  125   2HB   GLU  96          1HB       GLU  96 117.682   0.507   4.073
  126   1HG   GLU  96          2HG       GLU  96 116.125  -2.051   4.049
  127   2HG   GLU  96          1HG       GLU  96 116.074  -0.941   5.417
  128    H    LEU  97           H        LEU  97 120.440  -2.011   3.178
  129    HA   LEU  97           HA       LEU  97 122.016   0.329   2.937
  130   1HB   LEU  97          2HB       LEU  97 122.447  -2.506   3.486
  131   2HB   LEU  97          1HB       LEU  97 123.763  -1.780   2.584
  132    HG   LEU  97           HG       LEU  97 122.710  -0.602   5.149
  133   1HD1  LEU  97          1HD1      LEU  97 125.264  -2.093   5.124
  134   2HD1  LEU  97          2HD1      LEU  97 123.780  -3.048   5.106
  135   3HD1  LEU  97          3HD1      LEU  97 124.073  -1.896   6.410
  136   1HD2  LEU  97          1HD2      LEU  97 125.420  -0.274   3.899
  137   2HD2  LEU  97          2HD2      LEU  97 124.650   0.715   5.141
  138   3HD2  LEU  97          3HD2      LEU  97 124.061   0.770   3.478
  139    H    SER  98           H        SER  98 120.666  -1.731   0.598
  140    HA   SER  98           HA       SER  98 122.616  -1.714  -1.410
  141   1HB   SER  98          2HB       SER  98 120.839  -2.273  -2.939
  142   2HB   SER  98          1HB       SER  98 120.509  -3.084  -1.410
  143    HG   SER  98           HG       SER  98 119.154  -1.165  -0.953
  144    H    ASP  99           H        ASP  99 120.256   0.686  -0.436
  145    HA   ASP  99           HA       ASP  99 120.549   2.378  -2.700
  146   1HB   ASP  99          2HB       ASP  99 118.657   2.349  -0.948
  147   2HB   ASP  99          1HB       ASP  99 119.738   3.328   0.040
  148    H    LEU 100           H        LEU 100 122.282   2.002   0.301
  149    HA   LEU 100           HA       LEU 100 123.737   4.476   0.040
  150   1HB   LEU 100          2HB       LEU 100 123.903   2.127   1.903
  151   2HB   LEU 100          1HB       LEU 100 125.140   3.369   1.904
  152    HG   LEU 100           HG       LEU 100 122.331   4.289   2.143
  153   1HD1  LEU 100          1HD1      LEU 100 123.795   2.990   4.436
  154   2HD1  LEU 100          2HD1      LEU 100 122.387   2.321   3.612
  155   3HD1  LEU 100          3HD1      LEU 100 122.245   3.826   4.518
  156   1HD2  LEU 100          1HD2      LEU 100 123.469   5.790   3.820
  157   2HD2  LEU 100          2HD2      LEU 100 124.010   5.958   2.151
  158   3HD2  LEU 100          3HD2      LEU 100 124.993   5.065   3.311
  159    H    PHE 101           H        PHE 101 124.196   1.124  -0.823
  160    HA   PHE 101           HA       PHE 101 126.981   1.212  -1.283
  161   1HB   PHE 101          2HB       PHE 101 125.689  -0.890  -1.061
  162   2HB   PHE 101          1HB       PHE 101 124.916  -0.560  -2.608
  163    HD1  PHE 101           HD1      PHE 101 128.475  -0.159  -1.608
  164    HD2  PHE 101           HD2      PHE 101 125.655  -2.242  -4.020
  165    HE1  PHE 101           HE1      PHE 101 130.317  -1.303  -2.767
  166    HE2  PHE 101           HE2      PHE 101 127.494  -3.392  -5.182
  167    HZ   PHE 101           HZ       PHE 101 129.828  -2.922  -4.557
  168    H    ARG 102           H        ARG 102 124.191   1.762  -3.399
  169    HA   ARG 102           HA       ARG 102 125.617   2.083  -5.795
  170   1HB   ARG 102          2HB       ARG 102 123.160   1.758  -5.644
  171   2HB   ARG 102          1HB       ARG 102 123.006   3.388  -5.001
  172   1HG   ARG 102          2HG       ARG 102 124.038   4.230  -7.117
  173   2HG   ARG 102          1HG       ARG 102 123.926   2.584  -7.748
  174   1HD   ARG 102          2HD       ARG 102 121.582   4.173  -6.714
  175   2HD   ARG 102          1HD       ARG 102 122.037   4.073  -8.414
  176    HE   ARG 102           HE       ARG 102 121.796   1.480  -7.696
  177   1HH1  ARG 102          1HH1      ARG 102 119.693   4.245  -7.357
  178   2HH1  ARG 102          2HH1      ARG 102 118.240   3.308  -7.444
  179   1HH2  ARG 102          1HH2      ARG 102 119.885   0.246  -7.810
  180   2HH2  ARG 102          2HH2      ARG 102 118.348   1.038  -7.699
  181    H    MET 103           H        MET 103 124.886   4.303  -3.181
  182    HA   MET 103           HA       MET 103 125.493   6.723  -4.433
  183   1HB   MET 103          2HB       MET 103 125.912   5.919  -1.548
  184   2HB   MET 103          1HB       MET 103 125.948   7.572  -2.150
  185   1HG   MET 103          2HG       MET 103 123.526   6.070  -2.834
  186   2HG   MET 103          1HG       MET 103 123.770   6.341  -1.111
  187   1HE   MET 103          1HE       MET 103 123.798   9.349  -0.143
  188   2HE   MET 103          2HE       MET 103 122.855   7.863  -0.025
  189   3HE   MET 103          3HE       MET 103 122.085   9.358  -0.558
  190    H    PHE 104           H        PHE 104 127.575   4.300  -2.966
  191    HA   PHE 104           HA       PHE 104 129.957   5.855  -3.068
  192   1HB   PHE 104          2HB       PHE 104 129.283   3.003  -2.539
  193   2HB   PHE 104          1HB       PHE 104 130.945   3.381  -2.979
  194    HD1  PHE 104           HD1      PHE 104 132.320   3.454  -1.151
  195    HD2  PHE 104           HD2      PHE 104 128.371   5.007  -0.814
  196    HE1  PHE 104           HE1      PHE 104 132.784   4.118   1.172
  197    HE2  PHE 104           HE2      PHE 104 128.828   5.673   1.509
  198    HZ   PHE 104           HZ       PHE 104 131.035   5.230   2.505
  199    H    ASP 105           H        ASP 105 128.210   3.990  -5.387
  200    HA   ASP 105           HA       ASP 105 130.486   3.776  -7.188
  201   1HB   ASP 105          2HB       ASP 105 127.886   2.491  -6.928
  202   2HB   ASP 105          1HB       ASP 105 128.215   2.980  -8.587
  203    H    LYS 106           H        LYS 106 130.641   4.825  -9.170
  204    HA   LYS 106           HA       LYS 106 128.912   7.191  -9.443
  205   1HB   LYS 106          2HB       LYS 106 131.678   6.795 -10.593
  206   2HB   LYS 106          1HB       LYS 106 130.741   8.284 -10.575
  207   1HG   LYS 106          2HG       LYS 106 131.391   6.979  -7.984
  208   2HG   LYS 106          1HG       LYS 106 132.657   7.860  -8.839
  209   1HD   LYS 106          2HD       LYS 106 131.784   9.558  -7.579
  210   2HD   LYS 106          1HD       LYS 106 130.769   9.699  -9.015
  211   1HE   LYS 106          2HE       LYS 106 129.078   9.622  -7.537
  212   2HE   LYS 106          1HE       LYS 106 129.367   7.883  -7.577
  213   1HZ   LYS 106          1HZ       LYS 106 129.242   8.734  -5.311
  214   2HZ   LYS 106          2HZ       LYS 106 130.542   9.775  -5.610
  215   3HZ   LYS 106          3HZ       LYS 106 130.778   8.100  -5.638
  216    H    ASN 107           H        ASN 107 130.409   4.518 -11.185
  217    HA   ASN 107           HA       ASN 107 128.948   5.239 -13.615
  218   1HB   ASN 107          2HB       ASN 107 130.305   3.497 -14.704
  219   2HB   ASN 107          1HB       ASN 107 131.312   4.683 -13.878
  220   1HD2  ASN 107          1HD2      ASN 107 132.014   2.009 -14.639
  221   2HD2  ASN 107          2HD2      ASN 107 132.412   1.160 -13.187
  222    H    ALA 108           H        ALA 108 128.201   3.621 -10.904
  223    HA   ALA 108           HA       ALA 108 126.783   1.931 -10.327
  224   1HB   ALA 108          1HB       ALA 108 124.857   1.673 -12.067
  225   2HB   ALA 108          2HB       ALA 108 125.613   3.076 -12.822
  226   3HB   ALA 108          3HB       ALA 108 125.034   3.175 -11.159
  227    H    ASP 109           H        ASP 109 128.773   0.530 -10.785
  228    HA   ASP 109           HA       ASP 109 128.128  -1.419 -12.900
  229   1HB   ASP 109          2HB       ASP 109 130.525  -1.992 -12.936
  230   2HB   ASP 109          1HB       ASP 109 130.253  -0.297 -13.324
  231    H    GLY 110           H        GLY 110 128.172  -0.946  -9.582
  232   1HA   GLY 110          2HA       GLY 110 127.428  -2.556  -8.031
  233   2HA   GLY 110          1HA       GLY 110 127.919  -3.822  -9.145
  234    H    TYR 111           H        TYR 111 130.545  -2.178  -9.390
  235    HA   TYR 111           HA       TYR 111 131.743  -3.082  -6.857
  236   1HB   TYR 111          2HB       TYR 111 132.998  -3.324  -9.600
  237   2HB   TYR 111          1HB       TYR 111 133.712  -3.845  -8.077
  238    HD1  TYR 111           HD1      TYR 111 133.516  -6.068  -7.479
  239    HD2  TYR 111           HD2      TYR 111 130.641  -4.399 -10.133
  240    HE1  TYR 111           HE1      TYR 111 132.489  -8.286  -7.749
  241    HE2  TYR 111           HE2      TYR 111 129.605  -6.612 -10.411
  242    HH   TYR 111           HH       TYR 111 129.549  -8.832  -8.819
  243    H    ILE 112           H        ILE 112 133.266  -1.752  -5.952
  244    HA   ILE 112           HA       ILE 112 133.657   0.839  -7.292
  245    HB   ILE 112           HB       ILE 112 133.953   0.248  -4.347
  246   1HG1  ILE 112          2HG1      ILE 112 131.678   1.791  -5.557
  247   2HG1  ILE 112          1HG1      ILE 112 131.597   0.035  -5.448
  248   1HG2  ILE 112          1HG2      ILE 112 134.214   2.683  -6.037
  249   2HG2  ILE 112          2HG2      ILE 112 135.174   2.158  -4.655
  250   3HG2  ILE 112          3HG2      ILE 112 133.572   2.853  -4.403
  251   1HD1  ILE 112          1HD1      ILE 112 132.139   1.790  -3.075
  252   2HD1  ILE 112          2HD1      ILE 112 131.684   0.088  -3.093
  253   3HD1  ILE 112          3HD1      ILE 112 130.517   1.318  -3.577
  254    H    ASP 113           H        ASP 113 135.652   1.585  -7.715
  255    HA   ASP 113           HA       ASP 113 137.916  -0.141  -6.968
  256   1HB   ASP 113          2HB       ASP 113 137.186   0.530  -9.461
  257   2HB   ASP 113          1HB       ASP 113 138.221   1.909  -9.100
  258    H    LEU 114           H        LEU 114 140.066   1.301  -7.159
  259    HA   LEU 114           HA       LEU 114 140.028   2.991  -4.899
  260   1HB   LEU 114          2HB       LEU 114 142.054   2.277  -6.970
  261   2HB   LEU 114          1HB       LEU 114 142.378   3.628  -5.902
  262    HG   LEU 114           HG       LEU 114 141.686   1.755  -4.083
  263   1HD1  LEU 114          1HD1      LEU 114 143.081   0.247  -6.287
  264   2HD1  LEU 114          2HD1      LEU 114 141.395   0.037  -5.816
  265   3HD1  LEU 114          3HD1      LEU 114 142.684  -0.366  -4.683
  266   1HD2  LEU 114          1HD2      LEU 114 144.236   2.698  -5.241
  267   2HD2  LEU 114          2HD2      LEU 114 144.313   1.272  -4.207
  268   3HD2  LEU 114          3HD2      LEU 114 143.642   2.778  -3.582
  269    H    GLU 115           H        GLU 115 139.825   3.601  -8.337
  270    HA   GLU 115           HA       GLU 115 140.274   6.414  -8.166
  271   1HB   GLU 115          2HB       GLU 115 140.237   4.613 -10.212
  272   2HB   GLU 115          1HB       GLU 115 138.692   5.418 -10.443
  273   1HG   GLU 115          2HG       GLU 115 139.936   7.598 -10.373
  274   2HG   GLU 115          1HG       GLU 115 141.427   6.659 -10.421
  275    H    GLU 116           H        GLU 116 137.405   4.357  -8.254
  276    HA   GLU 116           HA       GLU 116 135.524   6.470  -8.428
  277   1HB   GLU 116          2HB       GLU 116 135.395   3.566  -7.742
  278   2HB   GLU 116          1HB       GLU 116 134.007   4.582  -7.381
  279   1HG   GLU 116          2HG       GLU 116 133.369   4.632  -9.505
  280   2HG   GLU 116          1HG       GLU 116 134.996   5.017 -10.066
  281    H    LEU 117           H        LEU 117 136.335   4.367  -5.663
  282    HA   LEU 117           HA       LEU 117 134.914   5.666  -3.701
  283   1HB   LEU 117          2HB       LEU 117 136.094   3.534  -3.389
  284   2HB   LEU 117          1HB       LEU 117 137.629   4.381  -3.414
  285    HG   LEU 117           HG       LEU 117 136.872   5.643  -1.373
  286   1HD1  LEU 117          1HD1      LEU 117 135.052   4.132  -0.148
  287   2HD1  LEU 117          2HD1      LEU 117 134.516   3.906  -1.814
  288   3HD1  LEU 117          3HD1      LEU 117 134.621   5.530  -1.132
  289   1HD2  LEU 117          1HD2      LEU 117 138.161   3.296  -1.584
  290   2HD2  LEU 117          2HD2      LEU 117 136.784   2.797  -0.601
  291   3HD2  LEU 117          3HD2      LEU 117 137.841   4.096  -0.044
  292    H    LYS 118           H        LYS 118 137.871   6.668  -5.227
  293    HA   LYS 118           HA       LYS 118 138.724   8.530  -3.275
  294   1HB   LYS 118          2HB       LYS 118 140.030   7.551  -5.268
  295   2HB   LYS 118          1HB       LYS 118 139.256   8.808  -6.223
  296   1HG   LYS 118          2HG       LYS 118 140.551   9.722  -3.745
  297   2HG   LYS 118          1HG       LYS 118 141.633   9.088  -4.987
  298   1HD   LYS 118          2HD       LYS 118 139.999  10.664  -6.474
  299   2HD   LYS 118          1HD       LYS 118 140.027  11.553  -4.950
  300   1HE   LYS 118          2HE       LYS 118 142.450  10.663  -6.510
  301   2HE   LYS 118          1HE       LYS 118 141.791  12.297  -6.487
  302   1HZ   LYS 118          1HZ       LYS 118 143.540  12.293  -4.950
  303   2HZ   LYS 118          2HZ       LYS 118 143.075  10.817  -4.269
  304   3HZ   LYS 118          3HZ       LYS 118 142.142  12.203  -4.002
  305    H    ILE 119           H        ILE 119 136.602   8.780  -6.081
  306    HA   ILE 119           HA       ILE 119 136.321  11.568  -6.132
  307    HB   ILE 119           HB       ILE 119 134.221   9.542  -6.904
  308   1HG1  ILE 119          2HG1      ILE 119 135.997  10.761  -8.944
  309   2HG1  ILE 119          1HG1      ILE 119 136.726   9.545  -7.901
  310   1HG2  ILE 119          1HG2      ILE 119 134.489  12.026  -8.433
  311   2HG2  ILE 119          2HG2      ILE 119 133.974  12.250  -6.761
  312   3HG2  ILE 119          3HG2      ILE 119 133.045  11.207  -7.838
  313   1HD1  ILE 119          1HD1      ILE 119 134.612   9.263  -9.957
  314   2HD1  ILE 119          2HD1      ILE 119 134.563   8.193  -8.556
  315   3HD1  ILE 119          3HD1      ILE 119 135.989   8.223  -9.592
  316    H    MET 120           H        MET 120 134.409   9.082  -4.470
  317    HA   MET 120           HA       MET 120 132.490  10.813  -3.364
  318   1HB   MET 120          2HB       MET 120 132.351   8.299  -3.523
  319   2HB   MET 120          1HB       MET 120 133.448   8.222  -2.151
  320   1HG   MET 120          2HG       MET 120 130.916   9.793  -1.967
  321   2HG   MET 120          1HG       MET 120 130.899   8.042  -1.767
  322   1HE   MET 120          1HE       MET 120 133.156   7.489   1.333
  323   2HE   MET 120          2HE       MET 120 133.885   7.686  -0.261
  324   3HE   MET 120          3HE       MET 120 132.383   6.776  -0.084
  325    H    LEU 121           H        LEU 121 135.728   9.986  -2.368
  326    HA   LEU 121           HA       LEU 121 135.447  11.023   0.296
  327   1HB   LEU 121          2HB       LEU 121 137.800  10.152  -1.360
  328   2HB   LEU 121          1HB       LEU 121 138.005  10.870   0.226
  329    HG   LEU 121           HG       LEU 121 136.227   8.484  -0.114
  330   1HD1  LEU 121          1HD1      LEU 121 137.966   6.967  -0.013
  331   2HD1  LEU 121          2HD1      LEU 121 139.124   8.174   0.547
  332   3HD1  LEU 121          3HD1      LEU 121 138.588   8.178  -1.134
  333   1HD2  LEU 121          1HD2      LEU 121 136.689  10.056   2.010
  334   2HD2  LEU 121          2HD2      LEU 121 137.993   8.885   2.217
  335   3HD2  LEU 121          3HD2      LEU 121 136.318   8.336   2.139
  336    H    GLN 122           H        GLN 122 137.044  12.165  -2.675
  337    HA   GLN 122           HA       GLN 122 138.014  14.581  -1.657
  338   1HB   GLN 122          2HB       GLN 122 138.012  15.341  -4.031
  339   2HB   GLN 122          1HB       GLN 122 138.773  13.774  -3.791
  340   1HG   GLN 122          2HG       GLN 122 136.751  12.666  -4.573
  341   2HG   GLN 122          1HG       GLN 122 135.978  14.233  -4.802
  342   1HE2  GLN 122          1HE2      GLN 122 135.843  14.668  -6.877
  343   2HE2  GLN 122          2HE2      GLN 122 137.076  14.409  -8.057
  344    H    ALA 123           H        ALA 123 134.919  13.776  -3.136
  345    HA   ALA 123           HA       ALA 123 133.807  16.310  -3.332
  346   1HB   ALA 123          1HB       ALA 123 132.114  15.138  -4.154
  347   2HB   ALA 123          2HB       ALA 123 131.781  14.437  -2.570
  348   3HB   ALA 123          3HB       ALA 123 132.931  13.658  -3.655
  349    H    THR 124           H        THR 124 134.398  14.390  -0.505
  350    HA   THR 124           HA       THR 124 132.476  15.442   1.234
  351    HB   THR 124           HB       THR 124 133.827  14.627   3.027
  352    HG1  THR 124           HG1      THR 124 135.994  14.196   2.797
  353   1HG2  THR 124          1HG2      THR 124 134.909  12.506   1.650
  354   2HG2  THR 124          2HG2      THR 124 133.552  13.010   0.644
  355   3HG2  THR 124          3HG2      THR 124 133.288  12.593   2.338
  356    H    GLY 125           H        GLY 125 133.148  16.814   3.219
  357   1HA   GLY 125          2HA       GLY 125 134.006  19.372   2.177
  358   2HA   GLY 125          1HA       GLY 125 133.391  19.054   3.791
  359    H    GLU 126           H        GLU 126 135.584  16.761   3.647
  360    HA   GLU 126           HA       GLU 126 137.703  18.500   4.703
  361   1HB   GLU 126          2HB       GLU 126 138.522  16.295   5.728
  362   2HB   GLU 126          1HB       GLU 126 137.065  17.015   6.399
  363   1HG   GLU 126          2HG       GLU 126 135.683  15.469   5.176
  364   2HG   GLU 126          1HG       GLU 126 137.097  14.801   4.363
  365    H    THR 127           H        THR 127 139.922  17.128   4.587
  366    HA   THR 127           HA       THR 127 140.287  16.492   1.739
  367    HB   THR 127           HB       THR 127 141.544  18.414   2.066
  368    HG1  THR 127           HG1      THR 127 143.226  17.451   1.303
  369   1HG2  THR 127          1HG2      THR 127 141.302  18.599   4.475
  370   2HG2  THR 127          2HG2      THR 127 142.971  18.859   3.967
  371   3HG2  THR 127          3HG2      THR 127 142.499  17.323   4.696
  372    H    ILE 128           H        ILE 128 140.854  14.477   1.266
  373    HA   ILE 128           HA       ILE 128 142.033  12.821   3.401
  374    HB   ILE 128           HB       ILE 128 140.491  11.800   1.019
  375   1HG1  ILE 128          2HG1      ILE 128 139.006  13.174   2.389
  376   2HG1  ILE 128          1HG1      ILE 128 138.603  11.469   2.574
  377   1HG2  ILE 128          1HG2      ILE 128 142.168  10.346   2.308
  378   2HG2  ILE 128          2HG2      ILE 128 140.548   9.706   2.040
  379   3HG2  ILE 128          3HG2      ILE 128 140.981  10.379   3.611
  380   1HD1  ILE 128          1HD1      ILE 128 140.066  11.543   4.665
  381   2HD1  ILE 128          2HD1      ILE 128 138.492  12.335   4.728
  382   3HD1  ILE 128          3HD1      ILE 128 139.956  13.295   4.518
  383    H    THR 129           H        THR 129 143.847  11.639   2.991
  384    HA   THR 129           HA       THR 129 145.349  12.361   0.615
  385    HB   THR 129           HB       THR 129 146.311  10.482   2.754
  386    HG1  THR 129           HG1      THR 129 146.340  12.024   4.158
  387   1HG2  THR 129          1HG2      THR 129 147.544  12.087   0.643
  388   2HG2  THR 129          2HG2      THR 129 148.116  10.627   1.451
  389   3HG2  THR 129          3HG2      THR 129 148.333  12.201   2.216
  390    H    GLU 130           H        GLU 130 146.687  10.540  -0.414
  391    HA   GLU 130           HA       GLU 130 144.910   8.704  -1.608
  392   1HB   GLU 130          2HB       GLU 130 147.832   9.229  -1.720
  393   2HB   GLU 130          1HB       GLU 130 147.282   7.655  -2.278
  394   1HG   GLU 130          2HG       GLU 130 145.999   8.583  -3.996
  395   2HG   GLU 130          1HG       GLU 130 146.049  10.195  -3.281
  396    H    ASP 131           H        ASP 131 147.278   8.391   0.983
  397    HA   ASP 131           HA       ASP 131 147.278   5.605   1.224
  398   1HB   ASP 131          2HB       ASP 131 148.474   7.733   2.556
  399   2HB   ASP 131          1HB       ASP 131 147.482   6.968   3.793
  400    H    ASP 132           H        ASP 132 145.221   8.043   2.778
  401    HA   ASP 132           HA       ASP 132 143.757   6.282   4.402
  402   1HB   ASP 132          2HB       ASP 132 143.354   9.051   3.376
  403   2HB   ASP 132          1HB       ASP 132 141.957   8.216   4.051
  404    H    ILE 133           H        ILE 133 143.247   7.386   1.085
  405    HA   ILE 133           HA       ILE 133 140.700   6.232   0.718
  406    HB   ILE 133           HB       ILE 133 142.797   6.706  -1.404
  407   1HG1  ILE 133          2HG1      ILE 133 140.583   8.629  -0.820
  408   2HG1  ILE 133          1HG1      ILE 133 142.011   8.650   0.208
  409   1HG2  ILE 133          1HG2      ILE 133 139.959   7.059  -2.042
  410   2HG2  ILE 133          2HG2      ILE 133 140.419   5.402  -1.650
  411   3HG2  ILE 133          3HG2      ILE 133 141.239   6.260  -2.955
  412   1HD1  ILE 133          1HD1      ILE 133 143.224   9.691  -1.338
  413   2HD1  ILE 133          2HD1      ILE 133 141.690  10.020  -2.142
  414   3HD1  ILE 133          3HD1      ILE 133 142.657   8.628  -2.625
  415    H    GLU 134           H        GLU 134 143.971   4.990   0.195
  416    HA   GLU 134           HA       GLU 134 143.154   2.546  -1.005
  417   1HB   GLU 134          2HB       GLU 134 145.521   3.808  -0.813
  418   2HB   GLU 134          1HB       GLU 134 145.718   2.639   0.485
  419   1HG   GLU 134          2HG       GLU 134 144.700   1.547  -2.045
  420   2HG   GLU 134          1HG       GLU 134 146.346   2.176  -2.094
  421    H    GLU 135           H        GLU 135 143.679   3.590   2.295
  422    HA   GLU 135           HA       GLU 135 143.811   1.096   3.556
  423   1HB   GLU 135          2HB       GLU 135 143.187   3.868   4.377
  424   2HB   GLU 135          1HB       GLU 135 142.579   2.604   5.437
  425   1HG   GLU 135          2HG       GLU 135 145.016   1.689   5.270
  426   2HG   GLU 135          1HG       GLU 135 145.390   3.342   4.787
  427    H    LEU 136           H        LEU 136 141.102   2.899   2.304
  428    HA   LEU 136           HA       LEU 136 139.072   1.435   3.667
  429   1HB   LEU 136          2HB       LEU 136 139.179   3.412   1.457
  430   2HB   LEU 136          1HB       LEU 136 137.756   2.392   1.540
  431    HG   LEU 136           HG       LEU 136 137.519   3.148   3.958
  432   1HD1  LEU 136          1HD1      LEU 136 139.409   5.311   3.050
  433   2HD1  LEU 136          2HD1      LEU 136 139.841   4.002   4.149
  434   3HD1  LEU 136          3HD1      LEU 136 138.613   5.178   4.618
  435   1HD2  LEU 136          1HD2      LEU 136 137.266   5.556   2.261
  436   2HD2  LEU 136          2HD2      LEU 136 136.075   4.757   3.288
  437   3HD2  LEU 136          3HD2      LEU 136 136.448   4.099   1.695
  438    H    MET 137           H        MET 137 140.716   1.092   0.575
  439    HA   MET 137           HA       MET 137 139.019  -0.852  -0.548
  440   1HB   MET 137          2HB       MET 137 141.652   0.278  -1.114
  441   2HB   MET 137          1HB       MET 137 141.530  -1.416  -1.565
  442   1HG   MET 137          2HG       MET 137 139.718   0.806  -2.477
  443   2HG   MET 137          1HG       MET 137 140.970   0.014  -3.431
  444   1HE   MET 137          1HE       MET 137 136.767  -0.945  -3.716
  445   2HE   MET 137          2HE       MET 137 137.851   0.173  -4.543
  446   3HE   MET 137          3HE       MET 137 137.490   0.401  -2.832
  447    H    LYS 138           H        LYS 138 142.155  -1.261   1.100
  448    HA   LYS 138           HA       LYS 138 142.072  -4.073   1.153
  449   1HB   LYS 138          2HB       LYS 138 144.111  -2.663   1.498
  450   2HB   LYS 138          1HB       LYS 138 143.507  -2.262   3.100
  451   1HG   LYS 138          2HG       LYS 138 144.346  -4.127   3.944
  452   2HG   LYS 138          1HG       LYS 138 143.509  -5.107   2.741
  453   1HD   LYS 138          2HD       LYS 138 145.516  -4.065   1.248
  454   2HD   LYS 138          1HD       LYS 138 146.301  -4.181   2.824
  455   1HE   LYS 138          2HE       LYS 138 144.830  -6.451   1.492
  456   2HE   LYS 138          1HE       LYS 138 146.572  -6.200   1.375
  457   1HZ   LYS 138          1HZ       LYS 138 146.255  -6.126   4.006
  458   2HZ   LYS 138          2HZ       LYS 138 146.567  -7.555   3.157
  459   3HZ   LYS 138          3HZ       LYS 138 144.983  -7.167   3.607
  460    H    ASP 139           H        ASP 139 140.542  -1.684   3.128
  461    HA   ASP 139           HA       ASP 139 140.048  -3.454   5.348
  462   1HB   ASP 139          2HB       ASP 139 139.378  -0.636   4.663
  463   2HB   ASP 139          1HB       ASP 139 138.348  -1.455   5.833
  464    H    GLY 140           H        GLY 140 138.601  -2.935   2.304
  465   1HA   GLY 140          2HA       GLY 140 136.161  -4.310   3.244
  466   2HA   GLY 140          1HA       GLY 140 136.133  -3.090   1.981
  467    H    ASP 141           H        ASP 141 138.912  -4.661   1.389
  468    HA   ASP 141           HA       ASP 141 137.605  -6.455  -0.526
  469   1HB   ASP 141          2HB       ASP 141 139.442  -4.582  -1.056
  470   2HB   ASP 141          1HB       ASP 141 140.528  -5.917  -0.679
  471    H    LYS 142           H        LYS 142 137.226  -8.250   0.705
  472    HA   LYS 142           HA       LYS 142 139.335  -9.441   2.282
  473   1HB   LYS 142          2HB       LYS 142 136.475 -10.155   1.707
  474   2HB   LYS 142          1HB       LYS 142 137.546 -11.297   2.508
  475   1HG   LYS 142          2HG       LYS 142 136.360 -10.161   4.204
  476   2HG   LYS 142          1HG       LYS 142 138.003  -9.518   4.216
  477   1HD   LYS 142          2HD       LYS 142 137.270  -7.453   3.806
  478   2HD   LYS 142          1HD       LYS 142 136.324  -8.005   2.423
  479   1HE   LYS 142          2HE       LYS 142 135.267  -8.610   5.125
  480   2HE   LYS 142          1HE       LYS 142 135.212  -6.930   4.597
  481   1HZ   LYS 142          1HZ       LYS 142 133.306  -8.683   4.052
  482   2HZ   LYS 142          2HZ       LYS 142 134.275  -8.912   2.685
  483   3HZ   LYS 142          3HZ       LYS 142 133.664  -7.376   3.040
  484    H    ASN 143           H        ASN 143 137.891  -9.875  -0.866
  485    HA   ASN 143           HA       ASN 143 139.223 -12.412  -1.305
  486   1HB   ASN 143          2HB       ASN 143 138.226 -12.181  -3.618
  487   2HB   ASN 143          1HB       ASN 143 137.064 -12.234  -2.296
  488   1HD2  ASN 143          1HD2      ASN 143 136.148 -11.288  -4.574
  489   2HD2  ASN 143          2HD2      ASN 143 135.972  -9.569  -4.533
  490    H    ASN 144           H        ASN 144 140.205  -9.256  -1.354
  491    HA   ASN 144           HA       ASN 144 141.857  -8.072  -2.383
  492   1HB   ASN 144          2HB       ASN 144 143.010 -10.845  -2.152
  493   2HB   ASN 144          1HB       ASN 144 143.965  -9.490  -2.747
  494   1HD2  ASN 144          1HD2      ASN 144 143.211 -11.238  -0.081
  495   2HD2  ASN 144          2HD2      ASN 144 143.606 -10.087   1.145
  496    H    ASP 145           H        ASP 145 139.886  -8.743  -4.220
  497    HA   ASP 145           HA       ASP 145 141.189  -9.765  -6.602
  498   1HB   ASP 145          2HB       ASP 145 139.004  -9.480  -7.672
  499   2HB   ASP 145          1HB       ASP 145 138.840 -10.349  -6.150
  500    H    GLY 146           H        GLY 146 140.136  -6.709  -5.257
  501   1HA   GLY 146          2HA       GLY 146 141.668  -4.842  -6.041
  502   2HA   GLY 146          1HA       GLY 146 141.177  -5.332  -7.654
  503    H    ARG 147           H        ARG 147 138.485  -5.816  -5.914
  504    HA   ARG 147           HA       ARG 147 137.589  -3.057  -5.768
  505   1HB   ARG 147          2HB       ARG 147 136.316  -5.068  -7.633
  506   2HB   ARG 147          1HB       ARG 147 135.619  -3.508  -7.217
  507   1HG   ARG 147          2HG       ARG 147 137.964  -2.639  -8.077
  508   2HG   ARG 147          1HG       ARG 147 137.915  -4.157  -8.977
  509   1HD   ARG 147          2HD       ARG 147 135.460  -3.325  -9.520
  510   2HD   ARG 147          1HD       ARG 147 136.185  -1.750  -9.204
  511    HE   ARG 147           HE       ARG 147 137.930  -2.891 -10.924
  512   1HH1  ARG 147          1HH1      ARG 147 134.472  -2.419 -11.005
  513   2HH1  ARG 147          2HH1      ARG 147 134.403  -2.302 -12.731
  514   1HH2  ARG 147          1HH2      ARG 147 137.840  -2.737 -13.194
  515   2HH2  ARG 147          2HH2      ARG 147 136.314  -2.484 -13.973
  516    H    ILE 148           H        ILE 148 135.419  -2.876  -4.810
  517    HA   ILE 148           HA       ILE 148 134.903  -5.133  -2.991
  518    HB   ILE 148           HB       ILE 148 134.050  -2.265  -2.591
  519   1HG1  ILE 148          2HG1      ILE 148 136.369  -3.647  -1.238
  520   2HG1  ILE 148          1HG1      ILE 148 136.569  -2.643  -2.672
  521   1HG2  ILE 148          1HG2      ILE 148 134.232  -4.566  -0.653
  522   2HG2  ILE 148          2HG2      ILE 148 132.746  -3.981  -1.403
  523   3HG2  ILE 148          3HG2      ILE 148 133.649  -2.939  -0.303
  524   1HD1  ILE 148          1HD1      ILE 148 135.095  -1.435  -0.422
  525   2HD1  ILE 148          2HD1      ILE 148 136.265  -0.724  -1.533
  526   3HD1  ILE 148          3HD1      ILE 148 136.820  -1.717  -0.185
  527    H    ASP 149           H        ASP 149 133.027  -6.178  -3.098
  528    HA   ASP 149           HA       ASP 149 130.950  -5.095  -4.866
  529   1HB   ASP 149          2HB       ASP 149 130.116  -7.385  -5.056
  530   2HB   ASP 149          1HB       ASP 149 131.825  -7.315  -5.470
  531    H    TYR 150           H        TYR 150 128.676  -5.725  -4.253
  532    HA   TYR 150           HA       TYR 150 127.959  -4.483  -1.872
  533   1HB   TYR 150          2HB       TYR 150 126.399  -4.674  -3.711
  534   2HB   TYR 150          1HB       TYR 150 126.401  -6.429  -3.582
  535    HD1  TYR 150           HD1      TYR 150 124.931  -7.541  -2.105
  536    HD2  TYR 150           HD2      TYR 150 125.388  -3.318  -1.840
  537    HE1  TYR 150           HE1      TYR 150 123.009  -7.434  -0.576
  538    HE2  TYR 150           HE2      TYR 150 123.468  -3.200  -0.310
  539    HH   TYR 150           HH       TYR 150 121.239  -5.430   0.020
  540    H    ASP 151           H        ASP 151 128.767  -7.819  -2.471
  541    HA   ASP 151           HA       ASP 151 127.568  -8.888  -0.131
  542   1HB   ASP 151          2HB       ASP 151 129.976 -10.063  -1.512
  543   2HB   ASP 151          1HB       ASP 151 128.705 -10.903  -0.631
  544    H    GLU 152           H        GLU 152 131.013  -8.295  -0.859
  545    HA   GLU 152           HA       GLU 152 131.803  -8.643   1.849
  546   1HB   GLU 152          2HB       GLU 152 134.006  -7.772   1.070
  547   2HB   GLU 152          1HB       GLU 152 133.391  -9.124   0.126
  548   1HG   GLU 152          2HG       GLU 152 132.643  -7.583  -1.604
  549   2HG   GLU 152          1HG       GLU 152 133.240  -6.224  -0.656
  550    H    PHE 153           H        PHE 153 130.770  -5.870  -0.004
  551    HA   PHE 153           HA       PHE 153 131.871  -3.914   1.762
  552   1HB   PHE 153          2HB       PHE 153 130.883  -3.757  -0.729
  553   2HB   PHE 153          1HB       PHE 153 129.462  -3.239   0.165
  554    HD1  PHE 153           HD1      PHE 153 130.441  -1.621   2.298
  555    HD2  PHE 153           HD2      PHE 153 131.918  -1.953  -1.677
  556    HE1  PHE 153           HE1      PHE 153 131.388   0.641   2.468
  557    HE2  PHE 153           HE2      PHE 153 132.870   0.311  -1.517
  558    HZ   PHE 153           HZ       PHE 153 132.605   1.611   0.558
  559    H    LEU 154           H        LEU 154 128.815  -5.634   1.562
  560    HA   LEU 154           HA       LEU 154 127.241  -4.139   3.269
  561   1HB   LEU 154          2HB       LEU 154 127.106  -6.659   2.057
  562   2HB   LEU 154          1HB       LEU 154 126.899  -6.970   3.769
  563    HG   LEU 154           HG       LEU 154 124.952  -5.604   3.882
  564   1HD1  LEU 154          1HD1      LEU 154 125.454  -3.706   2.610
  565   2HD1  LEU 154          2HD1      LEU 154 124.127  -4.478   1.745
  566   3HD1  LEU 154          3HD1      LEU 154 125.781  -4.654   1.159
  567   1HD2  LEU 154          1HD2      LEU 154 125.114  -7.523   1.613
  568   2HD2  LEU 154          2HD2      LEU 154 123.639  -6.578   1.821
  569   3HD2  LEU 154          3HD2      LEU 154 124.204  -7.629   3.119
  570    H    GLU 155           H        GLU 155 129.681  -6.565   4.067
  571    HA   GLU 155           HA       GLU 155 129.199  -6.523   6.873
  572   1HB   GLU 155          2HB       GLU 155 131.514  -7.481   5.198
  573   2HB   GLU 155          1HB       GLU 155 131.523  -7.582   6.953
  574   1HG   GLU 155          2HG       GLU 155 129.101  -8.674   5.775
  575   2HG   GLU 155          1HG       GLU 155 130.565  -9.483   5.215
  576    H    PHE 156           H        PHE 156 131.075  -4.575   4.697
  577    HA   PHE 156           HA       PHE 156 132.935  -3.454   6.447
  578   1HB   PHE 156          2HB       PHE 156 132.476  -3.180   3.825
  579   2HB   PHE 156          1HB       PHE 156 131.713  -1.695   4.381
  580    HD1  PHE 156           HD1      PHE 156 133.480  -0.950   6.619
  581    HD2  PHE 156           HD2      PHE 156 134.406  -2.475   2.756
  582    HE1  PHE 156           HE1      PHE 156 135.679   0.145   6.721
  583    HE2  PHE 156           HE2      PHE 156 136.608  -1.382   2.852
  584    HZ   PHE 156           HZ       PHE 156 137.247  -0.071   4.834
  585    H    MET 157           H        MET 157 129.683  -2.292   5.582
  586    HA   MET 157           HA       MET 157 129.804  -0.172   7.533
  587   1HB   MET 157          2HB       MET 157 127.518  -1.170   5.825
  588   2HB   MET 157          1HB       MET 157 127.464   0.268   6.835
  589   1HG   MET 157          2HG       MET 157 129.690   0.137   4.915
  590   2HG   MET 157          1HG       MET 157 128.078   0.283   4.219
  591   1HE   MET 157          1HE       MET 157 130.741   1.920   4.301
  592   2HE   MET 157          2HE       MET 157 130.624   3.529   5.016
  593   3HE   MET 157          3HE       MET 157 129.739   3.154   3.536
  594    H    LYS 158           H        LYS 158 129.411  -3.400   7.899
  595    HA   LYS 158           HA       LYS 158 127.355  -3.201   9.979
  596   1HB   LYS 158          2HB       LYS 158 128.602  -5.498   8.495
  597   2HB   LYS 158          1HB       LYS 158 127.765  -5.770  10.017
  598   1HG   LYS 158          2HG       LYS 158 125.730  -4.799   9.075
  599   2HG   LYS 158          1HG       LYS 158 126.572  -4.528   7.548
  600   1HD   LYS 158          2HD       LYS 158 126.605  -6.763   7.016
  601   2HD   LYS 158          1HD       LYS 158 126.554  -7.274   8.704
  602   1HE   LYS 158          2HE       LYS 158 124.164  -6.031   8.487
  603   2HE   LYS 158          1HE       LYS 158 124.360  -6.640   6.844
  604   1HZ   LYS 158          1HZ       LYS 158 123.924  -8.092   9.319
  605   2HZ   LYS 158          2HZ       LYS 158 125.037  -8.790   8.254
  606   3HZ   LYS 158          3HZ       LYS 158 123.456  -8.478   7.739
  607    H    GLY 159           H        GLY 159 129.748  -1.900  10.499
  608   1HA   GLY 159          2HA       GLY 159 130.679  -1.900  12.778
  609   2HA   GLY 159          1HA       GLY 159 130.948  -3.627  12.575
  610    H    VAL 160           H        VAL 160 132.533  -0.792  12.675
  611    HA   VAL 160           HA       VAL 160 134.660  -1.803  10.918
  612    HB   VAL 160           HB       VAL 160 134.486   1.136  11.106
  613   1HG1  VAL 160          1HG1      VAL 160 134.772   0.580   8.508
  614   2HG1  VAL 160          2HG1      VAL 160 135.329  -0.950   9.187
  615   3HG1  VAL 160          3HG1      VAL 160 136.119   0.559   9.648
  616   1HG2  VAL 160          1HG2      VAL 160 132.819   1.057   9.113
  617   2HG2  VAL 160          2HG2      VAL 160 132.199   0.991  10.763
  618   3HG2  VAL 160          3HG2      VAL 160 132.331  -0.488   9.810
  619    H    GLU 161           H        GLU 161 134.383  -2.091  13.752
  620    HA   GLU 161           HA       GLU 161 136.281  -0.185  14.886
  621   1HB   GLU 161          2HB       GLU 161 134.762  -2.453  16.189
  622   2HB   GLU 161          1HB       GLU 161 135.774  -1.286  17.031
  623   1HG   GLU 161          2HG       GLU 161 134.203   0.471  15.956
  624   2HG   GLU 161          1HG       GLU 161 133.112  -0.896  15.740
  Start of MODEL    2
    1   1H    MET  81          1HT       MET  81  90.167  -9.452  10.235
    2   2H    MET  81          2HT       MET  81  89.791  -9.536  11.907
    3   3H    MET  81          3HT       MET  81  89.106 -10.667  10.813
    4    HA   MET  81           HA       MET  81  90.971 -11.476  12.200
    5   1HB   MET  81          2HB       MET  81  90.152 -11.997   9.611
    6   2HB   MET  81          1HB       MET  81  91.892 -11.817   9.442
    7   1HG   MET  81          2HG       MET  81  91.017 -13.494  11.690
    8   2HG   MET  81          1HG       MET  81  90.646 -14.120  10.084
    9   1HE   MET  81          1HE       MET  81  93.619 -16.136  11.386
   10   2HE   MET  81          2HE       MET  81  92.778 -16.316   9.847
   11   3HE   MET  81          3HE       MET  81  91.867 -15.952  11.313
   12    H    VAL  82           H        VAL  82  91.579  -8.747  12.324
   13    HA   VAL  82           HA       VAL  82  94.299  -8.572  11.225
   14    HB   VAL  82           HB       VAL  82  92.687  -6.342  12.465
   15   1HG1  VAL  82          1HG1      VAL  82  94.328  -4.975  11.072
   16   2HG1  VAL  82          2HG1      VAL  82  95.267  -6.462  10.933
   17   3HG1  VAL  82          3HG1      VAL  82  94.959  -5.758  12.521
   18   1HG2  VAL  82          1HG2      VAL  82  91.616  -7.326  10.426
   19   2HG2  VAL  82          2HG2      VAL  82  93.065  -6.878   9.525
   20   3HG2  VAL  82          3HG2      VAL  82  92.071  -5.629  10.273
   21    H    ARG  83           H        ARG  83  95.165  -9.999  12.841
   22    HA   ARG  83           HA       ARG  83  95.401  -8.747  15.498
   23   1HB   ARG  83          2HB       ARG  83  95.952 -11.090  16.287
   24   2HB   ARG  83          1HB       ARG  83  94.287 -10.818  15.794
   25   1HG   ARG  83          2HG       ARG  83  94.609 -11.965  13.749
   26   2HG   ARG  83          1HG       ARG  83  96.358 -12.002  13.969
   27   1HD   ARG  83          2HD       ARG  83  95.029 -13.213  16.220
   28   2HD   ARG  83          1HD       ARG  83  94.499 -13.959  14.714
   29    HE   ARG  83           HE       ARG  83  96.648 -14.757  14.361
   30   1HH1  ARG  83          1HH1      ARG  83  96.556 -12.715  17.196
   31   2HH1  ARG  83          2HH1      ARG  83  98.114 -13.216  17.756
   32   1HH2  ARG  83          1HH2      ARG  83  98.695 -15.414  15.103
   33   2HH2  ARG  83          2HH2      ARG  83  99.328 -14.748  16.571
   34    H    CYS  84           H        CYS  84  97.099 -10.467  12.929
   35    HA   CYS  84           HA       CYS  84  99.524  -9.059  13.464
   36   1HB   CYS  84          2HB       CYS  84  99.264 -11.185  15.098
   37   2HB   CYS  84          1HB       CYS  84  99.983 -11.981  13.702
   38    HG   CYS  84           HG       CYS  84 101.832  -9.865  14.092
   39    H    MET  85           H        MET  85 101.350  -9.985  12.038
   40    HA   MET  85           HA       MET  85 102.109 -10.426   9.940
   41   1HB   MET  85          2HB       MET  85 101.261 -12.696  10.530
   42   2HB   MET  85          1HB       MET  85  99.731 -12.285   9.769
   43   1HG   MET  85          2HG       MET  85 100.958 -11.918   7.641
   44   2HG   MET  85          1HG       MET  85 102.416 -12.504   8.435
   45   1HE   MET  85          1HE       MET  85 102.057 -16.231   8.642
   46   2HE   MET  85          2HE       MET  85 102.108 -15.008   9.911
   47   3HE   MET  85          3HE       MET  85 103.130 -14.841   8.484
   48    H    LYS  86           H        LYS  86 101.150  -8.109   9.777
   49    HA   LYS  86           HA       LYS  86  99.626  -8.038   7.296
   50   1HB   LYS  86          2HB       LYS  86  98.704  -6.888   9.899
   51   2HB   LYS  86          1HB       LYS  86  98.313  -6.047   8.406
   52   1HG   LYS  86          2HG       LYS  86  97.730  -8.958   8.606
   53   2HG   LYS  86          1HG       LYS  86  96.675  -7.811   9.434
   54   1HD   LYS  86          2HD       LYS  86  95.598  -7.713   7.464
   55   2HD   LYS  86          1HD       LYS  86  96.921  -6.646   6.988
   56   1HE   LYS  86          2HE       LYS  86  96.998  -8.140   5.265
   57   2HE   LYS  86          1HE       LYS  86  98.088  -8.939   6.397
   58   1HZ   LYS  86          1HZ       LYS  86  95.766  -9.974   7.155
   59   2HZ   LYS  86          2HZ       LYS  86  96.747 -10.679   5.969
   60   3HZ   LYS  86          3HZ       LYS  86  95.432  -9.719   5.515
   61    H    ASP  87           H        ASP  87 100.817  -5.797   9.808
   62    HA   ASP  87           HA       ASP  87 102.064  -4.206   7.673
   63   1HB   ASP  87          2HB       ASP  87 100.840  -3.538  10.293
   64   2HB   ASP  87          1HB       ASP  87 102.241  -2.586   9.812
   65    H    ASP  88           H        ASP  88 104.207  -4.132   7.503
   66    HA   ASP  88           HA       ASP  88 105.863  -5.699   9.207
   67   1HB   ASP  88          2HB       ASP  88 106.350  -3.881   6.873
   68   2HB   ASP  88          1HB       ASP  88 107.712  -4.449   7.835
   69    H    SER  89           H        SER  89 107.809  -4.864  10.310
   70    HA   SER  89           HA       SER  89 107.187  -2.343  11.691
   71   1HB   SER  89          2HB       SER  89 107.676  -4.830  12.758
   72   2HB   SER  89          1HB       SER  89 109.251  -4.051  12.893
   73    HG   SER  89           HG       SER  89 108.048  -2.251  13.868
   74    H    LYS  90           H        LYS  90 110.184  -4.193  11.139
   75    HA   LYS  90           HA       LYS  90 111.883  -1.984  11.133
   76   1HB   LYS  90          2HB       LYS  90 112.140  -4.739   9.949
   77   2HB   LYS  90          1HB       LYS  90 113.430  -3.553   9.806
   78   1HG   LYS  90          2HG       LYS  90 112.637  -3.624  12.521
   79   2HG   LYS  90          1HG       LYS  90 112.834  -5.289  11.974
   80   1HD   LYS  90          2HD       LYS  90 115.034  -4.169  10.891
   81   2HD   LYS  90          1HD       LYS  90 114.841  -3.153  12.320
   82   1HE   LYS  90          2HE       LYS  90 115.045  -4.974  13.780
   83   2HE   LYS  90          1HE       LYS  90 114.744  -6.147  12.499
   84   1HZ   LYS  90          1HZ       LYS  90 117.165  -4.444  12.753
   85   2HZ   LYS  90          2HZ       LYS  90 116.878  -5.567  11.521
   86   3HZ   LYS  90          3HZ       LYS  90 117.076  -6.095  13.115
   87    H    GLY  91           H        GLY  91 112.873  -0.793   9.480
   88   1HA   GLY  91          2HA       GLY  91 111.397  -0.836   6.919
   89   2HA   GLY  91          1HA       GLY  91 112.007   0.631   7.668
   90    H    LYS  92           H        LYS  92 114.121   1.227   7.375
   91    HA   LYS  92           HA       LYS  92 115.511  -0.160   5.227
   92   1HB   LYS  92          2HB       LYS  92 115.543   2.563   6.375
   93   2HB   LYS  92          1HB       LYS  92 117.087   1.971   5.782
   94   1HG   LYS  92          2HG       LYS  92 116.403   2.776   3.815
   95   2HG   LYS  92          1HG       LYS  92 115.437   1.302   3.729
   96   1HD   LYS  92          2HD       LYS  92 114.168   3.464   5.240
   97   2HD   LYS  92          1HD       LYS  92 114.459   3.853   3.544
   98   1HE   LYS  92          2HE       LYS  92 113.424   1.524   3.087
   99   2HE   LYS  92          1HE       LYS  92 112.784   1.671   4.722
  100   1HZ   LYS  92          1HZ       LYS  92 112.059   3.125   2.308
  101   2HZ   LYS  92          2HZ       LYS  92 112.081   4.023   3.741
  102   3HZ   LYS  92          3HZ       LYS  92 111.099   2.652   3.619
  103    H    THR  93           H        THR  93 115.978  -1.996   6.685
  104    HA   THR  93           HA       THR  93 117.984  -1.541   8.726
  105    HB   THR  93           HB       THR  93 116.613  -3.229   9.461
  106    HG1  THR  93           HG1      THR  93 118.430  -4.308   9.703
  107   1HG2  THR  93          1HG2      THR  93 116.116  -5.231   7.799
  108   2HG2  THR  93          2HG2      THR  93 116.277  -3.936   6.610
  109   3HG2  THR  93          3HG2      THR  93 115.083  -3.805   7.903
  110    H    GLU  94           H        GLU  94 118.224  -4.319   6.577
  111    HA   GLU  94           HA       GLU  94 120.955  -3.477   5.919
  112   1HB   GLU  94          2HB       GLU  94 121.112  -5.919   5.134
  113   2HB   GLU  94          1HB       GLU  94 121.018  -5.618   6.864
  114   1HG   GLU  94          2HG       GLU  94 118.770  -6.305   6.965
  115   2HG   GLU  94          1HG       GLU  94 118.601  -6.261   5.211
  116    H    GLU  95           H        GLU  95 117.940  -4.516   4.506
  117    HA   GLU  95           HA       GLU  95 118.702  -4.768   1.829
  118   1HB   GLU  95          2HB       GLU  95 116.087  -3.941   3.085
  119   2HB   GLU  95          1HB       GLU  95 116.276  -4.137   1.348
  120   1HG   GLU  95          2HG       GLU  95 116.917  -6.472   1.684
  121   2HG   GLU  95          1HG       GLU  95 116.716  -6.273   3.423
  122    H    GLU  96           H        GLU  96 118.318  -1.954   3.792
  123    HA   GLU  96           HA       GLU  96 117.966  -0.074   1.674
  124   1HB   GLU  96          2HB       GLU  96 118.333   1.620   3.362
  125   2HB   GLU  96          1HB       GLU  96 117.283   0.370   4.015
  126   1HG   GLU  96          2HG       GLU  96 118.769  -0.250   5.581
  127   2HG   GLU  96          1HG       GLU  96 120.153  -0.013   4.518
  128    H    LEU  97           H        LEU  97 120.687  -1.639   3.138
  129    HA   LEU  97           HA       LEU  97 122.754   0.119   2.623
  130   1HB   LEU  97          2HB       LEU  97 122.694  -2.891   2.513
  131   2HB   LEU  97          1HB       LEU  97 124.173  -1.956   2.395
  132    HG   LEU  97           HG       LEU  97 122.295  -1.884   4.758
  133   1HD1  LEU  97          1HD1      LEU  97 125.006  -3.122   4.821
  134   2HD1  LEU  97          2HD1      LEU  97 123.642  -4.053   4.201
  135   3HD1  LEU  97          3HD1      LEU  97 123.604  -3.423   5.848
  136   1HD2  LEU  97          1HD2      LEU  97 124.798  -0.464   4.032
  137   2HD2  LEU  97          2HD2      LEU  97 124.595  -0.967   5.711
  138   3HD2  LEU  97          3HD2      LEU  97 123.404   0.094   4.959
  139    H    SER  98           H        SER  98 120.867  -1.719   0.377
  140    HA   SER  98           HA       SER  98 122.713  -1.728  -1.779
  141   1HB   SER  98          2HB       SER  98 120.735  -3.233  -1.641
  142   2HB   SER  98          1HB       SER  98 119.688  -1.838  -1.896
  143    HG   SER  98           HG       SER  98 121.732  -2.609  -3.700
  144    H    ASP  99           H        ASP  99 120.352   0.570  -0.603
  145    HA   ASP  99           HA       ASP  99 120.346   2.241  -2.908
  146   1HB   ASP  99          2HB       ASP  99 119.387   2.498  -0.088
  147   2HB   ASP  99          1HB       ASP  99 119.510   3.951  -1.076
  148    H    LEU 100           H        LEU 100 122.085   2.327   0.179
  149    HA   LEU 100           HA       LEU 100 123.489   4.740  -0.428
  150   1HB   LEU 100          2HB       LEU 100 123.486   2.733   1.739
  151   2HB   LEU 100          1HB       LEU 100 125.000   3.588   1.502
  152    HG   LEU 100           HG       LEU 100 122.534   5.234   1.664
  153   1HD1  LEU 100          1HD1      LEU 100 123.148   5.148   4.266
  154   2HD1  LEU 100          2HD1      LEU 100 123.511   3.479   3.828
  155   3HD1  LEU 100          3HD1      LEU 100 121.901   4.138   3.536
  156   1HD2  LEU 100          1HD2      LEU 100 124.007   6.797   2.710
  157   2HD2  LEU 100          2HD2      LEU 100 124.823   6.149   1.288
  158   3HD2  LEU 100          3HD2      LEU 100 125.262   5.571   2.895
  159    H    PHE 101           H        PHE 101 124.027   1.355  -1.010
  160    HA   PHE 101           HA       PHE 101 126.781   1.303  -1.403
  161   1HB   PHE 101          2HB       PHE 101 125.345  -0.706  -1.352
  162   2HB   PHE 101          1HB       PHE 101 124.676  -0.257  -2.916
  163    HD1  PHE 101           HD1      PHE 101 127.661  -1.473  -1.160
  164    HD2  PHE 101           HD2      PHE 101 125.896  -0.621  -4.936
  165    HE1  PHE 101           HE1      PHE 101 129.468  -2.711  -2.279
  166    HE2  PHE 101           HE2      PHE 101 127.699  -1.858  -6.063
  167    HZ   PHE 101           HZ       PHE 101 129.488  -2.906  -4.734
  168    H    ARG 102           H        ARG 102 124.187   2.176  -3.651
  169    HA   ARG 102           HA       ARG 102 125.748   2.453  -5.959
  170   1HB   ARG 102          2HB       ARG 102 123.114   3.515  -5.053
  171   2HB   ARG 102          1HB       ARG 102 123.854   4.244  -6.471
  172   1HG   ARG 102          2HG       ARG 102 123.286   1.305  -6.144
  173   2HG   ARG 102          1HG       ARG 102 122.267   2.448  -7.023
  174   1HD   ARG 102          2HD       ARG 102 124.391   2.986  -8.369
  175   2HD   ARG 102          1HD       ARG 102 125.028   1.488  -7.692
  176    HE   ARG 102           HE       ARG 102 123.034   1.754  -9.742
  177   1HH1  ARG 102          1HH1      ARG 102 124.298  -0.323  -7.239
  178   2HH1  ARG 102          2HH1      ARG 102 123.697  -1.775  -7.966
  179   1HH2  ARG 102          1HH2      ARG 102 122.242  -0.156 -10.700
  180   2HH2  ARG 102          2HH2      ARG 102 122.530  -1.681  -9.931
  181    H    MET 103           H        MET 103 125.114   4.666  -3.302
  182    HA   MET 103           HA       MET 103 126.046   7.043  -4.389
  183   1HB   MET 103          2HB       MET 103 126.325   6.053  -1.545
  184   2HB   MET 103          1HB       MET 103 126.540   7.720  -2.059
  185   1HG   MET 103          2HG       MET 103 123.981   6.312  -2.654
  186   2HG   MET 103          1HG       MET 103 124.283   6.937  -1.034
  187   1HE   MET 103          1HE       MET 103 125.887  10.082  -2.104
  188   2HE   MET 103          2HE       MET 103 125.365   9.141  -0.707
  189   3HE   MET 103          3HE       MET 103 124.444  10.559  -1.206
  190    H    PHE 104           H        PHE 104 127.828   4.322  -3.071
  191    HA   PHE 104           HA       PHE 104 130.365   5.637  -3.069
  192   1HB   PHE 104          2HB       PHE 104 129.410   2.839  -2.663
  193   2HB   PHE 104          1HB       PHE 104 131.114   3.096  -3.019
  194    HD1  PHE 104           HD1      PHE 104 132.588   3.649  -1.319
  195    HD2  PHE 104           HD2      PHE 104 128.410   4.175  -0.709
  196    HE1  PHE 104           HE1      PHE 104 133.005   4.180   1.046
  197    HE2  PHE 104           HE2      PHE 104 128.818   4.708   1.658
  198    HZ   PHE 104           HZ       PHE 104 131.118   4.711   2.538
  199    H    ASP 105           H        ASP 105 128.448   4.095  -5.473
  200    HA   ASP 105           HA       ASP 105 130.687   3.588  -7.247
  201   1HB   ASP 105          2HB       ASP 105 127.977   2.680  -7.036
  202   2HB   ASP 105          1HB       ASP 105 128.225   3.359  -8.640
  203    H    LYS 106           H        LYS 106 131.277   4.808  -8.966
  204    HA   LYS 106           HA       LYS 106 129.888   7.379  -9.293
  205   1HB   LYS 106          2HB       LYS 106 132.320   7.356  -8.583
  206   2HB   LYS 106          1HB       LYS 106 132.696   6.714 -10.175
  207   1HG   LYS 106          2HG       LYS 106 133.084   9.019 -10.323
  208   2HG   LYS 106          1HG       LYS 106 131.529   8.761 -11.116
  209   1HD   LYS 106          2HD       LYS 106 130.523   9.283  -8.792
  210   2HD   LYS 106          1HD       LYS 106 132.107   9.975  -8.437
  211   1HE   LYS 106          2HE       LYS 106 131.864  11.390 -10.479
  212   2HE   LYS 106          1HE       LYS 106 130.216  10.783 -10.642
  213   1HZ   LYS 106          1HZ       LYS 106 130.927  11.888  -8.047
  214   2HZ   LYS 106          2HZ       LYS 106 129.490  12.030  -8.930
  215   3HZ   LYS 106          3HZ       LYS 106 130.823  12.998  -9.321
  216    H    ASN 107           H        ASN 107 131.581   4.872 -11.168
  217    HA   ASN 107           HA       ASN 107 130.372   5.844 -13.627
  218   1HB   ASN 107          2HB       ASN 107 131.761   4.134 -14.728
  219   2HB   ASN 107          1HB       ASN 107 132.719   5.175 -13.679
  220   1HD2  ASN 107          1HD2      ASN 107 134.091   3.149 -14.126
  221   2HD2  ASN 107          2HD2      ASN 107 133.999   1.913 -12.923
  222    H    ALA 108           H        ALA 108 129.150   4.097 -11.222
  223    HA   ALA 108           HA       ALA 108 127.610   2.425 -10.987
  224   1HB   ALA 108          1HB       ALA 108 125.690   2.853 -12.131
  225   2HB   ALA 108          2HB       ALA 108 126.515   3.012 -13.681
  226   3HB   ALA 108          3HB       ALA 108 126.574   4.330 -12.510
  227    H    ASP 109           H        ASP 109 129.501   0.905 -11.304
  228    HA   ASP 109           HA       ASP 109 129.076  -0.749 -13.706
  229   1HB   ASP 109          2HB       ASP 109 131.401  -1.498 -13.474
  230   2HB   ASP 109          1HB       ASP 109 131.311   0.251 -13.652
  231    H    GLY 110           H        GLY 110 128.475  -0.644 -10.453
  232   1HA   GLY 110          2HA       GLY 110 127.378  -2.393  -9.301
  233   2HA   GLY 110          1HA       GLY 110 128.154  -3.550 -10.372
  234    H    TYR 111           H        TYR 111 130.604  -1.588  -9.605
  235    HA   TYR 111           HA       TYR 111 131.175  -2.731  -6.981
  236   1HB   TYR 111          2HB       TYR 111 133.074  -3.034  -9.318
  237   2HB   TYR 111          1HB       TYR 111 133.349  -3.585  -7.668
  238    HD1  TYR 111           HD1      TYR 111 132.678  -5.728  -7.008
  239    HD2  TYR 111           HD2      TYR 111 131.131  -4.077 -10.610
  240    HE1  TYR 111           HE1      TYR 111 131.667  -7.900  -7.560
  241    HE2  TYR 111           HE2      TYR 111 130.115  -6.244 -11.175
  242    HH   TYR 111           HH       TYR 111 129.329  -8.296  -9.903
  243    H    ILE 112           H        ILE 112 133.157  -1.771  -6.011
  244    HA   ILE 112           HA       ILE 112 133.557   0.984  -6.986
  245    HB   ILE 112           HB       ILE 112 133.793   0.099  -4.113
  246   1HG1  ILE 112          2HG1      ILE 112 131.553   1.776  -4.416
  247   2HG1  ILE 112          1HG1      ILE 112 131.423   0.575  -5.696
  248   1HG2  ILE 112          1HG2      ILE 112 133.451   2.631  -3.821
  249   2HG2  ILE 112          2HG2      ILE 112 133.870   2.739  -5.531
  250   3HG2  ILE 112          3HG2      ILE 112 135.022   2.059  -4.380
  251   1HD1  ILE 112          1HD1      ILE 112 130.710   0.300  -3.010
  252   2HD1  ILE 112          2HD1      ILE 112 132.144  -0.699  -3.238
  253   3HD1  ILE 112          3HD1      ILE 112 130.727  -0.946  -4.257
  254    H    ASP 113           H        ASP 113 135.560   1.508  -7.542
  255    HA   ASP 113           HA       ASP 113 137.755  -0.252  -6.681
  256   1HB   ASP 113          2HB       ASP 113 138.971   0.796  -8.663
  257   2HB   ASP 113          1HB       ASP 113 137.624  -0.271  -9.050
  258    H    LEU 114           H        LEU 114 139.957   1.062  -6.852
  259    HA   LEU 114           HA       LEU 114 139.954   2.859  -4.690
  260   1HB   LEU 114          2HB       LEU 114 142.094   2.493  -6.786
  261   2HB   LEU 114          1HB       LEU 114 142.308   3.211  -5.200
  262    HG   LEU 114           HG       LEU 114 141.403   0.362  -5.538
  263   1HD1  LEU 114          1HD1      LEU 114 144.226   0.892  -4.878
  264   2HD1  LEU 114          2HD1      LEU 114 143.755   1.180  -6.554
  265   3HD1  LEU 114          3HD1      LEU 114 143.501  -0.407  -5.827
  266   1HD2  LEU 114          1HD2      LEU 114 142.063   0.106  -3.282
  267   2HD2  LEU 114          2HD2      LEU 114 141.131   1.602  -3.354
  268   3HD2  LEU 114          3HD2      LEU 114 142.891   1.663  -3.270
  269    H    GLU 115           H        GLU 115 139.880   3.352  -8.167
  270    HA   GLU 115           HA       GLU 115 140.381   6.158  -8.062
  271   1HB   GLU 115          2HB       GLU 115 139.521   4.213 -10.146
  272   2HB   GLU 115          1HB       GLU 115 139.220   5.919 -10.442
  273   1HG   GLU 115          2HG       GLU 115 141.459   6.437 -10.538
  274   2HG   GLU 115          1HG       GLU 115 141.935   5.029  -9.591
  275    H    GLU 116           H        GLU 116 137.579   4.188  -7.626
  276    HA   GLU 116           HA       GLU 116 135.745   6.403  -8.066
  277   1HB   GLU 116          2HB       GLU 116 135.541   3.610  -8.255
  278   2HB   GLU 116          1HB       GLU 116 134.527   4.059  -6.892
  279   1HG   GLU 116          2HG       GLU 116 133.052   5.213  -8.185
  280   2HG   GLU 116          1HG       GLU 116 134.266   5.634  -9.391
  281    H    LEU 117           H        LEU 117 136.504   4.163  -5.395
  282    HA   LEU 117           HA       LEU 117 134.999   5.317  -3.403
  283   1HB   LEU 117          2HB       LEU 117 136.182   3.217  -3.106
  284   2HB   LEU 117          1HB       LEU 117 137.726   4.046  -3.172
  285    HG   LEU 117           HG       LEU 117 137.053   5.284  -1.088
  286   1HD1  LEU 117          1HD1      LEU 117 135.258   3.778   0.176
  287   2HD1  LEU 117          2HD1      LEU 117 134.661   3.585  -1.472
  288   3HD1  LEU 117          3HD1      LEU 117 134.812   5.197  -0.772
  289   1HD2  LEU 117          1HD2      LEU 117 138.222   2.832  -1.405
  290   2HD2  LEU 117          2HD2      LEU 117 136.947   2.494  -0.236
  291   3HD2  LEU 117          3HD2      LEU 117 138.146   3.740   0.104
  292    H    LYS 118           H        LYS 118 138.007   6.447  -4.763
  293    HA   LYS 118           HA       LYS 118 138.593   8.306  -2.674
  294   1HB   LYS 118          2HB       LYS 118 140.300   9.170  -4.158
  295   2HB   LYS 118          1HB       LYS 118 140.326   7.411  -4.191
  296   1HG   LYS 118          2HG       LYS 118 139.158   7.402  -6.309
  297   2HG   LYS 118          1HG       LYS 118 139.023   9.161  -6.266
  298   1HD   LYS 118          2HD       LYS 118 141.674   8.922  -5.974
  299   2HD   LYS 118          1HD       LYS 118 141.354   7.445  -6.885
  300   1HE   LYS 118          2HE       LYS 118 141.311   8.654  -8.747
  301   2HE   LYS 118          1HE       LYS 118 139.875   9.477  -8.142
  302   1HZ   LYS 118          1HZ       LYS 118 142.693  10.311  -7.714
  303   2HZ   LYS 118          2HZ       LYS 118 141.349  11.076  -7.032
  304   3HZ   LYS 118          3HZ       LYS 118 141.557  11.076  -8.709
  305    H    ILE 119           H        ILE 119 136.461   8.319  -5.364
  306    HA   ILE 119           HA       ILE 119 136.329  11.154  -5.723
  307    HB   ILE 119           HB       ILE 119 134.214   9.148  -6.496
  308   1HG1  ILE 119          2HG1      ILE 119 136.431   8.437  -7.331
  309   2HG1  ILE 119          1HG1      ILE 119 135.354   8.919  -8.637
  310   1HG2  ILE 119          1HG2      ILE 119 133.233  11.135  -6.968
  311   2HG2  ILE 119          2HG2      ILE 119 134.193  10.977  -8.439
  312   3HG2  ILE 119          3HG2      ILE 119 134.770  11.987  -7.113
  313   1HD1  ILE 119          1HD1      ILE 119 136.516  11.213  -8.430
  314   2HD1  ILE 119          2HD1      ILE 119 137.359   9.888  -9.230
  315   3HD1  ILE 119          3HD1      ILE 119 137.764  10.312  -7.567
  316    H    MET 120           H        MET 120 134.090   8.787  -4.272
  317    HA   MET 120           HA       MET 120 132.186  10.559  -3.326
  318   1HB   MET 120          2HB       MET 120 131.702   8.789  -1.593
  319   2HB   MET 120          1HB       MET 120 131.700   8.236  -3.261
  320   1HG   MET 120          2HG       MET 120 132.838   6.569  -2.128
  321   2HG   MET 120          1HG       MET 120 134.126   7.540  -2.833
  322   1HE   MET 120          1HE       MET 120 132.513   8.455   1.211
  323   2HE   MET 120          2HE       MET 120 132.700   6.701   1.181
  324   3HE   MET 120          3HE       MET 120 131.724   7.505  -0.047
  325    H    LEU 121           H        LEU 121 135.364   9.907  -2.107
  326    HA   LEU 121           HA       LEU 121 134.853  11.141   0.463
  327   1HB   LEU 121          2HB       LEU 121 137.067   9.677  -0.811
  328   2HB   LEU 121          1HB       LEU 121 137.564  10.942   0.298
  329    HG   LEU 121           HG       LEU 121 135.471   9.150   1.337
  330   1HD1  LEU 121          1HD1      LEU 121 137.571   7.590   1.919
  331   2HD1  LEU 121          2HD1      LEU 121 138.030   8.115   0.300
  332   3HD1  LEU 121          3HD1      LEU 121 136.491   7.294   0.557
  333   1HD2  LEU 121          1HD2      LEU 121 138.084  10.222   2.394
  334   2HD2  LEU 121          2HD2      LEU 121 136.942   9.250   3.323
  335   3HD2  LEU 121          3HD2      LEU 121 136.468  10.843   2.733
  336    H    GLN 122           H        GLN 122 136.279  11.995  -2.622
  337    HA   GLN 122           HA       GLN 122 137.499  14.414  -1.767
  338   1HB   GLN 122          2HB       GLN 122 136.816  13.178  -4.395
  339   2HB   GLN 122          1HB       GLN 122 137.177  14.899  -4.360
  340   1HG   GLN 122          2HG       GLN 122 139.079  13.154  -2.942
  341   2HG   GLN 122          1HG       GLN 122 139.026  12.985  -4.696
  342   1HE2  GLN 122          1HE2      GLN 122 141.244  13.925  -3.267
  343   2HE2  GLN 122          2HE2      GLN 122 141.513  15.576  -3.704
  344    H    ALA 123           H        ALA 123 134.283  13.543  -2.794
  345    HA   ALA 123           HA       ALA 123 133.311  16.117  -3.400
  346   1HB   ALA 123          1HB       ALA 123 131.077  15.127  -3.089
  347   2HB   ALA 123          2HB       ALA 123 131.831  13.684  -2.413
  348   3HB   ALA 123          3HB       ALA 123 132.125  14.127  -4.094
  349    H    THR 124           H        THR 124 133.934  14.525  -0.384
  350    HA   THR 124           HA       THR 124 132.186  15.887   1.311
  351    HB   THR 124           HB       THR 124 133.607  15.215   3.108
  352    HG1  THR 124           HG1      THR 124 135.747  14.542   2.724
  353   1HG2  THR 124          1HG2      THR 124 133.081  13.100   2.766
  354   2HG2  THR 124          2HG2      THR 124 134.530  12.926   1.775
  355   3HG2  THR 124          3HG2      THR 124 132.996  13.367   1.026
  356    H    GLY 125           H        GLY 125 133.098  17.429   3.095
  357   1HA   GLY 125          2HA       GLY 125 134.126  19.757   1.660
  358   2HA   GLY 125          1HA       GLY 125 133.381  19.763   3.251
  359    H    GLU 126           H        GLU 126 135.675  17.303   2.989
  360    HA   GLU 126           HA       GLU 126 137.685  18.996   4.317
  361   1HB   GLU 126          2HB       GLU 126 138.439  16.773   5.345
  362   2HB   GLU 126          1HB       GLU 126 136.944  17.476   5.945
  363   1HG   GLU 126          2HG       GLU 126 135.663  15.967   4.504
  364   2HG   GLU 126          1HG       GLU 126 137.170  15.252   3.933
  365    H    THR 127           H        THR 127 139.898  17.577   4.284
  366    HA   THR 127           HA       THR 127 140.367  16.902   1.454
  367    HB   THR 127           HB       THR 127 142.640  17.822   1.713
  368    HG1  THR 127           HG1      THR 127 142.837  17.571   3.969
  369   1HG2  THR 127          1HG2      THR 127 141.632  19.600   0.837
  370   2HG2  THR 127          2HG2      THR 127 141.700  20.265   2.469
  371   3HG2  THR 127          3HG2      THR 127 140.237  19.456   1.906
  372    H    ILE 128           H        ILE 128 140.793  14.814   1.237
  373    HA   ILE 128           HA       ILE 128 142.233  13.433   3.407
  374    HB   ILE 128           HB       ILE 128 140.498  12.114   1.324
  375   1HG1  ILE 128          2HG1      ILE 128 139.090  13.609   2.629
  376   2HG1  ILE 128          1HG1      ILE 128 138.779  11.941   3.104
  377   1HG2  ILE 128          1HG2      ILE 128 142.069  10.602   2.289
  378   2HG2  ILE 128          2HG2      ILE 128 140.496  10.271   3.014
  379   3HG2  ILE 128          3HG2      ILE 128 141.710  11.178   3.917
  380   1HD1  ILE 128          1HD1      ILE 128 140.440  12.375   4.998
  381   2HD1  ILE 128          2HD1      ILE 128 138.844  13.116   5.107
  382   3HD1  ILE 128          3HD1      ILE 128 140.231  14.082   4.606
  383    H    THR 129           H        THR 129 143.706  11.719   2.769
  384    HA   THR 129           HA       THR 129 145.167  12.447   0.347
  385    HB   THR 129           HB       THR 129 146.514  12.362   2.335
  386    HG1  THR 129           HG1      THR 129 148.050  10.901   1.663
  387   1HG2  THR 129          1HG2      THR 129 144.979   9.970   2.930
  388   2HG2  THR 129          2HG2      THR 129 145.875  11.046   4.004
  389   3HG2  THR 129          3HG2      THR 129 146.715   9.753   3.148
  390    H    GLU 130           H        GLU 130 146.147  10.664  -0.938
  391    HA   GLU 130           HA       GLU 130 144.112   8.876  -1.815
  392   1HB   GLU 130          2HB       GLU 130 146.396   9.957  -2.927
  393   2HB   GLU 130          1HB       GLU 130 146.820   8.262  -2.736
  394   1HG   GLU 130          2HG       GLU 130 145.302   7.562  -4.271
  395   2HG   GLU 130          1HG       GLU 130 144.179   8.877  -3.925
  396    H    ASP 131           H        ASP 131 146.740   8.628   0.423
  397    HA   ASP 131           HA       ASP 131 147.046   5.810   0.382
  398   1HB   ASP 131          2HB       ASP 131 148.048   8.050   1.954
  399   2HB   ASP 131          1HB       ASP 131 147.756   6.623   2.942
  400    H    ASP 132           H        ASP 132 145.361   7.944   2.696
  401    HA   ASP 132           HA       ASP 132 144.253   5.978   4.304
  402   1HB   ASP 132          2HB       ASP 132 144.177   8.685   4.298
  403   2HB   ASP 132          1HB       ASP 132 142.534   8.328   3.776
  404    H    ILE 133           H        ILE 133 143.109   7.264   1.233
  405    HA   ILE 133           HA       ILE 133 140.583   5.936   1.305
  406    HB   ILE 133           HB       ILE 133 142.048   6.932  -1.138
  407   1HG1  ILE 133          2HG1      ILE 133 139.986   8.501   0.388
  408   2HG1  ILE 133          1HG1      ILE 133 141.689   8.588   0.830
  409   1HG2  ILE 133          1HG2      ILE 133 139.740   5.472  -0.969
  410   2HG2  ILE 133          2HG2      ILE 133 140.187   6.526  -2.309
  411   3HG2  ILE 133          3HG2      ILE 133 139.137   7.128  -1.028
  412   1HD1  ILE 133          1HD1      ILE 133 142.168   9.266  -1.529
  413   2HD1  ILE 133          2HD1      ILE 133 141.219  10.421  -0.592
  414   3HD1  ILE 133          3HD1      ILE 133 140.426   9.383  -1.776
  415    H    GLU 134           H        GLU 134 143.790   5.065   0.275
  416    HA   GLU 134           HA       GLU 134 143.048   2.857  -1.360
  417   1HB   GLU 134          2HB       GLU 134 145.358   4.217  -0.982
  418   2HB   GLU 134          1HB       GLU 134 145.679   2.785  -0.013
  419   1HG   GLU 134          2HG       GLU 134 145.417   1.353  -1.878
  420   2HG   GLU 134          1HG       GLU 134 144.748   2.651  -2.865
  421    H    GLU 135           H        GLU 135 144.094   3.158   2.018
  422    HA   GLU 135           HA       GLU 135 144.148   0.424   2.630
  423   1HB   GLU 135          2HB       GLU 135 143.956   1.139   4.983
  424   2HB   GLU 135          1HB       GLU 135 145.151   2.076   4.098
  425   1HG   GLU 135          2HG       GLU 135 143.831   3.980   4.077
  426   2HG   GLU 135          1HG       GLU 135 142.351   3.076   4.397
  427    H    LEU 136           H        LEU 136 141.505   2.699   2.433
  428    HA   LEU 136           HA       LEU 136 139.566   1.288   3.877
  429   1HB   LEU 136          2HB       LEU 136 139.663   3.556   2.123
  430   2HB   LEU 136          1HB       LEU 136 138.283   2.561   1.701
  431    HG   LEU 136           HG       LEU 136 138.664   3.178   4.579
  432   1HD1  LEU 136          1HD1      LEU 136 137.429   5.211   2.745
  433   2HD1  LEU 136          2HD1      LEU 136 139.111   5.308   3.272
  434   3HD1  LEU 136          3HD1      LEU 136 137.809   5.363   4.461
  435   1HD2  LEU 136          1HD2      LEU 136 136.388   2.888   4.694
  436   2HD2  LEU 136          2HD2      LEU 136 136.795   1.813   3.356
  437   3HD2  LEU 136          3HD2      LEU 136 136.128   3.412   3.030
  438    H    MET 137           H        MET 137 140.792   0.865   0.635
  439    HA   MET 137           HA       MET 137 138.702  -0.821  -0.302
  440   1HB   MET 137          2HB       MET 137 140.560   0.478  -1.613
  441   2HB   MET 137          1HB       MET 137 141.504  -0.982  -1.353
  442   1HG   MET 137          2HG       MET 137 140.578  -1.762  -3.208
  443   2HG   MET 137          1HG       MET 137 139.090  -1.938  -2.279
  444   1HE   MET 137          1HE       MET 137 136.698   0.491  -3.688
  445   2HE   MET 137          2HE       MET 137 137.198  -0.317  -2.203
  446   3HE   MET 137          3HE       MET 137 136.971  -1.251  -3.681
  447    H    LYS 138           H        LYS 138 141.780  -1.393   1.312
  448    HA   LYS 138           HA       LYS 138 141.728  -4.225   1.027
  449   1HB   LYS 138          2HB       LYS 138 143.371  -2.238   2.475
  450   2HB   LYS 138          1HB       LYS 138 143.333  -3.851   3.174
  451   1HG   LYS 138          2HG       LYS 138 144.208  -4.822   1.193
  452   2HG   LYS 138          1HG       LYS 138 143.999  -3.320   0.290
  453   1HD   LYS 138          2HD       LYS 138 146.303  -3.465   0.825
  454   2HD   LYS 138          1HD       LYS 138 145.614  -2.260   1.914
  455   1HE   LYS 138          2HE       LYS 138 145.469  -4.921   3.041
  456   2HE   LYS 138          1HE       LYS 138 147.125  -4.487   2.622
  457   1HZ   LYS 138          1HZ       LYS 138 145.284  -2.933   4.359
  458   2HZ   LYS 138          2HZ       LYS 138 146.830  -2.427   3.900
  459   3HZ   LYS 138          3HZ       LYS 138 146.644  -3.806   4.861
  460    H    ASP 139           H        ASP 139 140.380  -1.977   3.318
  461    HA   ASP 139           HA       ASP 139 139.825  -3.963   5.323
  462   1HB   ASP 139          2HB       ASP 139 140.163  -1.415   5.650
  463   2HB   ASP 139          1HB       ASP 139 138.476  -1.281   5.164
  464    H    GLY 140           H        GLY 140 138.485  -3.412   2.347
  465   1HA   GLY 140          2HA       GLY 140 135.866  -4.434   3.254
  466   2HA   GLY 140          1HA       GLY 140 136.029  -3.307   1.917
  467    H    ASP 141           H        ASP 141 138.491  -4.724   0.979
  468    HA   ASP 141           HA       ASP 141 137.110  -6.717  -0.609
  469   1HB   ASP 141          2HB       ASP 141 139.660  -5.222  -0.796
  470   2HB   ASP 141          1HB       ASP 141 139.663  -6.841  -1.489
  471    H    LYS 142           H        LYS 142 136.737  -8.448   0.737
  472    HA   LYS 142           HA       LYS 142 138.600  -9.560   2.521
  473   1HB   LYS 142          2HB       LYS 142 136.315 -10.958   1.120
  474   2HB   LYS 142          1HB       LYS 142 137.131 -11.510   2.577
  475   1HG   LYS 142          2HG       LYS 142 135.396  -9.072   2.264
  476   2HG   LYS 142          1HG       LYS 142 135.060 -10.522   3.213
  477   1HD   LYS 142          2HD       LYS 142 137.481  -9.673   4.214
  478   2HD   LYS 142          1HD       LYS 142 136.633  -8.159   3.891
  479   1HE   LYS 142          2HE       LYS 142 134.654  -9.525   5.068
  480   2HE   LYS 142          1HE       LYS 142 136.033 -10.303   5.844
  481   1HZ   LYS 142          1HZ       LYS 142 135.218  -7.468   5.947
  482   2HZ   LYS 142          2HZ       LYS 142 136.809  -7.925   6.297
  483   3HZ   LYS 142          3HZ       LYS 142 135.533  -8.528   7.228
  484    H    ASN 143           H        ASN 143 138.276  -9.834  -0.909
  485    HA   ASN 143           HA       ASN 143 140.277 -11.995  -0.927
  486   1HB   ASN 143          2HB       ASN 143 139.468 -12.244  -3.377
  487   2HB   ASN 143          1HB       ASN 143 138.447 -12.865  -2.083
  488   1HD2  ASN 143          1HD2      ASN 143 136.688 -11.481  -1.359
  489   2HD2  ASN 143          2HD2      ASN 143 135.909 -10.452  -2.506
  490    H    ASN 144           H        ASN 144 140.318  -8.834  -0.964
  491    HA   ASN 144           HA       ASN 144 141.565  -7.176  -1.906
  492   1HB   ASN 144          2HB       ASN 144 143.469  -9.484  -2.337
  493   2HB   ASN 144          1HB       ASN 144 143.905  -7.777  -2.348
  494   1HD2  ASN 144          1HD2      ASN 144 145.409  -8.611  -0.678
  495   2HD2  ASN 144          2HD2      ASN 144 144.857  -8.636   0.959
  496    H    ASP 145           H        ASP 145 139.673  -8.273  -3.725
  497    HA   ASP 145           HA       ASP 145 140.930  -8.743  -6.253
  498   1HB   ASP 145          2HB       ASP 145 138.196  -8.639  -5.193
  499   2HB   ASP 145          1HB       ASP 145 138.338  -8.044  -6.844
  500    H    GLY 146           H        GLY 146 140.544  -5.959  -4.455
  501   1HA   GLY 146          2HA       GLY 146 141.259  -3.826  -5.108
  502   2HA   GLY 146          1HA       GLY 146 141.121  -4.317  -6.789
  503    H    ARG 147           H        ARG 147 138.315  -5.371  -5.907
  504    HA   ARG 147           HA       ARG 147 136.957  -2.768  -5.854
  505   1HB   ARG 147          2HB       ARG 147 136.145  -5.097  -7.597
  506   2HB   ARG 147          1HB       ARG 147 135.358  -3.528  -7.516
  507   1HG   ARG 147          2HG       ARG 147 137.909  -2.821  -8.140
  508   2HG   ARG 147          1HG       ARG 147 137.746  -4.363  -8.981
  509   1HD   ARG 147          2HD       ARG 147 135.461  -3.352  -9.760
  510   2HD   ARG 147          1HD       ARG 147 136.237  -1.818  -9.366
  511    HE   ARG 147           HE       ARG 147 138.059  -3.105 -10.929
  512   1HH1  ARG 147          1HH1      ARG 147 134.701  -2.240 -11.311
  513   2HH1  ARG 147          2HH1      ARG 147 134.812  -2.064 -13.030
  514   1HH2  ARG 147          1HH2      ARG 147 138.208  -2.878 -13.189
  515   2HH2  ARG 147          2HH2      ARG 147 136.804  -2.427 -14.097
  516    H    ILE 148           H        ILE 148 135.020  -2.694  -4.744
  517    HA   ILE 148           HA       ILE 148 134.412  -5.092  -3.147
  518    HB   ILE 148           HB       ILE 148 133.731  -2.229  -2.478
  519   1HG1  ILE 148          2HG1      ILE 148 135.926  -3.941  -1.297
  520   2HG1  ILE 148          1HG1      ILE 148 136.198  -2.722  -2.536
  521   1HG2  ILE 148          1HG2      ILE 148 133.756  -4.624  -0.657
  522   2HG2  ILE 148          2HG2      ILE 148 132.314  -4.087  -1.521
  523   3HG2  ILE 148          3HG2      ILE 148 133.084  -3.022  -0.345
  524   1HD1  ILE 148          1HD1      ILE 148 134.904  -2.055   0.082
  525   2HD1  ILE 148          2HD1      ILE 148 135.664  -0.971  -1.083
  526   3HD1  ILE 148          3HD1      ILE 148 136.655  -2.071  -0.126
  527    H    ASP 149           H        ASP 149 132.465  -6.000  -3.248
  528    HA   ASP 149           HA       ASP 149 130.434  -4.714  -4.938
  529   1HB   ASP 149          2HB       ASP 149 129.437  -7.038  -5.030
  530   2HB   ASP 149          1HB       ASP 149 131.017  -6.866  -5.791
  531    H    TYR 150           H        TYR 150 128.116  -5.611  -4.264
  532    HA   TYR 150           HA       TYR 150 127.482  -4.351  -1.830
  533   1HB   TYR 150          2HB       TYR 150 125.872  -4.563  -3.675
  534   2HB   TYR 150          1HB       TYR 150 125.826  -6.307  -3.441
  535    HD1  TYR 150           HD1      TYR 150 123.756  -6.914  -2.619
  536    HD2  TYR 150           HD2      TYR 150 125.632  -3.430  -1.056
  537    HE1  TYR 150           HE1      TYR 150 121.913  -6.651  -1.010
  538    HE2  TYR 150           HE2      TYR 150 123.795  -3.158   0.558
  539    HH   TYR 150           HH       TYR 150 121.487  -3.808   0.847
  540    H    ASP 151           H        ASP 151 128.521  -7.551  -2.522
  541    HA   ASP 151           HA       ASP 151 127.423  -8.757  -0.159
  542   1HB   ASP 151          2HB       ASP 151 128.982  -9.617  -2.470
  543   2HB   ASP 151          1HB       ASP 151 129.535 -10.365  -0.974
  544    H    GLU 152           H        GLU 152 130.698  -7.820  -1.185
  545    HA   GLU 152           HA       GLU 152 131.923  -8.340   1.304
  546   1HB   GLU 152          2HB       GLU 152 132.838  -6.406  -0.829
  547   2HB   GLU 152          1HB       GLU 152 133.834  -7.136   0.421
  548   1HG   GLU 152          2HG       GLU 152 133.140  -9.377  -0.630
  549   2HG   GLU 152          1HG       GLU 152 132.644  -8.401  -2.012
  550    H    PHE 153           H        PHE 153 130.531  -5.409  -0.113
  551    HA   PHE 153           HA       PHE 153 131.359  -3.669   1.966
  552   1HB   PHE 153          2HB       PHE 153 130.001  -3.418  -0.491
  553   2HB   PHE 153          1HB       PHE 153 128.921  -2.758   0.733
  554    HD1  PHE 153           HD1      PHE 153 131.111  -1.742  -1.587
  555    HD2  PHE 153           HD2      PHE 153 130.551  -1.435   2.620
  556    HE1  PHE 153           HE1      PHE 153 132.415   0.345  -1.570
  557    HE2  PHE 153           HE2      PHE 153 131.853   0.654   2.645
  558    HZ   PHE 153           HZ       PHE 153 132.786   1.545   0.548
  559    H    LEU 154           H        LEU 154 128.736  -5.907   1.664
  560    HA   LEU 154           HA       LEU 154 126.875  -4.853   3.436
  561   1HB   LEU 154          2HB       LEU 154 127.054  -7.133   1.984
  562   2HB   LEU 154          1HB       LEU 154 127.318  -7.768   3.596
  563    HG   LEU 154           HG       LEU 154 124.967  -7.919   2.967
  564   1HD1  LEU 154          1HD1      LEU 154 124.016  -6.962   4.938
  565   2HD1  LEU 154          2HD1      LEU 154 125.331  -5.792   5.067
  566   3HD1  LEU 154          3HD1      LEU 154 125.646  -7.507   5.332
  567   1HD2  LEU 154          1HD2      LEU 154 125.057  -5.904   1.451
  568   2HD2  LEU 154          2HD2      LEU 154 124.912  -4.912   2.902
  569   3HD2  LEU 154          3HD2      LEU 154 123.624  -6.036   2.470
  570    H    GLU 155           H        GLU 155 129.793  -6.730   4.069
  571    HA   GLU 155           HA       GLU 155 129.315  -6.823   6.914
  572   1HB   GLU 155          2HB       GLU 155 131.286  -7.935   5.030
  573   2HB   GLU 155          1HB       GLU 155 131.938  -7.525   6.611
  574   1HG   GLU 155          2HG       GLU 155 129.600  -8.850   7.214
  575   2HG   GLU 155          1HG       GLU 155 130.221  -9.723   5.813
  576    H    PHE 156           H        PHE 156 131.000  -4.783   4.662
  577    HA   PHE 156           HA       PHE 156 132.840  -3.542   6.356
  578   1HB   PHE 156          2HB       PHE 156 132.272  -3.318   3.736
  579   2HB   PHE 156          1HB       PHE 156 131.493  -1.853   4.321
  580    HD1  PHE 156           HD1      PHE 156 133.287  -0.989   6.454
  581    HD2  PHE 156           HD2      PHE 156 134.177  -2.629   2.630
  582    HE1  PHE 156           HE1      PHE 156 135.462   0.163   6.470
  583    HE2  PHE 156           HE2      PHE 156 136.352  -1.482   2.639
  584    HZ   PHE 156           HZ       PHE 156 136.998  -0.084   4.561
  585    H    MET 157           H        MET 157 129.466  -2.710   5.643
  586    HA   MET 157           HA       MET 157 129.514  -0.533   7.558
  587   1HB   MET 157          2HB       MET 157 128.159  -0.801   5.277
  588   2HB   MET 157          1HB       MET 157 126.962  -1.490   6.363
  589   1HG   MET 157          2HG       MET 157 126.327   0.516   7.027
  590   2HG   MET 157          1HG       MET 157 127.977   0.938   7.480
  591   1HE   MET 157          1HE       MET 157 129.211   1.554   3.739
  592   2HE   MET 157          2HE       MET 157 129.539   0.641   5.212
  593   3HE   MET 157          3HE       MET 157 129.713   2.395   5.206
  594    H    LYS 158           H        LYS 158 129.442  -3.729   7.995
  595    HA   LYS 158           HA       LYS 158 127.343  -3.735  10.041
  596   1HB   LYS 158          2HB       LYS 158 128.224  -5.663   8.198
  597   2HB   LYS 158          1HB       LYS 158 128.774  -6.236   9.768
  598   1HG   LYS 158          2HG       LYS 158 126.510  -6.121  10.632
  599   2HG   LYS 158          1HG       LYS 158 125.940  -5.473   9.093
  600   1HD   LYS 158          2HD       LYS 158 126.858  -7.589   8.031
  601   2HD   LYS 158          1HD       LYS 158 127.023  -8.220   9.671
  602   1HE   LYS 158          2HE       LYS 158 124.624  -7.868  10.039
  603   2HE   LYS 158          1HE       LYS 158 124.467  -7.254   8.394
  604   1HZ   LYS 158          1HZ       LYS 158 125.607  -9.596   7.915
  605   2HZ   LYS 158          2HZ       LYS 158 123.930  -9.391   7.991
  606   3HZ   LYS 158          3HZ       LYS 158 124.769  -9.989   9.332
  607    H    GLY 159           H        GLY 159 129.722  -2.206  10.414
  608   1HA   GLY 159          2HA       GLY 159 130.625  -1.953  12.691
  609   2HA   GLY 159          1HA       GLY 159 130.971  -3.678  12.651
  610    H    VAL 160           H        VAL 160 132.433  -0.791  12.511
  611    HA   VAL 160           HA       VAL 160 134.608  -1.843  10.837
  612    HB   VAL 160           HB       VAL 160 134.371   1.081  10.767
  613   1HG1  VAL 160          1HG1      VAL 160 134.712  -1.039   8.650
  614   2HG1  VAL 160          2HG1      VAL 160 135.999  -0.136   9.448
  615   3HG1  VAL 160          3HG1      VAL 160 134.861   0.698   8.388
  616   1HG2  VAL 160          1HG2      VAL 160 132.222  -0.634   9.532
  617   2HG2  VAL 160          2HG2      VAL 160 132.589   1.003   8.987
  618   3HG2  VAL 160          3HG2      VAL 160 132.022   0.728  10.634
  619    H    GLU 161           H        GLU 161 134.501  -2.062  13.604
  620    HA   GLU 161           HA       GLU 161 136.727  -0.309  14.365
  621   1HB   GLU 161          2HB       GLU 161 135.743  -0.174  16.676
  622   2HB   GLU 161          1HB       GLU 161 134.862   0.717  15.441
  623   1HG   GLU 161          2HG       GLU 161 133.585  -1.667  15.360
  624   2HG   GLU 161          1HG       GLU 161 134.044  -1.587  17.060
  Start of MODEL    3
    1   1H    MET  81          1HT       MET  81  88.837  -7.654   8.688
    2   2H    MET  81          2HT       MET  81  89.039  -6.162   9.514
    3   3H    MET  81          3HT       MET  81  87.502  -6.595   8.882
    4    HA   MET  81           HA       MET  81  87.346  -6.987  11.122
    5   1HB   MET  81          2HB       MET  81  86.737  -8.842   9.426
    6   2HB   MET  81          1HB       MET  81  88.160  -9.675  10.037
    7   1HG   MET  81          2HG       MET  81  87.008  -9.179  12.362
    8   2HG   MET  81          1HG       MET  81  85.562  -9.133  11.356
    9   1HE   MET  81          1HE       MET  81  84.423 -10.675  12.391
   10   2HE   MET  81          2HE       MET  81  84.834 -12.346  12.777
   11   3HE   MET  81          3HE       MET  81  84.227 -11.933  11.173
   12    H    VAL  82           H        VAL  82  88.528  -6.642  12.876
   13    HA   VAL  82           HA       VAL  82  90.140  -6.833  14.474
   14    HB   VAL  82           HB       VAL  82  91.217  -9.199  12.941
   15   1HG1  VAL  82          1HG1      VAL  82  91.296  -9.089  15.882
   16   2HG1  VAL  82          2HG1      VAL  82  92.324  -7.928  15.045
   17   3HG1  VAL  82          3HG1      VAL  82  92.508  -9.654  14.733
   18   1HG2  VAL  82          1HG2      VAL  82  88.964  -9.755  13.269
   19   2HG2  VAL  82          2HG2      VAL  82  88.921  -9.004  14.865
   20   3HG2  VAL  82          3HG2      VAL  82  89.809 -10.509  14.620
   21    H    ARG  83           H        ARG  83  91.816  -7.941  11.525
   22    HA   ARG  83           HA       ARG  83  93.912  -5.969  12.036
   23   1HB   ARG  83          2HB       ARG  83  94.535  -8.333  11.598
   24   2HB   ARG  83          1HB       ARG  83  93.830  -8.197   9.993
   25   1HG   ARG  83          2HG       ARG  83  95.458  -6.489   9.404
   26   2HG   ARG  83          1HG       ARG  83  96.149  -6.576  11.025
   27   1HD   ARG  83          2HD       ARG  83  97.258  -8.489  10.590
   28   2HD   ARG  83          1HD       ARG  83  95.948  -9.144   9.609
   29    HE   ARG  83           HE       ARG  83  98.243  -7.706   8.683
   30   1HH1  ARG  83          1HH1      ARG  83  94.912  -8.474   7.984
   31   2HH1  ARG  83          2HH1      ARG  83  95.083  -8.230   6.280
   32   1HH2  ARG  83          1HH2      ARG  83  98.470  -7.383   6.439
   33   2HH2  ARG  83          2HH2      ARG  83  97.102  -7.610   5.402
   34    H    CYS  84           H        CYS  84  94.337  -4.266  10.733
   35    HA   CYS  84           HA       CYS  84  92.720  -3.979   8.290
   36   1HB   CYS  84          2HB       CYS  84  92.688  -1.487   8.848
   37   2HB   CYS  84          1HB       CYS  84  91.659  -2.528   9.824
   38    HG   CYS  84           HG       CYS  84  93.979  -0.863  10.843
   39    H    MET  85           H        MET  85  95.593  -2.858  10.047
   40    HA   MET  85           HA       MET  85  97.263  -3.112   7.770
   41   1HB   MET  85          2HB       MET  85  95.810  -0.795   7.702
   42   2HB   MET  85          1HB       MET  85  97.274  -0.269   8.525
   43   1HG   MET  85          2HG       MET  85  98.226  -1.764   6.414
   44   2HG   MET  85          1HG       MET  85  96.834  -0.927   5.735
   45   1HE   MET  85          1HE       MET  85  99.550  -0.930   4.831
   46   2HE   MET  85          2HE       MET  85 100.740   0.171   5.525
   47   3HE   MET  85          3HE       MET  85  99.650   0.737   4.260
   48    H    LYS  86           H        LYS  86  98.923  -3.984   8.835
   49    HA   LYS  86           HA       LYS  86  99.849  -2.674  11.303
   50   1HB   LYS  86          2HB       LYS  86 100.893  -4.809  11.887
   51   2HB   LYS  86          1HB       LYS  86  99.166  -5.003  11.615
   52   1HG   LYS  86          2HG       LYS  86  99.551  -5.977   9.461
   53   2HG   LYS  86          1HG       LYS  86 101.279  -5.629   9.566
   54   1HD   LYS  86          2HD       LYS  86 101.058  -7.058  11.786
   55   2HD   LYS  86          1HD       LYS  86  99.672  -7.730  10.926
   56   1HE   LYS  86          2HE       LYS  86 101.741  -7.651   9.050
   57   2HE   LYS  86          1HE       LYS  86 102.487  -8.223  10.543
   58   1HZ   LYS  86          1HZ       LYS  86  99.935  -9.420   9.790
   59   2HZ   LYS  86          2HZ       LYS  86 101.288 -10.126  10.521
   60   3HZ   LYS  86          3HZ       LYS  86 101.279  -9.839   8.855
   61    H    ASP  87           H        ASP  87 102.342  -3.384  11.609
   62    HA   ASP  87           HA       ASP  87 103.732  -1.945   9.552
   63   1HB   ASP  87          2HB       ASP  87 104.752  -3.373  12.018
   64   2HB   ASP  87          1HB       ASP  87 105.736  -2.355  10.969
   65    H    ASP  88           H        ASP  88 104.917  -2.720   7.909
   66    HA   ASP  88           HA       ASP  88 104.728  -5.470   7.210
   67   1HB   ASP  88          2HB       ASP  88 105.413  -3.049   5.906
   68   2HB   ASP  88          1HB       ASP  88 106.776  -4.145   5.698
   69    H    SER  89           H        SER  89 107.768  -3.627   7.327
   70    HA   SER  89           HA       SER  89 108.964  -5.849   8.847
   71   1HB   SER  89          2HB       SER  89 109.803  -6.126   6.644
   72   2HB   SER  89          1HB       SER  89 110.052  -4.391   6.438
   73    HG   SER  89           HG       SER  89 111.675  -6.270   7.591
   74    H    LYS  90           H        LYS  90 111.151  -5.142   9.809
   75    HA   LYS  90           HA       LYS  90 110.706  -3.016  11.579
   76   1HB   LYS  90          2HB       LYS  90 113.030  -3.337  12.268
   77   2HB   LYS  90          1HB       LYS  90 112.218  -4.883  12.070
   78   1HG   LYS  90          2HG       LYS  90 113.329  -4.434   9.590
   79   2HG   LYS  90          1HG       LYS  90 114.545  -3.812  10.706
   80   1HD   LYS  90          2HD       LYS  90 115.072  -6.090  10.396
   81   2HD   LYS  90          1HD       LYS  90 114.289  -5.994  11.975
   82   1HE   LYS  90          2HE       LYS  90 112.636  -6.549   9.556
   83   2HE   LYS  90          1HE       LYS  90 113.607  -7.847  10.248
   84   1HZ   LYS  90          1HZ       LYS  90 111.785  -8.143  11.505
   85   2HZ   LYS  90          2HZ       LYS  90 111.222  -6.563  11.286
   86   3HZ   LYS  90          3HZ       LYS  90 112.427  -6.879  12.431
   87    H    GLY  91           H        GLY  91 112.916  -1.465  11.747
   88   1HA   GLY  91          2HA       GLY  91 112.443   0.472   9.699
   89   2HA   GLY  91          1HA       GLY  91 113.617   0.599  10.999
   90    H    LYS  92           H        LYS  92 115.327   1.331   9.816
   91    HA   LYS  92           HA       LYS  92 116.107   0.247   7.313
   92   1HB   LYS  92          2HB       LYS  92 117.900   1.726   9.234
   93   2HB   LYS  92          1HB       LYS  92 118.038   1.636   7.484
   94   1HG   LYS  92          2HG       LYS  92 116.600   3.317   7.164
   95   2HG   LYS  92          1HG       LYS  92 115.499   2.745   8.418
   96   1HD   LYS  92          2HD       LYS  92 116.608   3.893  10.095
   97   2HD   LYS  92          1HD       LYS  92 118.117   3.972   9.183
   98   1HE   LYS  92          2HE       LYS  92 116.770   5.454   7.546
   99   2HE   LYS  92          1HE       LYS  92 115.641   5.631   8.888
  100   1HZ   LYS  92          1HZ       LYS  92 118.462   6.082   9.471
  101   2HZ   LYS  92          2HZ       LYS  92 117.093   6.880  10.065
  102   3HZ   LYS  92          3HZ       LYS  92 117.688   7.252   8.526
  103    H    THR  93           H        THR  93 116.862  -1.742   7.017
  104    HA   THR  93           HA       THR  93 118.574  -2.925   9.101
  105    HB   THR  93           HB       THR  93 117.355  -4.701   7.078
  106    HG1  THR  93           HG1      THR  93 115.347  -4.361   7.603
  107   1HG2  THR  93          1HG2      THR  93 117.103  -5.013  10.027
  108   2HG2  THR  93          2HG2      THR  93 118.652  -5.315   9.240
  109   3HG2  THR  93          3HG2      THR  93 117.227  -6.243   8.770
  110    H    GLU  94           H        GLU  94 119.392  -5.117   7.394
  111    HA   GLU  94           HA       GLU  94 121.642  -3.900   6.137
  112   1HB   GLU  94          2HB       GLU  94 120.714  -6.604   6.748
  113   2HB   GLU  94          1HB       GLU  94 121.593  -6.502   5.229
  114   1HG   GLU  94          2HG       GLU  94 123.407  -5.297   6.510
  115   2HG   GLU  94          1HG       GLU  94 122.556  -5.777   7.978
  116    H    GLU  95           H        GLU  95 118.512  -4.206   5.110
  117    HA   GLU  95           HA       GLU  95 119.017  -4.824   2.338
  118   1HB   GLU  95          2HB       GLU  95 116.686  -4.454   4.050
  119   2HB   GLU  95          1HB       GLU  95 116.487  -3.682   2.483
  120   1HG   GLU  95          2HG       GLU  95 117.568  -6.406   2.389
  121   2HG   GLU  95          1HG       GLU  95 115.922  -6.272   3.011
  122    H    GLU  96           H        GLU  96 118.703  -1.973   4.320
  123    HA   GLU  96           HA       GLU  96 118.321  -0.119   2.196
  124   1HB   GLU  96          2HB       GLU  96 119.509   0.468   4.906
  125   2HB   GLU  96          1HB       GLU  96 118.686   1.591   3.832
  126   1HG   GLU  96          2HG       GLU  96 117.144  -0.768   4.711
  127   2HG   GLU  96          1HG       GLU  96 117.513   0.444   5.935
  128    H    LEU  97           H        LEU  97 121.067  -1.772   3.434
  129    HA   LEU  97           HA       LEU  97 123.142  -0.012   2.910
  130   1HB   LEU  97          2HB       LEU  97 122.834  -2.863   3.317
  131   2HB   LEU  97          1HB       LEU  97 124.101  -2.524   2.155
  132    HG   LEU  97           HG       LEU  97 124.097  -1.017   4.730
  133   1HD1  LEU  97          1HD1      LEU  97 125.692  -3.050   5.398
  134   2HD1  LEU  97          2HD1      LEU  97 124.513  -3.928   4.423
  135   3HD1  LEU  97          3HD1      LEU  97 123.981  -2.996   5.824
  136   1HD2  LEU  97          1HD2      LEU  97 126.167  -2.017   2.790
  137   2HD2  LEU  97          2HD2      LEU  97 126.578  -1.342   4.365
  138   3HD2  LEU  97          3HD2      LEU  97 125.743  -0.348   3.170
  139    H    SER  98           H        SER  98 121.086  -1.685   0.693
  140    HA   SER  98           HA       SER  98 122.782  -1.705  -1.565
  141   1HB   SER  98          2HB       SER  98 120.853  -2.253  -2.830
  142   2HB   SER  98          1HB       SER  98 120.580  -2.968  -1.240
  143    HG   SER  98           HG       SER  98 119.013  -1.577  -0.868
  144    H    ASP  99           H        ASP  99 120.324   0.611  -0.464
  145    HA   ASP  99           HA       ASP  99 120.506   2.399  -2.606
  146   1HB   ASP  99          2HB       ASP  99 119.568   2.575   0.217
  147   2HB   ASP  99          1HB       ASP  99 119.829   4.083  -0.654
  148    H    LEU 100           H        LEU 100 122.345   2.220   0.409
  149    HA   LEU 100           HA       LEU 100 123.842   4.602  -0.088
  150   1HB   LEU 100          2HB       LEU 100 124.176   2.312   1.834
  151   2HB   LEU 100          1HB       LEU 100 125.333   3.627   1.745
  152    HG   LEU 100           HG       LEU 100 122.476   4.358   2.111
  153   1HD1  LEU 100          1HD1      LEU 100 122.718   2.491   3.651
  154   2HD1  LEU 100          2HD1      LEU 100 122.629   4.018   4.529
  155   3HD1  LEU 100          3HD1      LEU 100 124.182   3.214   4.317
  156   1HD2  LEU 100          1HD2      LEU 100 123.642   5.978   3.701
  157   2HD2  LEU 100          2HD2      LEU 100 123.950   6.175   1.975
  158   3HD2  LEU 100          3HD2      LEU 100 125.151   5.390   3.001
  159    H    PHE 101           H        PHE 101 124.228   1.225  -0.870
  160    HA   PHE 101           HA       PHE 101 126.965   1.160  -1.422
  161   1HB   PHE 101          2HB       PHE 101 125.534  -0.849  -1.304
  162   2HB   PHE 101          1HB       PHE 101 124.755  -0.373  -2.810
  163    HD1  PHE 101           HD1      PHE 101 125.891  -0.603  -4.926
  164    HD2  PHE 101           HD2      PHE 101 127.793  -1.715  -1.285
  165    HE1  PHE 101           HE1      PHE 101 127.611  -1.815  -6.200
  166    HE2  PHE 101           HE2      PHE 101 129.517  -2.930  -2.552
  167    HZ   PHE 101           HZ       PHE 101 129.428  -2.981  -5.013
  168    H    ARG 102           H        ARG 102 124.226   1.937  -3.549
  169    HA   ARG 102           HA       ARG 102 125.668   2.302  -5.912
  170   1HB   ARG 102          2HB       ARG 102 123.013   3.099  -4.892
  171   2HB   ARG 102          1HB       ARG 102 123.640   4.081  -6.209
  172   1HG   ARG 102          2HG       ARG 102 123.749   1.128  -6.492
  173   2HG   ARG 102          1HG       ARG 102 122.185   1.929  -6.647
  174   1HD   ARG 102          2HD       ARG 102 124.603   2.861  -8.164
  175   2HD   ARG 102          1HD       ARG 102 123.560   1.579  -8.778
  176    HE   ARG 102           HE       ARG 102 121.819   3.569  -8.223
  177   1HH1  ARG 102          1HH1      ARG 102 124.779   3.449 -10.065
  178   2HH1  ARG 102          2HH1      ARG 102 124.295   4.697 -11.162
  179   1HH2  ARG 102          1HH2      ARG 102 121.178   5.210  -9.665
  180   2HH2  ARG 102          2HH2      ARG 102 122.250   5.698 -10.934
  181    H    MET 103           H        MET 103 125.071   4.489  -3.222
  182    HA   MET 103           HA       MET 103 125.890   6.886  -4.391
  183   1HB   MET 103          2HB       MET 103 125.628   5.850  -1.633
  184   2HB   MET 103          1HB       MET 103 126.701   7.228  -1.831
  185   1HG   MET 103          2HG       MET 103 123.860   7.157  -2.814
  186   2HG   MET 103          1HG       MET 103 124.352   7.805  -1.250
  187   1HE   MET 103          1HE       MET 103 123.820  11.122  -2.276
  188   2HE   MET 103          2HE       MET 103 125.240  10.800  -1.279
  189   3HE   MET 103          3HE       MET 103 123.792   9.811  -1.097
  190    H    PHE 104           H        PHE 104 127.742   4.192  -3.182
  191    HA   PHE 104           HA       PHE 104 130.246   5.613  -3.170
  192   1HB   PHE 104          2HB       PHE 104 129.325   2.876  -2.532
  193   2HB   PHE 104          1HB       PHE 104 130.979   3.002  -3.122
  194    HD1  PHE 104           HD1      PHE 104 132.510   4.696  -1.947
  195    HD2  PHE 104           HD2      PHE 104 128.843   3.292  -0.305
  196    HE1  PHE 104           HE1      PHE 104 133.262   5.368   0.297
  197    HE2  PHE 104           HE2      PHE 104 129.588   3.963   1.942
  198    HZ   PHE 104           HZ       PHE 104 131.800   5.003   2.246
  199    H    ASP 105           H        ASP 105 128.369   3.850  -5.473
  200    HA   ASP 105           HA       ASP 105 130.619   3.469  -7.279
  201   1HB   ASP 105          2HB       ASP 105 128.386   1.986  -6.866
  202   2HB   ASP 105          1HB       ASP 105 127.873   2.952  -8.245
  203    H    LYS 106           H        LYS 106 130.942   4.578  -9.168
  204    HA   LYS 106           HA       LYS 106 129.233   6.942  -9.581
  205   1HB   LYS 106          2HB       LYS 106 131.522   7.500  -8.881
  206   2HB   LYS 106          1HB       LYS 106 132.164   6.590 -10.241
  207   1HG   LYS 106          2HG       LYS 106 132.247   8.870 -10.845
  208   2HG   LYS 106          1HG       LYS 106 130.907   8.160 -11.749
  209   1HD   LYS 106          2HD       LYS 106 130.285  10.332 -10.828
  210   2HD   LYS 106          1HD       LYS 106 129.329   9.040 -10.095
  211   1HE   LYS 106          2HE       LYS 106 130.280   9.309  -8.053
  212   2HE   LYS 106          1HE       LYS 106 131.841   9.779  -8.722
  213   1HZ   LYS 106          1HZ       LYS 106 130.994  11.697  -7.723
  214   2HZ   LYS 106          2HZ       LYS 106 129.436  11.456  -8.337
  215   3HZ   LYS 106          3HZ       LYS 106 130.689  11.924  -9.372
  216    H    ASN 107           H        ASN 107 131.176   4.479 -11.238
  217    HA   ASN 107           HA       ASN 107 130.057   5.189 -13.812
  218   1HB   ASN 107          2HB       ASN 107 131.481   3.388 -14.684
  219   2HB   ASN 107          1HB       ASN 107 132.399   4.491 -13.664
  220   1HD2  ASN 107          1HD2      ASN 107 133.021   1.768 -14.371
  221   2HD2  ASN 107          2HD2      ASN 107 133.117   0.881 -12.891
  222    H    ALA 108           H        ALA 108 128.821   3.555 -11.270
  223    HA   ALA 108           HA       ALA 108 127.273   1.906 -10.962
  224   1HB   ALA 108          1HB       ALA 108 125.500   1.901 -12.830
  225   2HB   ALA 108          2HB       ALA 108 126.446   3.220 -13.523
  226   3HB   ALA 108          3HB       ALA 108 125.751   3.386 -11.911
  227    H    ASP 109           H        ASP 109 129.118   0.344 -11.243
  228    HA   ASP 109           HA       ASP 109 128.577  -1.419 -13.542
  229   1HB   ASP 109          2HB       ASP 109 130.934  -2.112 -13.479
  230   2HB   ASP 109          1HB       ASP 109 130.780  -0.381 -13.769
  231    H    GLY 110           H        GLY 110 128.213  -1.132 -10.282
  232   1HA   GLY 110          2HA       GLY 110 127.299  -2.822  -8.918
  233   2HA   GLY 110          1HA       GLY 110 127.986  -4.031  -9.992
  234    H    TYR 111           H        TYR 111 130.526  -2.165  -9.699
  235    HA   TYR 111           HA       TYR 111 131.363  -3.118  -7.055
  236   1HB   TYR 111          2HB       TYR 111 133.062  -3.411  -9.540
  237   2HB   TYR 111          1HB       TYR 111 133.455  -3.967  -7.918
  238    HD1  TYR 111           HD1      TYR 111 131.892  -5.748  -6.886
  239    HD2  TYR 111           HD2      TYR 111 132.010  -4.847 -11.043
  240    HE1  TYR 111           HE1      TYR 111 130.869  -7.929  -7.381
  241    HE2  TYR 111           HE2      TYR 111 130.986  -7.025 -11.549
  242    HH   TYR 111           HH       TYR 111 130.954  -9.414 -10.150
  243    H    ILE 112           H        ILE 112 132.912  -1.852  -6.029
  244    HA   ILE 112           HA       ILE 112 133.385   0.762  -7.294
  245    HB   ILE 112           HB       ILE 112 133.478   0.104  -4.349
  246   1HG1  ILE 112          2HG1      ILE 112 131.333   1.867  -5.200
  247   2HG1  ILE 112          1HG1      ILE 112 131.218   0.295  -5.987
  248   1HG2  ILE 112          1HG2      ILE 112 134.786   1.993  -4.610
  249   2HG2  ILE 112          2HG2      ILE 112 133.194   2.680  -4.285
  250   3HG2  ILE 112          3HG2      ILE 112 133.807   2.614  -5.938
  251   1HD1  ILE 112          1HD1      ILE 112 131.605  -0.576  -3.533
  252   2HD1  ILE 112          2HD1      ILE 112 130.005  -0.103  -4.107
  253   3HD1  ILE 112          3HD1      ILE 112 130.954   1.010  -3.122
  254    H    ASP 113           H        ASP 113 135.390   1.358  -7.771
  255    HA   ASP 113           HA       ASP 113 137.606  -0.286  -6.751
  256   1HB   ASP 113          2HB       ASP 113 138.867   0.513  -8.728
  257   2HB   ASP 113          1HB       ASP 113 137.398  -0.349  -9.174
  258    H    LEU 114           H        LEU 114 139.764   1.199  -7.090
  259    HA   LEU 114           HA       LEU 114 139.665   3.038  -4.949
  260   1HB   LEU 114          2HB       LEU 114 141.646   1.645  -5.859
  261   2HB   LEU 114          1HB       LEU 114 141.872   2.975  -6.977
  262    HG   LEU 114           HG       LEU 114 141.771   4.343  -4.652
  263   1HD1  LEU 114          1HD1      LEU 114 143.276   3.022  -3.091
  264   2HD1  LEU 114          2HD1      LEU 114 142.798   1.596  -4.011
  265   3HD1  LEU 114          3HD1      LEU 114 141.579   2.543  -3.158
  266   1HD2  LEU 114          1HD2      LEU 114 144.277   3.017  -5.664
  267   2HD2  LEU 114          2HD2      LEU 114 144.136   4.563  -4.830
  268   3HD2  LEU 114          3HD2      LEU 114 143.500   4.382  -6.465
  269    H    GLU 115           H        GLU 115 139.462   3.404  -8.423
  270    HA   GLU 115           HA       GLU 115 139.936   6.193  -8.525
  271   1HB   GLU 115          2HB       GLU 115 138.925   4.117 -10.361
  272   2HB   GLU 115          1HB       GLU 115 138.362   5.748 -10.695
  273   1HG   GLU 115          2HG       GLU 115 141.268   5.207 -10.266
  274   2HG   GLU 115          1HG       GLU 115 140.514   4.890 -11.828
  275    H    GLU 116           H        GLU 116 136.878   4.361  -8.716
  276    HA   GLU 116           HA       GLU 116 135.169   6.568  -8.662
  277   1HB   GLU 116          2HB       GLU 116 134.845   3.677  -7.933
  278   2HB   GLU 116          1HB       GLU 116 133.536   4.811  -7.621
  279   1HG   GLU 116          2HG       GLU 116 132.874   4.321  -9.688
  280   2HG   GLU 116          1HG       GLU 116 134.174   5.393 -10.205
  281    H    LEU 117           H        LEU 117 136.295   4.520  -5.980
  282    HA   LEU 117           HA       LEU 117 134.930   5.803  -3.916
  283   1HB   LEU 117          2HB       LEU 117 136.207   3.636  -3.784
  284   2HB   LEU 117          1HB       LEU 117 137.680   4.583  -3.705
  285    HG   LEU 117           HG       LEU 117 136.867   5.636  -1.617
  286   1HD1  LEU 117          1HD1      LEU 117 134.950   4.344  -0.492
  287   2HD1  LEU 117          2HD1      LEU 117 134.526   3.839  -2.129
  288   3HD1  LEU 117          3HD1      LEU 117 134.545   5.553  -1.712
  289   1HD2  LEU 117          1HD2      LEU 117 137.726   3.976  -0.352
  290   2HD2  LEU 117          2HD2      LEU 117 138.076   3.252  -1.922
  291   3HD2  LEU 117          3HD2      LEU 117 136.642   2.757  -1.022
  292    H    LYS 118           H        LYS 118 137.999   6.577  -5.453
  293    HA   LYS 118           HA       LYS 118 139.000   8.456  -3.685
  294   1HB   LYS 118          2HB       LYS 118 140.141   7.543  -5.730
  295   2HB   LYS 118          1HB       LYS 118 139.171   8.651  -6.693
  296   1HG   LYS 118          2HG       LYS 118 140.233  10.356  -4.882
  297   2HG   LYS 118          1HG       LYS 118 141.526   9.163  -5.018
  298   1HD   LYS 118          2HD       LYS 118 140.939   9.504  -7.620
  299   2HD   LYS 118          1HD       LYS 118 140.508  11.100  -7.003
  300   1HE   LYS 118          2HE       LYS 118 142.742  11.248  -5.948
  301   2HE   LYS 118          1HE       LYS 118 143.163   9.703  -6.687
  302   1HZ   LYS 118          1HZ       LYS 118 143.950  11.033  -8.300
  303   2HZ   LYS 118          2HZ       LYS 118 142.953  12.336  -7.891
  304   3HZ   LYS 118          3HZ       LYS 118 142.341  11.062  -8.819
  305    H    ILE 119           H        ILE 119 136.260   8.697  -5.770
  306    HA   ILE 119           HA       ILE 119 136.182  11.581  -5.765
  307    HB   ILE 119           HB       ILE 119 133.981   9.674  -6.556
  308   1HG1  ILE 119          2HG1      ILE 119 135.959  10.960  -8.433
  309   2HG1  ILE 119          1HG1      ILE 119 136.241   9.369  -7.734
  310   1HG2  ILE 119          1HG2      ILE 119 134.472  12.598  -6.969
  311   2HG2  ILE 119          2HG2      ILE 119 133.024  11.782  -6.378
  312   3HG2  ILE 119          3HG2      ILE 119 133.458  11.682  -8.085
  313   1HD1  ILE 119          1HD1      ILE 119 133.720   9.098  -8.715
  314   2HD1  ILE 119          2HD1      ILE 119 135.196   8.623  -9.557
  315   3HD1  ILE 119          3HD1      ILE 119 134.454  10.188  -9.891
  316    H    MET 120           H        MET 120 134.755   8.956  -3.960
  317    HA   MET 120           HA       MET 120 132.609  10.181  -2.746
  318   1HB   MET 120          2HB       MET 120 133.588   7.741  -2.588
  319   2HB   MET 120          1HB       MET 120 134.332   8.363  -1.122
  320   1HG   MET 120          2HG       MET 120 131.386   8.543  -1.679
  321   2HG   MET 120          1HG       MET 120 132.134   7.194  -0.825
  322   1HE   MET 120          1HE       MET 120 133.131   7.270   1.500
  323   2HE   MET 120          2HE       MET 120 133.369   8.724   2.470
  324   3HE   MET 120          3HE       MET 120 134.337   8.463   1.020
  325    H    LEU 121           H        LEU 121 136.014  10.319  -1.778
  326    HA   LEU 121           HA       LEU 121 135.282  12.074   0.438
  327   1HB   LEU 121          2HB       LEU 121 137.975  11.943   0.636
  328   2HB   LEU 121          1HB       LEU 121 136.860  10.857   1.434
  329    HG   LEU 121           HG       LEU 121 138.793   9.734   0.357
  330   1HD1  LEU 121          1HD1      LEU 121 135.980   9.080   0.004
  331   2HD1  LEU 121          2HD1      LEU 121 137.321   8.083   0.565
  332   3HD1  LEU 121          3HD1      LEU 121 137.036   8.285  -1.162
  333   1HD2  LEU 121          1HD2      LEU 121 137.811   9.721  -2.328
  334   2HD2  LEU 121          2HD2      LEU 121 139.404  10.177  -1.725
  335   3HD2  LEU 121          3HD2      LEU 121 138.121  11.382  -1.821
  336    H    GLN 122           H        GLN 122 136.499  12.321  -2.762
  337    HA   GLN 122           HA       GLN 122 137.853  14.826  -2.344
  338   1HB   GLN 122          2HB       GLN 122 138.540  14.670  -4.514
  339   2HB   GLN 122          1HB       GLN 122 138.158  12.980  -4.232
  340   1HG   GLN 122          2HG       GLN 122 135.928  13.376  -5.253
  341   2HG   GLN 122          1HG       GLN 122 136.445  15.015  -5.641
  342   1HE2  GLN 122          1HE2      GLN 122 136.818  15.132  -7.731
  343   2HE2  GLN 122          2HE2      GLN 122 137.697  13.983  -8.675
  344    H    ALA 123           H        ALA 123 134.772  13.812  -3.769
  345    HA   ALA 123           HA       ALA 123 133.870  16.328  -4.581
  346   1HB   ALA 123          1HB       ALA 123 132.655  14.554  -5.438
  347   2HB   ALA 123          2HB       ALA 123 131.553  15.226  -4.235
  348   3HB   ALA 123          3HB       ALA 123 132.486  13.776  -3.864
  349    H    THR 124           H        THR 124 133.877  14.800  -1.438
  350    HA   THR 124           HA       THR 124 132.007  16.529  -0.192
  351    HB   THR 124           HB       THR 124 132.887  15.648   1.913
  352    HG1  THR 124           HG1      THR 124 134.966  14.708   0.254
  353   1HG2  THR 124          1HG2      THR 124 133.025  13.092   1.036
  354   2HG2  THR 124          2HG2      THR 124 132.170  13.868  -0.295
  355   3HG2  THR 124          3HG2      THR 124 131.528  13.970   1.343
  356    H    GLY 125           H        GLY 125 132.713  17.925   1.740
  357   1HA   GLY 125          2HA       GLY 125 134.584  19.891   0.700
  358   2HA   GLY 125          1HA       GLY 125 133.525  20.090   2.087
  359    H    GLU 126           H        GLU 126 135.156  17.165   2.303
  360    HA   GLU 126           HA       GLU 126 136.953  18.291   4.310
  361   1HB   GLU 126          2HB       GLU 126 137.331  15.810   4.835
  362   2HB   GLU 126          1HB       GLU 126 135.753  16.490   5.206
  363   1HG   GLU 126          2HG       GLU 126 134.750  15.441   3.355
  364   2HG   GLU 126          1HG       GLU 126 136.312  15.041   2.640
  365    H    THR 127           H        THR 127 139.117  17.036   4.502
  366    HA   THR 127           HA       THR 127 140.301  16.841   1.809
  367    HB   THR 127           HB       THR 127 142.429  17.623   2.902
  368    HG1  THR 127           HG1      THR 127 140.689  18.318   5.029
  369   1HG2  THR 127          1HG2      THR 127 140.688  19.147   1.731
  370   2HG2  THR 127          2HG2      THR 127 141.989  19.866   2.682
  371   3HG2  THR 127          3HG2      THR 127 140.371  19.727   3.366
  372    H    ILE 128           H        ILE 128 140.644  14.756   1.398
  373    HA   ILE 128           HA       ILE 128 141.853  13.101   3.518
  374    HB   ILE 128           HB       ILE 128 140.140  12.087   1.249
  375   1HG1  ILE 128          2HG1      ILE 128 138.525  11.609   3.207
  376   2HG1  ILE 128          1HG1      ILE 128 139.458  12.812   4.090
  377   1HG2  ILE 128          1HG2      ILE 128 141.683  10.831   3.430
  378   2HG2  ILE 128          2HG2      ILE 128 141.294  10.229   1.819
  379   3HG2  ILE 128          3HG2      ILE 128 140.089  10.153   3.103
  380   1HD1  ILE 128          1HD1      ILE 128 138.758  13.859   1.531
  381   2HD1  ILE 128          2HD1      ILE 128 138.312  14.440   3.136
  382   3HD1  ILE 128          3HD1      ILE 128 137.316  13.229   2.328
  383    H    THR 129           H        THR 129 143.592  11.821   2.992
  384    HA   THR 129           HA       THR 129 144.893  12.471   0.454
  385    HB   THR 129           HB       THR 129 146.338  10.865   2.475
  386    HG1  THR 129           HG1      THR 129 145.409  12.212   3.919
  387   1HG2  THR 129          1HG2      THR 129 147.876  13.009   2.006
  388   2HG2  THR 129          2HG2      THR 129 146.938  12.968   0.511
  389   3HG2  THR 129          3HG2      THR 129 147.881  11.559   1.000
  390    H    GLU 130           H        GLU 130 146.529  10.466  -0.070
  391    HA   GLU 130           HA       GLU 130 144.729   8.366  -0.926
  392   1HB   GLU 130          2HB       GLU 130 146.704   7.545  -2.194
  393   2HB   GLU 130          1HB       GLU 130 146.278   9.212  -2.560
  394   1HG   GLU 130          2HG       GLU 130 148.167   9.172  -0.419
  395   2HG   GLU 130          1HG       GLU 130 148.768   8.185  -1.751
  396    H    ASP 131           H        ASP 131 146.079   8.806   1.924
  397    HA   ASP 131           HA       ASP 131 147.249   6.162   2.267
  398   1HB   ASP 131          2HB       ASP 131 147.385   8.709   3.674
  399   2HB   ASP 131          1HB       ASP 131 147.112   7.361   4.775
  400    H    ASP 132           H        ASP 132 144.644   8.099   3.737
  401    HA   ASP 132           HA       ASP 132 143.543   5.935   5.199
  402   1HB   ASP 132          2HB       ASP 132 143.123   8.706   5.036
  403   2HB   ASP 132          1HB       ASP 132 141.586   7.975   4.587
  404    H    ILE 133           H        ILE 133 143.057   7.152   1.959
  405    HA   ILE 133           HA       ILE 133 140.618   5.759   1.460
  406    HB   ILE 133           HB       ILE 133 142.623   6.721  -0.582
  407   1HG1  ILE 133          2HG1      ILE 133 140.206   8.223   0.424
  408   2HG1  ILE 133          1HG1      ILE 133 141.815   8.459   1.100
  409   1HG2  ILE 133          1HG2      ILE 133 141.199   5.564  -1.895
  410   2HG2  ILE 133          2HG2      ILE 133 140.202   7.009  -1.725
  411   3HG2  ILE 133          3HG2      ILE 133 139.898   5.604  -0.705
  412   1HD1  ILE 133          1HD1      ILE 133 141.293  10.162  -0.544
  413   2HD1  ILE 133          2HD1      ILE 133 141.015   8.919  -1.764
  414   3HD1  ILE 133          3HD1      ILE 133 142.630   9.152  -1.093
  415    H    GLU 134           H        GLU 134 143.977   5.156   0.410
  416    HA   GLU 134           HA       GLU 134 143.543   2.756  -0.910
  417   1HB   GLU 134          2HB       GLU 134 145.709   4.285  -0.486
  418   2HB   GLU 134          1HB       GLU 134 146.050   2.996   0.658
  419   1HG   GLU 134          2HG       GLU 134 146.253   1.402  -0.990
  420   2HG   GLU 134          1HG       GLU 134 145.294   2.323  -2.146
  421    H    GLU 135           H        GLU 135 143.737   3.407   2.508
  422    HA   GLU 135           HA       GLU 135 143.861   0.566   3.152
  423   1HB   GLU 135          2HB       GLU 135 144.095   1.269   5.461
  424   2HB   GLU 135          1HB       GLU 135 145.228   2.156   4.451
  425   1HG   GLU 135          2HG       GLU 135 143.583   4.043   4.424
  426   2HG   GLU 135          1HG       GLU 135 142.649   3.158   5.627
  427    H    LEU 136           H        LEU 136 141.477   2.170   1.970
  428    HA   LEU 136           HA       LEU 136 139.477   1.516   4.014
  429   1HB   LEU 136          2HB       LEU 136 139.707   3.775   2.614
  430   2HB   LEU 136          1HB       LEU 136 138.729   2.867   1.476
  431    HG   LEU 136           HG       LEU 136 137.718   2.789   4.229
  432   1HD1  LEU 136          1HD1      LEU 136 138.355   5.001   4.496
  433   2HD1  LEU 136          2HD1      LEU 136 136.719   5.140   3.853
  434   3HD1  LEU 136          3HD1      LEU 136 138.107   5.383   2.793
  435   1HD2  LEU 136          1HD2      LEU 136 135.688   3.654   2.753
  436   2HD2  LEU 136          2HD2      LEU 136 136.185   1.961   2.765
  437   3HD2  LEU 136          3HD2      LEU 136 136.699   3.022   1.453
  438    H    MET 137           H        MET 137 140.536   0.728   0.779
  439    HA   MET 137           HA       MET 137 138.253  -0.967   0.244
  440   1HB   MET 137          2HB       MET 137 140.826  -0.807  -1.325
  441   2HB   MET 137          1HB       MET 137 139.264  -1.389  -1.884
  442   1HG   MET 137          2HG       MET 137 138.656   1.148  -1.120
  443   2HG   MET 137          1HG       MET 137 140.308   1.336  -1.705
  444   1HE   MET 137          1HE       MET 137 137.402  -0.865  -2.384
  445   2HE   MET 137          2HE       MET 137 137.254  -0.939  -4.140
  446   3HE   MET 137          3HE       MET 137 136.475   0.365  -3.242
  447    H    LYS 138           H        LYS 138 141.651  -1.347   1.118
  448    HA   LYS 138           HA       LYS 138 141.865  -4.115   0.837
  449   1HB   LYS 138          2HB       LYS 138 143.292  -2.040   2.424
  450   2HB   LYS 138          1HB       LYS 138 143.557  -3.723   2.859
  451   1HG   LYS 138          2HG       LYS 138 143.764  -3.477   0.031
  452   2HG   LYS 138          1HG       LYS 138 144.759  -2.229   0.784
  453   1HD   LYS 138          2HD       LYS 138 144.865  -5.086   1.705
  454   2HD   LYS 138          1HD       LYS 138 145.825  -4.525   0.335
  455   1HE   LYS 138          2HE       LYS 138 147.210  -3.286   1.637
  456   2HE   LYS 138          1HE       LYS 138 145.942  -2.891   2.795
  457   1HZ   LYS 138          1HZ       LYS 138 147.248  -4.301   4.010
  458   2HZ   LYS 138          2HZ       LYS 138 147.679  -5.255   2.681
  459   3HZ   LYS 138          3HZ       LYS 138 146.140  -5.406   3.366
  460    H    ASP 139           H        ASP 139 140.407  -2.177   3.342
  461    HA   ASP 139           HA       ASP 139 140.166  -4.370   5.201
  462   1HB   ASP 139          2HB       ASP 139 140.355  -1.849   5.756
  463   2HB   ASP 139          1HB       ASP 139 138.635  -1.787   5.383
  464    H    GLY 140           H        GLY 140 138.553  -3.567   2.396
  465   1HA   GLY 140          2HA       GLY 140 136.107  -4.924   3.345
  466   2HA   GLY 140          1HA       GLY 140 136.070  -3.621   2.169
  467    H    ASP 141           H        ASP 141 138.775  -5.267   1.397
  468    HA   ASP 141           HA       ASP 141 137.362  -6.803  -0.656
  469   1HB   ASP 141          2HB       ASP 141 139.991  -5.458  -0.479
  470   2HB   ASP 141          1HB       ASP 141 139.970  -6.975  -1.373
  471    H    LYS 142           H        LYS 142 136.794  -8.671   0.416
  472    HA   LYS 142           HA       LYS 142 138.679 -10.150   1.995
  473   1HB   LYS 142          2HB       LYS 142 136.022 -11.079   0.896
  474   2HB   LYS 142          1HB       LYS 142 136.923 -11.796   2.225
  475   1HG   LYS 142          2HG       LYS 142 135.593  -9.098   2.186
  476   2HG   LYS 142          1HG       LYS 142 135.101 -10.518   3.110
  477   1HD   LYS 142          2HD       LYS 142 137.784 -10.068   3.785
  478   2HD   LYS 142          1HD       LYS 142 137.022  -8.476   3.773
  479   1HE   LYS 142          2HE       LYS 142 136.849  -9.431   5.981
  480   2HE   LYS 142          1HE       LYS 142 135.247  -9.351   5.248
  481   1HZ   LYS 142          1HZ       LYS 142 135.713 -11.754   4.556
  482   2HZ   LYS 142          2HZ       LYS 142 135.336 -11.458   6.179
  483   3HZ   LYS 142          3HZ       LYS 142 136.942 -11.722   5.718
  484    H    ASN 143           H        ASN 143 137.416 -10.339  -1.288
  485    HA   ASN 143           HA       ASN 143 138.876 -12.786  -1.834
  486   1HB   ASN 143          2HB       ASN 143 137.942 -12.457  -4.160
  487   2HB   ASN 143          1HB       ASN 143 136.742 -12.641  -2.885
  488   1HD2  ASN 143          1HD2      ASN 143 135.168 -11.605  -4.096
  489   2HD2  ASN 143          2HD2      ASN 143 135.180  -9.898  -4.360
  490    H    ASN 144           H        ASN 144 139.729  -9.609  -1.633
  491    HA   ASN 144           HA       ASN 144 141.416  -8.324  -2.444
  492   1HB   ASN 144          2HB       ASN 144 142.465 -11.096  -2.356
  493   2HB   ASN 144          1HB       ASN 144 143.421  -9.928  -3.262
  494   1HD2  ASN 144          1HD2      ASN 144 142.389 -10.983  -0.167
  495   2HD2  ASN 144          2HD2      ASN 144 143.330  -9.878   0.769
  496    H    ASP 145           H        ASP 145 139.343  -9.179  -4.366
  497    HA   ASP 145           HA       ASP 145 140.573  -9.713  -6.872
  498   1HB   ASP 145          2HB       ASP 145 138.379  -9.196  -7.833
  499   2HB   ASP 145          1HB       ASP 145 138.215 -10.248  -6.431
  500    H    GLY 146           H        GLY 146 139.633  -6.784  -5.171
  501   1HA   GLY 146          2HA       GLY 146 141.170  -4.868  -5.674
  502   2HA   GLY 146          1HA       GLY 146 140.833  -5.206  -7.365
  503    H    ARG 147           H        ARG 147 138.030  -5.748  -5.665
  504    HA   ARG 147           HA       ARG 147 137.152  -2.986  -5.575
  505   1HB   ARG 147          2HB       ARG 147 135.796  -4.990  -7.389
  506   2HB   ARG 147          1HB       ARG 147 135.265  -3.340  -7.088
  507   1HG   ARG 147          2HG       ARG 147 137.561  -2.646  -7.995
  508   2HG   ARG 147          1HG       ARG 147 137.652  -4.293  -8.621
  509   1HD   ARG 147          2HD       ARG 147 135.598  -3.956  -9.871
  510   2HD   ARG 147          1HD       ARG 147 135.430  -2.336  -9.195
  511    HE   ARG 147           HE       ARG 147 137.852  -2.248 -10.386
  512   1HH1  ARG 147          1HH1      ARG 147 134.695  -3.234 -11.500
  513   2HH1  ARG 147          2HH1      ARG 147 134.993  -2.775 -13.142
  514   1HH2  ARG 147          1HH2      ARG 147 138.246  -1.645 -12.545
  515   2HH2  ARG 147          2HH2      ARG 147 137.009  -1.872 -13.737
  516    H    ILE 148           H        ILE 148 134.963  -2.778  -4.666
  517    HA   ILE 148           HA       ILE 148 134.398  -5.004  -2.825
  518    HB   ILE 148           HB       ILE 148 133.628  -2.100  -2.504
  519   1HG1  ILE 148          2HG1      ILE 148 135.767  -3.620  -1.005
  520   2HG1  ILE 148          1HG1      ILE 148 136.110  -2.600  -2.400
  521   1HG2  ILE 148          1HG2      ILE 148 133.408  -4.476  -0.664
  522   2HG2  ILE 148          2HG2      ILE 148 132.093  -3.515  -1.341
  523   3HG2  ILE 148          3HG2      ILE 148 133.182  -2.804  -0.151
  524   1HD1  ILE 148          1HD1      ILE 148 134.624  -1.479  -0.069
  525   2HD1  ILE 148          2HD1      ILE 148 135.638  -0.659  -1.258
  526   3HD1  ILE 148          3HD1      ILE 148 136.378  -1.655  -0.003
  527    H    ASP 149           H        ASP 149 132.544  -6.057  -2.990
  528    HA   ASP 149           HA       ASP 149 130.476  -4.976  -4.774
  529   1HB   ASP 149          2HB       ASP 149 129.649  -7.314  -4.897
  530   2HB   ASP 149          1HB       ASP 149 131.312  -7.152  -5.451
  531    H    TYR 150           H        TYR 150 128.196  -5.852  -4.142
  532    HA   TYR 150           HA       TYR 150 127.415  -4.568  -1.794
  533   1HB   TYR 150          2HB       TYR 150 125.893  -5.033  -3.683
  534   2HB   TYR 150          1HB       TYR 150 125.937  -6.747  -3.287
  535    HD1  TYR 150           HD1      TYR 150 124.276  -7.618  -1.924
  536    HD2  TYR 150           HD2      TYR 150 125.114  -3.450  -1.734
  537    HE1  TYR 150           HE1      TYR 150 122.376  -7.311  -0.392
  538    HE2  TYR 150           HE2      TYR 150 123.217  -3.133  -0.201
  539    HH   TYR 150           HH       TYR 150 120.963  -4.461   0.238
  540    H    ASP 151           H        ASP 151 128.494  -7.826  -2.329
  541    HA   ASP 151           HA       ASP 151 127.492  -8.901   0.119
  542   1HB   ASP 151          2HB       ASP 151 128.736  -9.923  -2.182
  543   2HB   ASP 151          1HB       ASP 151 129.844 -10.279  -0.860
  544    H    GLU 152           H        GLU 152 130.758  -7.965  -0.950
  545    HA   GLU 152           HA       GLU 152 131.973  -8.277   1.571
  546   1HB   GLU 152          2HB       GLU 152 132.861  -6.447  -0.660
  547   2HB   GLU 152          1HB       GLU 152 133.862  -7.100   0.629
  548   1HG   GLU 152          2HG       GLU 152 133.364  -9.384  -0.269
  549   2HG   GLU 152          1HG       GLU 152 132.603  -8.598  -1.651
  550    H    PHE 153           H        PHE 153 130.448  -5.499   0.005
  551    HA   PHE 153           HA       PHE 153 131.248  -3.621   1.991
  552   1HB   PHE 153          2HB       PHE 153 129.932  -3.515  -0.497
  553   2HB   PHE 153          1HB       PHE 153 128.809  -2.831   0.673
  554    HD1  PHE 153           HD1      PHE 153 130.432  -1.417   2.543
  555    HD2  PHE 153           HD2      PHE 153 130.949  -1.821  -1.662
  556    HE1  PHE 153           HE1      PHE 153 131.677   0.705   2.496
  557    HE2  PHE 153           HE2      PHE 153 132.197   0.300  -1.715
  558    HZ   PHE 153           HZ       PHE 153 132.562   1.565   0.364
  559    H    LEU 154           H        LEU 154 128.591  -5.848   1.678
  560    HA   LEU 154           HA       LEU 154 126.795  -4.710   3.498
  561   1HB   LEU 154          2HB       LEU 154 127.105  -7.204   2.107
  562   2HB   LEU 154          1HB       LEU 154 126.639  -7.521   3.768
  563    HG   LEU 154           HG       LEU 154 124.652  -6.147   3.520
  564   1HD1  LEU 154          1HD1      LEU 154 124.200  -4.778   1.776
  565   2HD1  LEU 154          2HD1      LEU 154 125.016  -5.814   0.605
  566   3HD1  LEU 154          3HD1      LEU 154 125.958  -4.753   1.652
  567   1HD2  LEU 154          1HD2      LEU 154 125.162  -8.322   1.540
  568   2HD2  LEU 154          2HD2      LEU 154 123.621  -7.466   1.525
  569   3HD2  LEU 154          3HD2      LEU 154 124.138  -8.326   2.975
  570    H    GLU 155           H        GLU 155 129.492  -6.948   3.996
  571    HA   GLU 155           HA       GLU 155 129.063  -7.126   6.831
  572   1HB   GLU 155          2HB       GLU 155 131.251  -8.056   4.985
  573   2HB   GLU 155          1HB       GLU 155 131.397  -8.204   6.730
  574   1HG   GLU 155          2HG       GLU 155 128.865  -9.227   5.800
  575   2HG   GLU 155          1HG       GLU 155 130.217 -10.009   4.983
  576    H    PHE 156           H        PHE 156 131.009  -5.195   4.667
  577    HA   PHE 156           HA       PHE 156 132.887  -4.159   6.441
  578   1HB   PHE 156          2HB       PHE 156 132.581  -3.852   3.853
  579   2HB   PHE 156          1HB       PHE 156 131.677  -2.417   4.326
  580    HD1  PHE 156           HD1      PHE 156 134.757  -3.914   5.788
  581    HD2  PHE 156           HD2      PHE 156 132.996  -0.610   3.762
  582    HE1  PHE 156           HE1      PHE 156 136.865  -2.661   6.005
  583    HE2  PHE 156           HE2      PHE 156 135.101   0.646   3.973
  584    HZ   PHE 156           HZ       PHE 156 137.038  -0.379   5.096
  585    H    MET 157           H        MET 157 129.514  -3.388   6.017
  586    HA   MET 157           HA       MET 157 129.758  -1.175   7.934
  587   1HB   MET 157          2HB       MET 157 127.493  -1.892   6.064
  588   2HB   MET 157          1HB       MET 157 127.478  -0.541   7.189
  589   1HG   MET 157          2HG       MET 157 129.562  -0.844   5.050
  590   2HG   MET 157          1HG       MET 157 128.028  -0.017   4.781
  591   1HE   MET 157          1HE       MET 157 131.637   0.416   5.699
  592   2HE   MET 157          2HE       MET 157 131.575   2.178   5.687
  593   3HE   MET 157          3HE       MET 157 130.911   1.263   4.333
  594    H    LYS 158           H        LYS 158 129.213  -4.383   8.022
  595    HA   LYS 158           HA       LYS 158 127.074  -4.266  10.022
  596   1HB   LYS 158          2HB       LYS 158 126.988  -5.921   8.109
  597   2HB   LYS 158          1HB       LYS 158 128.362  -6.730   8.849
  598   1HG   LYS 158          2HG       LYS 158 126.743  -7.967   9.804
  599   2HG   LYS 158          1HG       LYS 158 126.715  -6.635  10.960
  600   1HD   LYS 158          2HD       LYS 158 125.029  -6.369   8.537
  601   2HD   LYS 158          1HD       LYS 158 124.514  -7.536   9.756
  602   1HE   LYS 158          2HE       LYS 158 125.334  -4.932  10.826
  603   2HE   LYS 158          1HE       LYS 158 123.913  -4.880   9.783
  604   1HZ   LYS 158          1HZ       LYS 158 122.676  -6.007  11.266
  605   2HZ   LYS 158          2HZ       LYS 158 123.805  -5.422  12.379
  606   3HZ   LYS 158          3HZ       LYS 158 123.951  -6.995  11.775
  607    H    GLY 159           H        GLY 159 129.653  -3.217  10.627
  608   1HA   GLY 159          2HA       GLY 159 130.591  -3.344  12.866
  609   2HA   GLY 159          1HA       GLY 159 130.472  -5.096  12.752
  610    H    VAL 160           H        VAL 160 132.562  -2.522  12.547
  611    HA   VAL 160           HA       VAL 160 134.528  -4.176  11.123
  612    HB   VAL 160           HB       VAL 160 135.113  -1.393  10.679
  613   1HG1  VAL 160          1HG1      VAL 160 136.098  -3.060   9.326
  614   2HG1  VAL 160          2HG1      VAL 160 134.984  -2.176   8.282
  615   3HG1  VAL 160          3HG1      VAL 160 134.531  -3.759   8.917
  616   1HG2  VAL 160          1HG2      VAL 160 133.223  -0.946   9.086
  617   2HG2  VAL 160          2HG2      VAL 160 132.786  -0.888  10.794
  618   3HG2  VAL 160          3HG2      VAL 160 132.369  -2.302   9.823
  619    H    GLU 161           H        GLU 161 134.507  -4.340  13.753
  620    HA   GLU 161           HA       GLU 161 135.875  -2.361  15.206
  621   1HB   GLU 161          2HB       GLU 161 136.223  -4.071  16.895
  622   2HB   GLU 161          1HB       GLU 161 134.591  -4.188  16.253
  623   1HG   GLU 161          2HG       GLU 161 135.194  -6.085  14.913
  624   2HG   GLU 161          1HG       GLU 161 136.887  -5.919  15.373
  Start of MODEL    4
    1   1H    MET  81          1HT       MET  81  93.373 -14.282  -2.177
    2   2H    MET  81          2HT       MET  81  94.502 -14.336  -0.886
    3   3H    MET  81          3HT       MET  81  94.615 -13.105  -2.076
    4    HA   MET  81           HA       MET  81  92.352 -12.404  -1.375
    5   1HB   MET  81          2HB       MET  81  93.076 -14.438   0.712
    6   2HB   MET  81          1HB       MET  81  92.020 -13.093   1.115
    7   1HG   MET  81          2HG       MET  81  90.836 -13.983  -1.137
    8   2HG   MET  81          1HG       MET  81  91.505 -15.487  -0.506
    9   1HE   MET  81          1HE       MET  81  90.024 -15.014   3.258
   10   2HE   MET  81          2HE       MET  81  91.544 -14.463   2.554
   11   3HE   MET  81          3HE       MET  81  91.010 -16.126   2.310
   12    H    VAL  82           H        VAL  82  92.190 -10.770   0.402
   13    HA   VAL  82           HA       VAL  82  94.676  -9.351   0.611
   14    HB   VAL  82           HB       VAL  82  93.333  -7.672   1.881
   15   1HG1  VAL  82          1HG1      VAL  82  91.609  -7.453  -0.171
   16   2HG1  VAL  82          2HG1      VAL  82  92.761  -8.595  -0.862
   17   3HG1  VAL  82          3HG1      VAL  82  93.315  -7.024  -0.283
   18   1HG2  VAL  82          1HG2      VAL  82  90.990  -7.924   2.180
   19   2HG2  VAL  82          2HG2      VAL  82  91.744  -9.384   2.820
   20   3HG2  VAL  82          3HG2      VAL  82  90.963  -9.416   1.239
   21    H    ARG  83           H        ARG  83  95.493  -8.488   2.671
   22    HA   ARG  83           HA       ARG  83  96.377  -8.780   4.745
   23   1HB   ARG  83          2HB       ARG  83  93.872  -8.616   5.273
   24   2HB   ARG  83          1HB       ARG  83  93.916 -10.365   5.451
   25   1HG   ARG  83          2HG       ARG  83  96.043  -9.442   6.991
   26   2HG   ARG  83          1HG       ARG  83  94.730  -8.303   7.294
   27   1HD   ARG  83          2HD       ARG  83  94.211 -11.248   7.352
   28   2HD   ARG  83          1HD       ARG  83  94.939 -10.453   8.745
   29    HE   ARG  83           HE       ARG  83  92.210 -10.256   7.865
   30   1HH1  ARG  83          1HH1      ARG  83  94.753  -8.692   9.673
   31   2HH1  ARG  83          2HH1      ARG  83  93.662  -7.770  10.651
   32   1HH2  ARG  83          1HH2      ARG  83  90.773  -9.044   9.151
   33   2HH2  ARG  83          2HH2      ARG  83  91.402  -7.970  10.355
   34    H    CYS  84           H        CYS  84  98.121 -10.066   4.485
   35    HA   CYS  84           HA       CYS  84  97.837 -12.857   5.214
   36   1HB   CYS  84          2HB       CYS  84  99.301 -13.531   3.228
   37   2HB   CYS  84          1HB       CYS  84  97.610 -13.181   2.888
   38    HG   CYS  84           HG       CYS  84  98.956 -10.674   2.319
   39    H    MET  85           H        MET  85 100.058 -10.320   4.098
   40    HA   MET  85           HA       MET  85 101.743 -10.681   6.385
   41   1HB   MET  85          2HB       MET  85 102.323 -12.450   4.453
   42   2HB   MET  85          1HB       MET  85 103.267 -11.085   3.870
   43   1HG   MET  85          2HG       MET  85 104.208 -10.985   6.258
   44   2HG   MET  85          1HG       MET  85 103.549 -12.611   6.427
   45   1HE   MET  85          1HE       MET  85 105.867 -10.226   5.002
   46   2HE   MET  85          2HE       MET  85 105.979 -10.856   3.358
   47   3HE   MET  85          3HE       MET  85 107.277 -11.168   4.511
   48    H    LYS  86           H        LYS  86 103.038  -8.920   6.759
   49    HA   LYS  86           HA       LYS  86 103.493  -6.962   4.674
   50   1HB   LYS  86          2HB       LYS  86 102.515  -5.122   6.124
   51   2HB   LYS  86          1HB       LYS  86 101.357  -6.178   5.325
   52   1HG   LYS  86          2HG       LYS  86 101.720  -7.446   7.714
   53   2HG   LYS  86          1HG       LYS  86 101.860  -5.748   8.170
   54   1HD   LYS  86          2HD       LYS  86  99.592  -6.851   6.519
   55   2HD   LYS  86          1HD       LYS  86  99.535  -6.693   8.276
   56   1HE   LYS  86          2HE       LYS  86 100.183  -4.367   6.491
   57   2HE   LYS  86          1HE       LYS  86  98.520  -4.806   6.875
   58   1HZ   LYS  86          1HZ       LYS  86 100.570  -3.629   8.578
   59   2HZ   LYS  86          2HZ       LYS  86  99.541  -4.756   9.308
   60   3HZ   LYS  86          3HZ       LYS  86  98.896  -3.379   8.566
   61    H    ASP  87           H        ASP  87 103.665  -7.630   8.160
   62    HA   ASP  87           HA       ASP  87 106.320  -6.349   8.187
   63   1HB   ASP  87          2HB       ASP  87 104.059  -5.972   9.879
   64   2HB   ASP  87          1HB       ASP  87 105.331  -6.719  10.840
   65    H    ASP  88           H        ASP  88 107.554  -8.122   7.667
   66    HA   ASP  88           HA       ASP  88 107.640 -10.228   9.717
   67   1HB   ASP  88          2HB       ASP  88 106.507 -11.167   7.772
   68   2HB   ASP  88          1HB       ASP  88 107.828 -10.657   6.727
   69    H    SER  89           H        SER  89 109.525  -9.765   6.746
   70    HA   SER  89           HA       SER  89 111.897  -9.257   8.415
   71   1HB   SER  89          2HB       SER  89 112.097 -10.771   5.831
   72   2HB   SER  89          1HB       SER  89 113.200 -10.768   7.208
   73    HG   SER  89           HG       SER  89 110.797 -12.156   6.845
   74    H    LYS  90           H        LYS  90 110.105  -7.408   6.972
   75    HA   LYS  90           HA       LYS  90 111.728  -6.477   4.745
   76   1HB   LYS  90          2HB       LYS  90 108.989  -5.962   5.741
   77   2HB   LYS  90          1HB       LYS  90 109.791  -4.609   4.955
   78   1HG   LYS  90          2HG       LYS  90 110.221  -6.077   2.997
   79   2HG   LYS  90          1HG       LYS  90 109.255  -7.327   3.782
   80   1HD   LYS  90          2HD       LYS  90 107.287  -6.035   3.649
   81   2HD   LYS  90          1HD       LYS  90 108.185  -4.564   3.275
   82   1HE   LYS  90          2HE       LYS  90 106.976  -5.670   1.342
   83   2HE   LYS  90          1HE       LYS  90 108.682  -5.302   1.092
   84   1HZ   LYS  90          1HZ       LYS  90 107.954  -7.554   0.341
   85   2HZ   LYS  90          2HZ       LYS  90 107.713  -7.963   1.964
   86   3HZ   LYS  90          3HZ       LYS  90 109.261  -7.557   1.416
   87    H    GLY  91           H        GLY  91 113.478  -6.153   6.493
   88   1HA   GLY  91          2HA       GLY  91 113.189  -3.783   8.121
   89   2HA   GLY  91          1HA       GLY  91 114.637  -4.764   7.951
   90    H    LYS  92           H        LYS  92 114.924  -2.065   8.012
   91    HA   LYS  92           HA       LYS  92 115.467  -1.396   5.198
   92   1HB   LYS  92          2HB       LYS  92 114.808   0.486   7.470
   93   2HB   LYS  92          1HB       LYS  92 115.242   0.986   5.841
   94   1HG   LYS  92          2HG       LYS  92 112.881  -0.779   6.421
   95   2HG   LYS  92          1HG       LYS  92 112.782   0.983   6.402
   96   1HD   LYS  92          2HD       LYS  92 113.099   1.114   4.136
   97   2HD   LYS  92          1HD       LYS  92 114.024  -0.387   4.071
   98   1HE   LYS  92          2HE       LYS  92 111.443  -1.081   4.948
   99   2HE   LYS  92          1HE       LYS  92 111.226   0.045   3.609
  100   1HZ   LYS  92          1HZ       LYS  92 113.039  -2.289   3.433
  101   2HZ   LYS  92          2HZ       LYS  92 112.431  -1.341   2.171
  102   3HZ   LYS  92          3HZ       LYS  92 111.402  -2.382   3.016
  103    H    THR  93           H        THR  93 117.176  -2.828   7.030
  104    HA   THR  93           HA       THR  93 119.394  -0.907   7.297
  105    HB   THR  93           HB       THR  93 119.206  -3.499   8.807
  106    HG1  THR  93           HG1      THR  93 117.340  -2.275   9.279
  107   1HG2  THR  93          1HG2      THR  93 120.493  -2.150  10.494
  108   2HG2  THR  93          2HG2      THR  93 120.692  -0.930   9.238
  109   3HG2  THR  93          3HG2      THR  93 121.350  -2.549   9.006
  110    H    GLU  94           H        GLU  94 118.750  -4.367   6.740
  111    HA   GLU  94           HA       GLU  94 121.345  -4.772   5.552
  112   1HB   GLU  94          2HB       GLU  94 119.038  -6.711   5.534
  113   2HB   GLU  94          1HB       GLU  94 120.754  -7.072   5.404
  114   1HG   GLU  94          2HG       GLU  94 121.026  -6.205   7.732
  115   2HG   GLU  94          1HG       GLU  94 119.268  -6.104   7.831
  116    H    GLU  95           H        GLU  95 118.092  -4.229   4.429
  117    HA   GLU  95           HA       GLU  95 118.873  -4.811   1.668
  118   1HB   GLU  95          2HB       GLU  95 116.524  -4.623   1.118
  119   2HB   GLU  95          1HB       GLU  95 116.710  -5.683   2.509
  120   1HG   GLU  95          2HG       GLU  95 115.054  -4.457   3.371
  121   2HG   GLU  95          1HG       GLU  95 116.337  -3.304   3.737
  122    H    GLU  96           H        GLU  96 118.849  -2.223   3.775
  123    HA   GLU  96           HA       GLU  96 118.227  -0.202   1.781
  124   1HB   GLU  96          2HB       GLU  96 118.711  -0.237   4.719
  125   2HB   GLU  96          1HB       GLU  96 119.032   1.259   3.855
  126   1HG   GLU  96          2HG       GLU  96 116.429  -0.239   3.965
  127   2HG   GLU  96          1HG       GLU  96 116.804   1.299   4.741
  128    H    LEU  97           H        LEU  97 120.980  -1.712   3.270
  129    HA   LEU  97           HA       LEU  97 122.949   0.204   2.794
  130   1HB   LEU  97          2HB       LEU  97 123.001  -2.790   2.980
  131   2HB   LEU  97          1HB       LEU  97 124.461  -1.892   2.606
  132    HG   LEU  97           HG       LEU  97 122.806  -1.387   5.075
  133   1HD1  LEU  97          1HD1      LEU  97 125.277  -3.091   4.795
  134   2HD1  LEU  97          2HD1      LEU  97 123.643  -3.689   5.083
  135   3HD1  LEU  97          3HD1      LEU  97 124.446  -2.695   6.299
  136   1HD2  LEU  97          1HD2      LEU  97 125.697  -0.731   4.613
  137   2HD2  LEU  97          2HD2      LEU  97 124.592  -0.077   5.822
  138   3HD2  LEU  97          3HD2      LEU  97 124.408   0.370   4.125
  139    H    SER  98           H        SER  98 121.207  -1.772   0.578
  140    HA   SER  98           HA       SER  98 123.096  -1.910  -1.515
  141   1HB   SER  98          2HB       SER  98 120.862  -3.191  -1.227
  142   2HB   SER  98          1HB       SER  98 120.125  -1.775  -1.978
  143    HG   SER  98           HG       SER  98 120.758  -3.495  -3.451
  144    H    ASP  99           H        ASP  99 120.483   0.395  -0.819
  145    HA   ASP  99           HA       ASP  99 120.786   2.002  -3.086
  146   1HB   ASP  99          2HB       ASP  99 119.312   2.091  -0.636
  147   2HB   ASP  99          1HB       ASP  99 120.052   3.668  -0.898
  148    H    LEU 100           H        LEU 100 122.425   2.065   0.033
  149    HA   LEU 100           HA       LEU 100 123.861   4.475  -0.451
  150   1HB   LEU 100          2HB       LEU 100 124.071   2.248   1.537
  151   2HB   LEU 100          1HB       LEU 100 125.364   3.426   1.416
  152    HG   LEU 100           HG       LEU 100 123.345   5.136   1.650
  153   1HD1  LEU 100          1HD1      LEU 100 121.609   4.337   3.094
  154   2HD1  LEU 100          2HD1      LEU 100 122.357   2.743   3.190
  155   3HD1  LEU 100          3HD1      LEU 100 121.667   3.303   1.666
  156   1HD2  LEU 100          1HD2      LEU 100 125.370   4.753   3.131
  157   2HD2  LEU 100          2HD2      LEU 100 124.343   3.682   4.084
  158   3HD2  LEU 100          3HD2      LEU 100 123.926   5.387   3.919
  159    H    PHE 101           H        PHE 101 124.378   1.119  -1.213
  160    HA   PHE 101           HA       PHE 101 127.144   1.176  -1.688
  161   1HB   PHE 101          2HB       PHE 101 125.783  -0.897  -1.517
  162   2HB   PHE 101          1HB       PHE 101 125.068  -0.526  -3.082
  163    HD1  PHE 101           HD1      PHE 101 125.793  -2.363  -4.343
  164    HD2  PHE 101           HD2      PHE 101 128.616  -0.087  -2.117
  165    HE1  PHE 101           HE1      PHE 101 127.631  -3.555  -5.461
  166    HE2  PHE 101           HE2      PHE 101 130.460  -1.274  -3.233
  167    HZ   PHE 101           HZ       PHE 101 129.968  -3.011  -4.909
  168    H    ARG 102           H        ARG 102 124.402   1.663  -3.910
  169    HA   ARG 102           HA       ARG 102 125.899   2.077  -6.233
  170   1HB   ARG 102          2HB       ARG 102 123.294   3.470  -5.640
  171   2HB   ARG 102          1HB       ARG 102 123.917   2.952  -7.200
  172   1HG   ARG 102          2HG       ARG 102 123.741   0.578  -6.305
  173   2HG   ARG 102          1HG       ARG 102 122.781   1.268  -4.994
  174   1HD   ARG 102          2HD       ARG 102 121.171   2.133  -6.573
  175   2HD   ARG 102          1HD       ARG 102 122.162   1.590  -7.927
  176    HE   ARG 102           HE       ARG 102 121.627  -0.654  -6.405
  177   1HH1  ARG 102          1HH1      ARG 102 119.791   1.714  -8.195
  178   2HH1  ARG 102          2HH1      ARG 102 118.508   0.615  -8.576
  179   1HH2  ARG 102          1HH2      ARG 102 119.942  -2.101  -6.905
  180   2HH2  ARG 102          2HH2      ARG 102 118.594  -1.551  -7.844
  181    H    MET 103           H        MET 103 124.860   4.325  -3.715
  182    HA   MET 103           HA       MET 103 125.558   6.730  -4.916
  183   1HB   MET 103          2HB       MET 103 125.594   5.872  -2.025
  184   2HB   MET 103          1HB       MET 103 125.946   7.520  -2.523
  185   1HG   MET 103          2HG       MET 103 123.552   6.813  -3.800
  186   2HG   MET 103          1HG       MET 103 123.417   6.236  -2.139
  187   1HE   MET 103          1HE       MET 103 124.752   9.081  -4.247
  188   2HE   MET 103          2HE       MET 103 124.188  10.556  -3.461
  189   3HE   MET 103          3HE       MET 103 123.057   9.553  -4.370
  190    H    PHE 104           H        PHE 104 127.559   4.275  -3.463
  191    HA   PHE 104           HA       PHE 104 129.923   5.902  -3.337
  192   1HB   PHE 104          2HB       PHE 104 129.208   3.093  -2.735
  193   2HB   PHE 104          1HB       PHE 104 130.882   3.377  -3.199
  194    HD1  PHE 104           HD1      PHE 104 128.360   5.109  -1.055
  195    HD2  PHE 104           HD2      PHE 104 132.308   3.567  -1.425
  196    HE1  PHE 104           HE1      PHE 104 128.862   5.858   1.234
  197    HE2  PHE 104           HE2      PHE 104 132.819   4.312   0.864
  198    HZ   PHE 104           HZ       PHE 104 131.094   5.459   2.196
  199    H    ASP 105           H        ASP 105 128.321   4.090  -5.769
  200    HA   ASP 105           HA       ASP 105 130.694   3.716  -7.393
  201   1HB   ASP 105          2HB       ASP 105 127.892   2.812  -7.464
  202   2HB   ASP 105          1HB       ASP 105 128.591   3.145  -9.045
  203    H    LYS 106           H        LYS 106 131.205   4.846  -9.239
  204    HA   LYS 106           HA       LYS 106 129.785   7.393  -9.577
  205   1HB   LYS 106          2HB       LYS 106 132.543   6.574 -10.509
  206   2HB   LYS 106          1HB       LYS 106 131.825   8.165 -10.719
  207   1HG   LYS 106          2HG       LYS 106 131.910   7.153  -7.954
  208   2HG   LYS 106          1HG       LYS 106 133.468   7.517  -8.698
  209   1HD   LYS 106          2HD       LYS 106 133.123   9.662  -8.213
  210   2HD   LYS 106          1HD       LYS 106 131.795   9.660  -9.375
  211   1HE   LYS 106          2HE       LYS 106 131.562   8.944  -6.454
  212   2HE   LYS 106          1HE       LYS 106 131.114  10.496  -7.160
  213   1HZ   LYS 106          1HZ       LYS 106 129.136   9.292  -7.013
  214   2HZ   LYS 106          2HZ       LYS 106 129.840   7.861  -7.574
  215   3HZ   LYS 106          3HZ       LYS 106 129.582   9.149  -8.639
  216    H    ASN 107           H        ASN 107 131.010   4.609 -11.378
  217    HA   ASN 107           HA       ASN 107 129.612   5.574 -13.773
  218   1HB   ASN 107          2HB       ASN 107 130.926   3.822 -14.967
  219   2HB   ASN 107          1HB       ASN 107 131.928   5.034 -14.177
  220   1HD2  ASN 107          1HD2      ASN 107 132.104   2.034 -14.927
  221   2HD2  ASN 107          2HD2      ASN 107 132.809   1.329 -13.516
  222    H    ALA 108           H        ALA 108 128.652   3.973 -11.233
  223    HA   ALA 108           HA       ALA 108 127.238   2.241 -10.748
  224   1HB   ALA 108          1HB       ALA 108 125.364   2.074 -12.541
  225   2HB   ALA 108          2HB       ALA 108 126.176   3.469 -13.254
  226   3HB   ALA 108          3HB       ALA 108 125.550   3.559 -11.607
  227    H    ASP 109           H        ASP 109 129.035   0.687 -11.031
  228    HA   ASP 109           HA       ASP 109 128.532  -1.105 -13.317
  229   1HB   ASP 109          2HB       ASP 109 130.886  -1.792 -13.193
  230   2HB   ASP 109          1HB       ASP 109 130.743  -0.060 -13.475
  231    H    GLY 110           H        GLY 110 128.235  -0.794 -10.007
  232   1HA   GLY 110          2HA       GLY 110 127.252  -2.474  -8.661
  233   2HA   GLY 110          1HA       GLY 110 127.915  -3.693  -9.739
  234    H    TYR 111           H        TYR 111 130.478  -1.842  -9.430
  235    HA   TYR 111           HA       TYR 111 131.310  -2.816  -6.794
  236   1HB   TYR 111          2HB       TYR 111 133.007  -3.159  -9.274
  237   2HB   TYR 111          1HB       TYR 111 133.365  -3.735  -7.650
  238    HD1  TYR 111           HD1      TYR 111 130.999  -4.159 -10.483
  239    HD2  TYR 111           HD2      TYR 111 132.663  -5.865  -6.957
  240    HE1  TYR 111           HE1      TYR 111 129.912  -6.300 -11.012
  241    HE2  TYR 111           HE2      TYR 111 131.582  -8.011  -7.479
  242    HH   TYR 111           HH       TYR 111 129.644  -8.827  -8.784
  243    H    ILE 112           H        ILE 112 133.101  -1.674  -5.887
  244    HA   ILE 112           HA       ILE 112 133.459   0.995  -7.074
  245    HB   ILE 112           HB       ILE 112 133.903   0.199  -4.196
  246   1HG1  ILE 112          2HG1      ILE 112 131.610   1.881  -5.155
  247   2HG1  ILE 112          1HG1      ILE 112 131.487   0.124  -5.196
  248   1HG2  ILE 112          1HG2      ILE 112 133.577   2.961  -5.334
  249   2HG2  ILE 112          2HG2      ILE 112 135.149   2.185  -5.148
  250   3HG2  ILE 112          3HG2      ILE 112 134.148   2.500  -3.732
  251   1HD1  ILE 112          1HD1      ILE 112 131.908   0.043  -2.793
  252   2HD1  ILE 112          2HD1      ILE 112 130.497   1.029  -3.176
  253   3HD1  ILE 112          3HD1      ILE 112 132.025   1.802  -2.756
  254    H    ASP 113           H        ASP 113 135.421   1.663  -7.673
  255    HA   ASP 113           HA       ASP 113 137.714  -0.068  -7.031
  256   1HB   ASP 113          2HB       ASP 113 136.868   0.386  -9.489
  257   2HB   ASP 113          1HB       ASP 113 137.773   1.885  -9.297
  258    H    LEU 114           H        LEU 114 139.864   1.225  -7.233
  259    HA   LEU 114           HA       LEU 114 139.932   3.086  -5.134
  260   1HB   LEU 114          2HB       LEU 114 141.989   2.636  -7.298
  261   2HB   LEU 114          1HB       LEU 114 142.268   3.450  -5.768
  262    HG   LEU 114           HG       LEU 114 141.326   1.052  -4.899
  263   1HD1  LEU 114          1HD1      LEU 114 142.437   0.671  -7.616
  264   2HD1  LEU 114          2HD1      LEU 114 141.215  -0.256  -6.747
  265   3HD1  LEU 114          3HD1      LEU 114 142.924  -0.483  -6.375
  266   1HD2  LEU 114          1HD2      LEU 114 143.390   0.824  -3.991
  267   2HD2  LEU 114          2HD2      LEU 114 143.555   2.485  -4.563
  268   3HD2  LEU 114          3HD2      LEU 114 144.218   1.153  -5.512
  269    H    GLU 115           H        GLU 115 139.770   3.506  -8.626
  270    HA   GLU 115           HA       GLU 115 140.298   6.291  -8.639
  271   1HB   GLU 115          2HB       GLU 115 139.804   4.272 -10.553
  272   2HB   GLU 115          1HB       GLU 115 138.602   5.525 -10.830
  273   1HG   GLU 115          2HG       GLU 115 141.327   6.517 -10.416
  274   2HG   GLU 115          1HG       GLU 115 141.113   5.518 -11.851
  275    H    GLU 116           H        GLU 116 137.418   4.393  -8.122
  276    HA   GLU 116           HA       GLU 116 135.655   6.681  -8.367
  277   1HB   GLU 116          2HB       GLU 116 135.259   3.771  -7.739
  278   2HB   GLU 116          1HB       GLU 116 133.967   4.929  -7.453
  279   1HG   GLU 116          2HG       GLU 116 133.547   4.025  -9.570
  280   2HG   GLU 116          1HG       GLU 116 134.231   5.622  -9.867
  281    H    LEU 117           H        LEU 117 136.790   4.526  -5.784
  282    HA   LEU 117           HA       LEU 117 135.402   5.651  -3.656
  283   1HB   LEU 117          2HB       LEU 117 136.851   3.545  -3.715
  284   2HB   LEU 117          1HB       LEU 117 138.215   4.610  -3.432
  285    HG   LEU 117           HG       LEU 117 137.032   5.400  -1.343
  286   1HD1  LEU 117          1HD1      LEU 117 135.233   4.163  -0.453
  287   2HD1  LEU 117          2HD1      LEU 117 135.379   2.915  -1.689
  288   3HD1  LEU 117          3HD1      LEU 117 134.794   4.521  -2.124
  289   1HD2  LEU 117          1HD2      LEU 117 138.297   2.798  -1.842
  290   2HD2  LEU 117          2HD2      LEU 117 137.395   2.910  -0.331
  291   3HD2  LEU 117          3HD2      LEU 117 138.697   4.051  -0.667
  292    H    LYS 118           H        LYS 118 138.498   6.600  -5.081
  293    HA   LYS 118           HA       LYS 118 139.239   8.518  -3.182
  294   1HB   LYS 118          2HB       LYS 118 140.711   9.421  -4.894
  295   2HB   LYS 118          1HB       LYS 118 140.752   7.663  -4.927
  296   1HG   LYS 118          2HG       LYS 118 139.474   7.567  -6.900
  297   2HG   LYS 118          1HG       LYS 118 139.005   9.262  -6.770
  298   1HD   LYS 118          2HD       LYS 118 141.715   9.462  -6.821
  299   2HD   LYS 118          1HD       LYS 118 141.455   8.052  -7.850
  300   1HE   LYS 118          2HE       LYS 118 141.160   9.574  -9.474
  301   2HE   LYS 118          1HE       LYS 118 139.546   9.736  -8.784
  302   1HZ   LYS 118          1HZ       LYS 118 140.533  11.892  -9.063
  303   2HZ   LYS 118          2HZ       LYS 118 141.899  11.441  -8.174
  304   3HZ   LYS 118          3HZ       LYS 118 140.397  11.565  -7.407
  305    H    ILE 119           H        ILE 119 137.037   8.687  -5.901
  306    HA   ILE 119           HA       ILE 119 136.760  11.527  -5.891
  307    HB   ILE 119           HB       ILE 119 134.802   9.497  -6.968
  308   1HG1  ILE 119          2HG1      ILE 119 136.924  10.893  -8.580
  309   2HG1  ILE 119          1HG1      ILE 119 137.260   9.368  -7.767
  310   1HG2  ILE 119          1HG2      ILE 119 134.261  11.382  -8.539
  311   2HG2  ILE 119          2HG2      ILE 119 135.236  12.426  -7.506
  312   3HG2  ILE 119          3HG2      ILE 119 133.793  11.646  -6.860
  313   1HD1  ILE 119          1HD1      ILE 119 135.170   8.511  -9.004
  314   2HD1  ILE 119          2HD1      ILE 119 136.673   8.717  -9.903
  315   3HD1  ILE 119          3HD1      ILE 119 135.396   9.928 -10.029
  316    H    MET 120           H        MET 120 134.798   8.861  -4.594
  317    HA   MET 120           HA       MET 120 132.673  10.311  -3.580
  318   1HB   MET 120          2HB       MET 120 133.029   7.768  -3.651
  319   2HB   MET 120          1HB       MET 120 133.868   7.965  -2.120
  320   1HG   MET 120          2HG       MET 120 131.093   9.015  -2.509
  321   2HG   MET 120          1HG       MET 120 131.386   7.328  -2.090
  322   1HE   MET 120          1HE       MET 120 132.873   7.201   1.204
  323   2HE   MET 120          2HE       MET 120 134.116   8.140   0.380
  324   3HE   MET 120          3HE       MET 120 133.282   6.843  -0.474
  325    H    LEU 121           H        LEU 121 135.910   9.950  -2.323
  326    HA   LEU 121           HA       LEU 121 135.316  11.035   0.265
  327   1HB   LEU 121          2HB       LEU 121 137.962  10.698  -1.151
  328   2HB   LEU 121          1HB       LEU 121 137.763  11.110   0.541
  329    HG   LEU 121           HG       LEU 121 136.470   8.607  -0.396
  330   1HD1  LEU 121          1HD1      LEU 121 138.998   8.967  -1.239
  331   2HD1  LEU 121          2HD1      LEU 121 138.336   7.401  -0.770
  332   3HD1  LEU 121          3HD1      LEU 121 139.299   8.332   0.378
  333   1HD2  LEU 121          1HD2      LEU 121 137.792   9.630   2.091
  334   2HD2  LEU 121          2HD2      LEU 121 137.495   7.907   1.859
  335   3HD2  LEU 121          3HD2      LEU 121 136.145   9.042   1.867
  336    H    GLN 122           H        GLN 122 136.390  12.299  -2.818
  337    HA   GLN 122           HA       GLN 122 137.187  14.857  -1.876
  338   1HB   GLN 122          2HB       GLN 122 136.338  13.903  -4.613
  339   2HB   GLN 122          1HB       GLN 122 136.953  15.518  -4.291
  340   1HG   GLN 122          2HG       GLN 122 138.954  14.168  -3.232
  341   2HG   GLN 122          1HG       GLN 122 138.376  12.914  -4.329
  342   1HE2  GLN 122          1HE2      GLN 122 137.825  13.901  -6.590
  343   2HE2  GLN 122          2HE2      GLN 122 139.077  14.880  -7.266
  344    H    ALA 123           H        ALA 123 134.127  13.425  -2.625
  345    HA   ALA 123           HA       ALA 123 132.632  15.756  -3.137
  346   1HB   ALA 123          1HB       ALA 123 130.869  14.368  -3.290
  347   2HB   ALA 123          2HB       ALA 123 131.228  13.572  -1.758
  348   3HB   ALA 123          3HB       ALA 123 132.098  13.104  -3.220
  349    H    THR 124           H        THR 124 133.687  14.235  -0.168
  350    HA   THR 124           HA       THR 124 131.921  15.619   1.574
  351    HB   THR 124           HB       THR 124 133.451  14.895   3.363
  352    HG1  THR 124           HG1      THR 124 135.391  15.169   2.086
  353   1HG2  THR 124          1HG2      THR 124 132.939  12.693   3.292
  354   2HG2  THR 124          2HG2      THR 124 133.425  12.517   1.606
  355   3HG2  THR 124          3HG2      THR 124 131.876  13.259   2.003
  356    H    GLY 125           H        GLY 125 132.799  17.117   3.320
  357   1HA   GLY 125          2HA       GLY 125 134.132  19.326   1.966
  358   2HA   GLY 125          1HA       GLY 125 133.315  19.397   3.519
  359    H    GLU 126           H        GLU 126 135.421  16.752   3.288
  360    HA   GLU 126           HA       GLU 126 137.443  18.221   4.843
  361   1HB   GLU 126          2HB       GLU 126 136.597  15.325   4.918
  362   2HB   GLU 126          1HB       GLU 126 138.047  15.920   5.717
  363   1HG   GLU 126          2HG       GLU 126 135.792  17.544   6.429
  364   2HG   GLU 126          1HG       GLU 126 135.440  15.842   6.726
  365    H    THR 127           H        THR 127 139.634  16.896   4.767
  366    HA   THR 127           HA       THR 127 140.256  16.503   1.914
  367    HB   THR 127           HB       THR 127 142.615  17.106   2.611
  368    HG1  THR 127           HG1      THR 127 141.301  18.022   4.948
  369   1HG2  THR 127          1HG2      THR 127 140.818  18.734   1.669
  370   2HG2  THR 127          2HG2      THR 127 142.327  19.360   2.333
  371   3HG2  THR 127          3HG2      THR 127 140.853  19.403   3.300
  372    H    ILE 128           H        ILE 128 140.873  14.543   1.300
  373    HA   ILE 128           HA       ILE 128 141.902  12.690   3.351
  374    HB   ILE 128           HB       ILE 128 140.366  11.880   0.886
  375   1HG1  ILE 128          2HG1      ILE 128 138.913  13.194   2.366
  376   2HG1  ILE 128          1HG1      ILE 128 138.449  11.495   2.374
  377   1HG2  ILE 128          1HG2      ILE 128 141.918  10.221   1.876
  378   2HG2  ILE 128          2HG2      ILE 128 140.228   9.720   1.933
  379   3HG2  ILE 128          3HG2      ILE 128 141.017  10.332   3.388
  380   1HD1  ILE 128          1HD1      ILE 128 138.757  11.345   4.562
  381   2HD1  ILE 128          2HD1      ILE 128 138.925  13.101   4.573
  382   3HD1  ILE 128          3HD1      ILE 128 140.358  12.080   4.459
  383    H    THR 129           H        THR 129 143.686  11.479   2.869
  384    HA   THR 129           HA       THR 129 145.137  12.255   0.450
  385    HB   THR 129           HB       THR 129 146.321  12.548   2.560
  386    HG1  THR 129           HG1      THR 129 147.721  12.038   0.980
  387   1HG2  THR 129          1HG2      THR 129 145.163  10.101   3.294
  388   2HG2  THR 129          2HG2      THR 129 146.254  11.118   4.238
  389   3HG2  THR 129          3HG2      THR 129 146.905   9.834   3.217
  390    H    GLU 130           H        GLU 130 146.752  10.316  -0.179
  391    HA   GLU 130           HA       GLU 130 145.116   8.375  -1.422
  392   1HB   GLU 130          2HB       GLU 130 147.578   9.320  -1.932
  393   2HB   GLU 130          1HB       GLU 130 148.016   7.824  -1.119
  394   1HG   GLU 130          2HG       GLU 130 147.636   6.677  -2.966
  395   2HG   GLU 130          1HG       GLU 130 145.970   7.254  -3.007
  396    H    ASP 131           H        ASP 131 146.844   8.443   1.593
  397    HA   ASP 131           HA       ASP 131 147.061   5.693   2.089
  398   1HB   ASP 131          2HB       ASP 131 147.873   7.894   3.412
  399   2HB   ASP 131          1HB       ASP 131 146.475   7.467   4.394
  400    H    ASP 132           H        ASP 132 144.545   7.986   3.146
  401    HA   ASP 132           HA       ASP 132 142.880   6.115   4.382
  402   1HB   ASP 132          2HB       ASP 132 142.598   8.880   3.377
  403   2HB   ASP 132          1HB       ASP 132 141.096   7.974   3.530
  404    H    ILE 133           H        ILE 133 143.081   7.162   1.025
  405    HA   ILE 133           HA       ILE 133 140.741   5.889   0.103
  406    HB   ILE 133           HB       ILE 133 143.251   6.441  -1.483
  407   1HG1  ILE 133          2HG1      ILE 133 140.863   8.253  -1.425
  408   2HG1  ILE 133          1HG1      ILE 133 142.070   8.373  -0.149
  409   1HG2  ILE 133          1HG2      ILE 133 140.438   5.745  -2.211
  410   2HG2  ILE 133          2HG2      ILE 133 141.953   5.104  -2.847
  411   3HG2  ILE 133          3HG2      ILE 133 141.419   6.722  -3.302
  412   1HD1  ILE 133          1HD1      ILE 133 143.471   8.331  -2.587
  413   2HD1  ILE 133          2HD1      ILE 133 143.270   9.677  -1.464
  414   3HD1  ILE 133          3HD1      ILE 133 142.123   9.449  -2.785
  415    H    GLU 134           H        GLU 134 144.138   4.833   0.121
  416    HA   GLU 134           HA       GLU 134 143.586   2.287  -1.026
  417   1HB   GLU 134          2HB       GLU 134 145.853   3.735  -0.624
  418   2HB   GLU 134          1HB       GLU 134 145.995   2.541   0.658
  419   1HG   GLU 134          2HG       GLU 134 145.546   0.802  -1.154
  420   2HG   GLU 134          1HG       GLU 134 145.866   2.100  -2.302
  421    H    GLU 135           H        GLU 135 143.680   3.537   2.231
  422    HA   GLU 135           HA       GLU 135 143.752   1.008   3.544
  423   1HB   GLU 135          2HB       GLU 135 143.273   3.833   4.357
  424   2HB   GLU 135          1HB       GLU 135 142.714   2.567   5.441
  425   1HG   GLU 135          2HG       GLU 135 145.505   2.476   4.405
  426   2HG   GLU 135          1HG       GLU 135 145.094   3.587   5.711
  427    H    LEU 136           H        LEU 136 141.157   3.272   2.701
  428    HA   LEU 136           HA       LEU 136 139.046   1.895   3.919
  429   1HB   LEU 136          2HB       LEU 136 139.369   4.138   2.188
  430   2HB   LEU 136          1HB       LEU 136 138.106   3.120   1.525
  431    HG   LEU 136           HG       LEU 136 138.020   3.842   4.424
  432   1HD1  LEU 136          1HD1      LEU 136 138.322   5.846   2.658
  433   2HD1  LEU 136          2HD1      LEU 136 137.337   5.968   4.117
  434   3HD1  LEU 136          3HD1      LEU 136 136.575   5.616   2.565
  435   1HD2  LEU 136          1HD2      LEU 136 135.608   3.680   4.026
  436   2HD2  LEU 136          2HD2      LEU 136 136.446   2.198   3.568
  437   3HD2  LEU 136          3HD2      LEU 136 135.916   3.332   2.324
  438    H    MET 137           H        MET 137 140.696   1.376   0.888
  439    HA   MET 137           HA       MET 137 138.725  -0.393  -0.204
  440   1HB   MET 137          2HB       MET 137 141.224   0.781  -1.050
  441   2HB   MET 137          1HB       MET 137 141.192  -0.933  -1.433
  442   1HG   MET 137          2HG       MET 137 139.005   0.987  -2.182
  443   2HG   MET 137          1HG       MET 137 140.357   0.575  -3.235
  444   1HE   MET 137          1HE       MET 137 137.385   0.237  -4.212
  445   2HE   MET 137          2HE       MET 137 136.813  -0.044  -2.569
  446   3HE   MET 137          3HE       MET 137 136.579  -1.278  -3.805
  447    H    LYS 138           H        LYS 138 141.866  -0.825   1.390
  448    HA   LYS 138           HA       LYS 138 141.884  -3.648   1.236
  449   1HB   LYS 138          2HB       LYS 138 143.725  -1.793   1.923
  450   2HB   LYS 138          1HB       LYS 138 143.268  -2.373   3.518
  451   1HG   LYS 138          2HG       LYS 138 144.051  -4.248   1.313
  452   2HG   LYS 138          1HG       LYS 138 145.240  -3.500   2.381
  453   1HD   LYS 138          2HD       LYS 138 143.758  -4.410   4.291
  454   2HD   LYS 138          1HD       LYS 138 143.066  -5.454   3.048
  455   1HE   LYS 138          2HE       LYS 138 144.927  -6.721   2.890
  456   2HE   LYS 138          1HE       LYS 138 146.009  -5.350   3.133
  457   1HZ   LYS 138          1HZ       LYS 138 144.914  -5.547   5.546
  458   2HZ   LYS 138          2HZ       LYS 138 146.338  -6.347   5.104
  459   3HZ   LYS 138          3HZ       LYS 138 144.862  -7.173   5.079
  460    H    ASP 139           H        ASP 139 140.385  -1.401   3.420
  461    HA   ASP 139           HA       ASP 139 139.910  -3.319   5.502
  462   1HB   ASP 139          2HB       ASP 139 140.044  -0.720   5.664
  463   2HB   ASP 139          1HB       ASP 139 138.348  -0.775   5.197
  464    H    GLY 140           H        GLY 140 138.521  -2.819   2.482
  465   1HA   GLY 140          2HA       GLY 140 136.038  -4.154   3.368
  466   2HA   GLY 140          1HA       GLY 140 136.062  -2.956   2.084
  467    H    ASP 141           H        ASP 141 138.679  -4.109   1.112
  468    HA   ASP 141           HA       ASP 141 137.528  -5.943  -0.753
  469   1HB   ASP 141          2HB       ASP 141 139.556  -4.255  -0.990
  470   2HB   ASP 141          1HB       ASP 141 140.488  -5.656  -0.476
  471    H    LYS 142           H        LYS 142 136.816  -7.746   0.356
  472    HA   LYS 142           HA       LYS 142 138.554  -9.216   2.112
  473   1HB   LYS 142          2HB       LYS 142 135.971 -10.198   0.903
  474   2HB   LYS 142          1HB       LYS 142 136.737 -10.733   2.393
  475   1HG   LYS 142          2HG       LYS 142 135.539  -8.010   1.920
  476   2HG   LYS 142          1HG       LYS 142 134.786  -9.328   2.820
  477   1HD   LYS 142          2HD       LYS 142 137.509  -8.556   3.668
  478   2HD   LYS 142          1HD       LYS 142 136.232  -7.377   3.976
  479   1HE   LYS 142          2HE       LYS 142 135.528 -10.134   4.678
  480   2HE   LYS 142          1HE       LYS 142 136.872  -9.472   5.606
  481   1HZ   LYS 142          1HZ       LYS 142 135.140  -7.445   5.690
  482   2HZ   LYS 142          2HZ       LYS 142 135.226  -8.653   6.869
  483   3HZ   LYS 142          3HZ       LYS 142 134.066  -8.752   5.644
  484    H    ASN 143           H        ASN 143 137.457  -9.475  -1.221
  485    HA   ASN 143           HA       ASN 143 138.899 -11.968  -1.610
  486   1HB   ASN 143          2HB       ASN 143 138.033 -11.739  -3.975
  487   2HB   ASN 143          1HB       ASN 143 136.798 -11.871  -2.727
  488   1HD2  ASN 143          1HD2      ASN 143 135.977 -10.921  -5.041
  489   2HD2  ASN 143          2HD2      ASN 143 135.718  -9.215  -4.982
  490    H    ASN 144           H        ASN 144 139.713  -8.749  -1.588
  491    HA   ASN 144           HA       ASN 144 141.413  -7.502  -2.442
  492   1HB   ASN 144          2HB       ASN 144 142.456 -10.168  -1.862
  493   2HB   ASN 144          1HB       ASN 144 143.420  -9.304  -3.055
  494   1HD2  ASN 144          1HD2      ASN 144 143.650  -6.864  -2.382
  495   2HD2  ASN 144          2HD2      ASN 144 144.204  -6.631  -0.763
  496    H    ASP 145           H        ASP 145 139.454  -8.462  -4.380
  497    HA   ASP 145           HA       ASP 145 140.948  -9.107  -6.768
  498   1HB   ASP 145          2HB       ASP 145 138.757  -9.071  -7.883
  499   2HB   ASP 145          1HB       ASP 145 138.724 -10.068  -6.431
  500    H    GLY 146           H        GLY 146 140.628  -6.308  -5.115
  501   1HA   GLY 146          2HA       GLY 146 141.489  -4.251  -5.901
  502   2HA   GLY 146          1HA       GLY 146 141.091  -4.739  -7.540
  503    H    ARG 147           H        ARG 147 138.365  -5.563  -6.169
  504    HA   ARG 147           HA       ARG 147 137.228  -2.878  -5.911
  505   1HB   ARG 147          2HB       ARG 147 136.094  -4.988  -7.757
  506   2HB   ARG 147          1HB       ARG 147 135.409  -3.398  -7.450
  507   1HG   ARG 147          2HG       ARG 147 137.929  -2.761  -8.260
  508   2HG   ARG 147          1HG       ARG 147 137.590  -4.199  -9.224
  509   1HD   ARG 147          2HD       ARG 147 135.275  -2.916  -9.563
  510   2HD   ARG 147          1HD       ARG 147 136.320  -1.524  -9.281
  511    HE   ARG 147           HE       ARG 147 137.600  -3.105 -11.155
  512   1HH1  ARG 147          1HH1      ARG 147 134.598  -1.343 -10.913
  513   2HH1  ARG 147          2HH1      ARG 147 134.502  -1.026 -12.613
  514   1HH2  ARG 147          1HH2      ARG 147 137.477  -2.690 -13.390
  515   2HH2  ARG 147          2HH2      ARG 147 136.135  -1.791 -14.019
  516    H    ILE 148           H        ILE 148 135.237  -2.792  -4.790
  517    HA   ILE 148           HA       ILE 148 134.710  -5.200  -3.180
  518    HB   ILE 148           HB       ILE 148 134.017  -2.341  -2.490
  519   1HG1  ILE 148          2HG1      ILE 148 136.162  -3.945  -1.134
  520   2HG1  ILE 148          1HG1      ILE 148 136.526  -3.072  -2.620
  521   1HG2  ILE 148          1HG2      ILE 148 134.033  -4.805  -0.756
  522   2HG2  ILE 148          2HG2      ILE 148 132.590  -4.091  -1.475
  523   3HG2  ILE 148          3HG2      ILE 148 133.526  -3.182  -0.289
  524   1HD1  ILE 148          1HD1      ILE 148 135.757  -1.998   0.059
  525   2HD1  ILE 148          2HD1      ILE 148 135.526  -1.037  -1.402
  526   3HD1  ILE 148          3HD1      ILE 148 137.141  -1.591  -0.957
  527    H    ASP 149           H        ASP 149 132.761  -6.129  -3.208
  528    HA   ASP 149           HA       ASP 149 130.680  -4.876  -4.859
  529   1HB   ASP 149          2HB       ASP 149 129.709  -7.157  -5.013
  530   2HB   ASP 149          1HB       ASP 149 131.349  -7.070  -5.645
  531    H    TYR 150           H        TYR 150 128.389  -5.813  -4.118
  532    HA   TYR 150           HA       TYR 150 127.856  -4.545  -1.632
  533   1HB   TYR 150          2HB       TYR 150 126.223  -4.530  -3.448
  534   2HB   TYR 150          1HB       TYR 150 126.080  -6.282  -3.358
  535    HD1  TYR 150           HD1      TYR 150 124.296  -7.156  -2.183
  536    HD2  TYR 150           HD2      TYR 150 125.725  -3.284  -1.146
  537    HE1  TYR 150           HE1      TYR 150 122.466  -6.923  -0.555
  538    HE2  TYR 150           HE2      TYR 150 123.900  -3.044   0.486
  539    HH   TYR 150           HH       TYR 150 121.222  -4.715   0.511
  540    H    ASP 151           H        ASP 151 128.703  -7.768  -2.456
  541    HA   ASP 151           HA       ASP 151 127.460  -9.049  -0.226
  542   1HB   ASP 151          2HB       ASP 151 129.867 -10.085  -1.719
  543   2HB   ASP 151          1HB       ASP 151 128.625 -11.010  -0.883
  544    H    GLU 152           H        GLU 152 130.865  -8.269  -0.935
  545    HA   GLU 152           HA       GLU 152 131.746  -8.873   1.696
  546   1HB   GLU 152          2HB       GLU 152 133.846  -7.632   0.931
  547   2HB   GLU 152          1HB       GLU 152 133.389  -9.076   0.039
  548   1HG   GLU 152          2HG       GLU 152 132.504  -7.773  -1.752
  549   2HG   GLU 152          1HG       GLU 152 132.709  -6.282  -0.835
  550    H    PHE 153           H        PHE 153 130.808  -5.864   0.086
  551    HA   PHE 153           HA       PHE 153 131.731  -4.126   2.112
  552   1HB   PHE 153          2HB       PHE 153 130.665  -3.749  -0.361
  553   2HB   PHE 153          1HB       PHE 153 129.310  -3.277   0.656
  554    HD1  PHE 153           HD1      PHE 153 131.843  -1.956  -1.138
  555    HD2  PHE 153           HD2      PHE 153 130.326  -1.851   2.837
  556    HE1  PHE 153           HE1      PHE 153 132.880   0.249  -0.804
  557    HE2  PHE 153           HE2      PHE 153 131.361   0.354   3.177
  558    HZ   PHE 153           HZ       PHE 153 132.640   1.408   1.355
  559    H    LEU 154           H        LEU 154 128.851  -6.061   1.797
  560    HA   LEU 154           HA       LEU 154 127.110  -4.826   3.549
  561   1HB   LEU 154          2HB       LEU 154 126.950  -7.055   2.144
  562   2HB   LEU 154          1HB       LEU 154 127.410  -7.793   3.666
  563    HG   LEU 154           HG       LEU 154 125.017  -7.854   3.466
  564   1HD1  LEU 154          1HD1      LEU 154 126.250  -7.116   5.659
  565   2HD1  LEU 154          2HD1      LEU 154 124.489  -7.100   5.563
  566   3HD1  LEU 154          3HD1      LEU 154 125.395  -5.600   5.373
  567   1HD2  LEU 154          1HD2      LEU 154 124.723  -6.047   1.867
  568   2HD2  LEU 154          2HD2      LEU 154 125.165  -4.864   3.096
  569   3HD2  LEU 154          3HD2      LEU 154 123.684  -5.806   3.270
  570    H    GLU 155           H        GLU 155 129.973  -6.710   4.225
  571    HA   GLU 155           HA       GLU 155 129.463  -6.827   7.069
  572   1HB   GLU 155          2HB       GLU 155 131.698  -7.742   5.283
  573   2HB   GLU 155          1HB       GLU 155 131.908  -7.706   7.029
  574   1HG   GLU 155          2HG       GLU 155 129.445  -9.016   6.181
  575   2HG   GLU 155          1HG       GLU 155 130.909  -9.795   5.579
  576    H    PHE 156           H        PHE 156 131.179  -4.808   4.823
  577    HA   PHE 156           HA       PHE 156 133.065  -3.572   6.410
  578   1HB   PHE 156          2HB       PHE 156 132.361  -3.234   3.883
  579   2HB   PHE 156          1HB       PHE 156 131.439  -1.890   4.548
  580    HD1  PHE 156           HD1      PHE 156 132.900  -0.442   6.303
  581    HD2  PHE 156           HD2      PHE 156 134.428  -2.726   3.057
  582    HE1  PHE 156           HE1      PHE 156 134.916   0.964   6.273
  583    HE2  PHE 156           HE2      PHE 156 136.453  -1.321   3.022
  584    HZ   PHE 156           HZ       PHE 156 136.697   0.523   4.630
  585    H    MET 157           H        MET 157 129.601  -3.159   6.389
  586    HA   MET 157           HA       MET 157 129.637  -0.795   8.030
  587   1HB   MET 157          2HB       MET 157 127.588  -2.496   6.755
  588   2HB   MET 157          1HB       MET 157 127.097  -1.749   8.269
  589   1HG   MET 157          2HG       MET 157 126.427  -0.282   6.564
  590   2HG   MET 157          1HG       MET 157 127.854   0.446   7.300
  591   1HE   MET 157          1HE       MET 157 130.595  -0.122   5.648
  592   2HE   MET 157          2HE       MET 157 129.638   1.164   6.384
  593   3HE   MET 157          3HE       MET 157 130.050   1.243   4.671
  594    H    LYS 158           H        LYS 158 128.057  -3.912   8.666
  595    HA   LYS 158           HA       LYS 158 128.067  -3.622  11.455
  596   1HB   LYS 158          2HB       LYS 158 127.626  -6.115  11.457
  597   2HB   LYS 158          1HB       LYS 158 126.510  -5.139  10.512
  598   1HG   LYS 158          2HG       LYS 158 127.424  -5.857   8.479
  599   2HG   LYS 158          1HG       LYS 158 128.875  -6.490   9.259
  600   1HD   LYS 158          2HD       LYS 158 127.907  -8.462   9.681
  601   2HD   LYS 158          1HD       LYS 158 126.434  -7.700  10.285
  602   1HE   LYS 158          2HE       LYS 158 125.643  -8.810   8.431
  603   2HE   LYS 158          1HE       LYS 158 125.989  -7.218   7.761
  604   1HZ   LYS 158          1HZ       LYS 158 128.101  -9.248   7.688
  605   2HZ   LYS 158          2HZ       LYS 158 127.780  -7.989   6.606
  606   3HZ   LYS 158          3HZ       LYS 158 126.823  -9.384   6.587
  607    H    GLY 159           H        GLY 159 130.384  -2.874  11.530
  608   1HA   GLY 159          2HA       GLY 159 132.156  -3.752  13.008
  609   2HA   GLY 159          1HA       GLY 159 132.155  -5.194  12.003
  610    H    VAL 160           H        VAL 160 133.068  -1.826  12.204
  611    HA   VAL 160           HA       VAL 160 134.504  -1.990   9.663
  612    HB   VAL 160           HB       VAL 160 134.423   0.431  11.446
  613   1HG1  VAL 160          1HG1      VAL 160 135.177  -0.181   8.653
  614   2HG1  VAL 160          2HG1      VAL 160 135.871   0.974   9.790
  615   3HG1  VAL 160          3HG1      VAL 160 134.374   1.362   8.942
  616   1HG2  VAL 160          1HG2      VAL 160 132.398  -0.144   9.293
  617   2HG2  VAL 160          2HG2      VAL 160 132.411   1.189  10.446
  618   3HG2  VAL 160          3HG2      VAL 160 132.098  -0.455  11.002
  619    H    GLU 161           H        GLU 161 135.512  -3.633  11.686
  620    HA   GLU 161           HA       GLU 161 138.136  -2.389  12.105
  621   1HB   GLU 161          2HB       GLU 161 138.197  -3.651  14.338
  622   2HB   GLU 161          1HB       GLU 161 137.242  -2.176  14.263
  623   1HG   GLU 161          2HG       GLU 161 135.742  -4.596  13.608
  624   2HG   GLU 161          1HG       GLU 161 136.386  -4.564  15.248
  Start of MODEL    5
    1   1H    MET  81          1HT       MET  81  96.391 -16.063   7.856
    2   2H    MET  81          2HT       MET  81  96.038 -14.780   8.941
    3   3H    MET  81          3HT       MET  81  96.001 -14.509   7.247
    4    HA   MET  81           HA       MET  81  94.200 -16.112   7.070
    5   1HB   MET  81          2HB       MET  81  95.046 -16.803   9.604
    6   2HB   MET  81          1HB       MET  81  93.565 -15.909   9.924
    7   1HG   MET  81          2HG       MET  81  92.247 -17.499   9.033
    8   2HG   MET  81          1HG       MET  81  93.413 -17.915   7.776
    9   1HE   MET  81          1HE       MET  81  92.579 -20.632   8.338
   10   2HE   MET  81          2HE       MET  81  91.508 -19.797   9.462
   11   3HE   MET  81          3HE       MET  81  92.494 -21.148  10.022
   12    H    VAL  82           H        VAL  82  92.660 -14.841   6.290
   13    HA   VAL  82           HA       VAL  82  91.090 -13.203   6.095
   14    HB   VAL  82           HB       VAL  82  91.574 -12.582   9.011
   15   1HG1  VAL  82          1HG1      VAL  82  89.595 -11.730   6.983
   16   2HG1  VAL  82          2HG1      VAL  82  90.254 -10.854   8.365
   17   3HG1  VAL  82          3HG1      VAL  82  88.986 -12.057   8.605
   18   1HG2  VAL  82          1HG2      VAL  82  89.237 -14.201   8.293
   19   2HG2  VAL  82          2HG2      VAL  82  90.349 -14.351   9.652
   20   3HG2  VAL  82          3HG2      VAL  82  90.787 -15.014   8.078
   21    H    ARG  83           H        ARG  83  93.407 -11.878   8.465
   22    HA   ARG  83           HA       ARG  83  93.693  -9.524   6.742
   23   1HB   ARG  83          2HB       ARG  83  94.836  -8.545   8.807
   24   2HB   ARG  83          1HB       ARG  83  93.104  -8.819   8.899
   25   1HG   ARG  83          2HG       ARG  83  94.313 -11.174   9.836
   26   2HG   ARG  83          1HG       ARG  83  95.200  -9.837  10.564
   27   1HD   ARG  83          2HD       ARG  83  92.659  -8.978  10.881
   28   2HD   ARG  83          1HD       ARG  83  92.420 -10.722  10.974
   29    HE   ARG  83           HE       ARG  83  94.567  -9.748  12.623
   30   1HH1  ARG  83          1HH1      ARG  83  91.135 -10.356  12.451
   31   2HH1  ARG  83          2HH1      ARG  83  90.945 -10.483  14.167
   32   1HH2  ARG  83          1HH2      ARG  83  94.320  -9.916  14.880
   33   2HH2  ARG  83          2HH2      ARG  83  92.753 -10.234  15.547
   34    H    CYS  84           H        CYS  84  95.748 -11.656   8.739
   35    HA   CYS  84           HA       CYS  84  97.906 -12.330   8.513
   36   1HB   CYS  84          2HB       CYS  84  96.798 -12.861   6.157
   37   2HB   CYS  84          1HB       CYS  84  97.940 -11.638   5.613
   38    HG   CYS  84           HG       CYS  84  99.880 -13.159   6.259
   39    H    MET  85           H        MET  85  99.440 -11.119   9.393
   40    HA   MET  85           HA       MET  85  99.871  -8.393   8.477
   41   1HB   MET  85          2HB       MET  85  99.985  -9.610  10.962
   42   2HB   MET  85          1HB       MET  85 101.679  -9.374  10.550
   43   1HG   MET  85          2HG       MET  85 101.231  -6.993  10.150
   44   2HG   MET  85          1HG       MET  85  99.552  -7.246  10.625
   45   1HE   MET  85          1HE       MET  85  99.941  -5.204  12.702
   46   2HE   MET  85          2HE       MET  85  99.632  -6.232  14.101
   47   3HE   MET  85          3HE       MET  85  98.775  -6.523  12.586
   48    H    LYS  86           H        LYS  86 101.631  -7.673   7.393
   49    HA   LYS  86           HA       LYS  86 103.771  -9.616   6.826
   50   1HB   LYS  86          2HB       LYS  86 102.011  -9.055   4.950
   51   2HB   LYS  86          1HB       LYS  86 102.972  -7.594   4.772
   52   1HG   LYS  86          2HG       LYS  86 104.604  -8.670   3.710
   53   2HG   LYS  86          1HG       LYS  86 104.599 -10.000   4.868
   54   1HD   LYS  86          2HD       LYS  86 103.321 -11.289   3.551
   55   2HD   LYS  86          1HD       LYS  86 102.249  -9.953   3.132
   56   1HE   LYS  86          2HE       LYS  86 104.192  -9.139   1.654
   57   2HE   LYS  86          1HE       LYS  86 104.834 -10.770   1.849
   58   1HZ   LYS  86          1HZ       LYS  86 102.092 -10.224   0.864
   59   2HZ   LYS  86          2HZ       LYS  86 102.938 -11.686   0.811
   60   3HZ   LYS  86          3HZ       LYS  86 103.424 -10.395  -0.167
   61    H    ASP  87           H        ASP  87 103.099  -6.174   6.156
   62    HA   ASP  87           HA       ASP  87 105.838  -5.455   6.595
   63   1HB   ASP  87          2HB       ASP  87 104.268  -4.305   4.986
   64   2HB   ASP  87          1HB       ASP  87 103.467  -3.593   6.382
   65    H    ASP  88           H        ASP  88 106.776  -5.034   8.475
   66    HA   ASP  88           HA       ASP  88 105.135  -4.008  10.688
   67   1HB   ASP  88          2HB       ASP  88 106.797  -6.457  10.603
   68   2HB   ASP  88          1HB       ASP  88 106.957  -5.468  12.051
   69    H    SER  89           H        SER  89 106.196  -2.643  12.150
   70    HA   SER  89           HA       SER  89 108.254  -1.045  11.042
   71   1HB   SER  89          2HB       SER  89 107.109  -1.148  13.841
   72   2HB   SER  89          1HB       SER  89 108.240   0.083  13.278
   73    HG   SER  89           HG       SER  89 105.857   0.512  13.159
   74    H    LYS  90           H        LYS  90 110.176  -2.032  10.701
   75    HA   LYS  90           HA       LYS  90 111.453  -3.362  12.997
   76   1HB   LYS  90          2HB       LYS  90 111.316  -3.999  10.148
   77   2HB   LYS  90          1HB       LYS  90 112.959  -4.024  10.772
   78   1HG   LYS  90          2HG       LYS  90 112.306  -5.612  12.491
   79   2HG   LYS  90          1HG       LYS  90 110.638  -5.562  11.917
   80   1HD   LYS  90          2HD       LYS  90 112.116  -6.132   9.641
   81   2HD   LYS  90          1HD       LYS  90 112.908  -7.068  10.910
   82   1HE   LYS  90          2HE       LYS  90 111.320  -8.596  10.536
   83   2HE   LYS  90          1HE       LYS  90 110.251  -7.507  11.418
   84   1HZ   LYS  90          1HZ       LYS  90 110.328  -8.134   8.599
   85   2HZ   LYS  90          2HZ       LYS  90 110.158  -6.486   8.939
   86   3HZ   LYS  90          3HZ       LYS  90 109.040  -7.596   9.554
   87    H    GLY  91           H        GLY  91 114.055  -3.355  12.261
   88   1HA   GLY  91          2HA       GLY  91 114.708  -0.492  12.410
   89   2HA   GLY  91          1HA       GLY  91 115.735  -1.804  12.966
   90    H    LYS  92           H        LYS  92 117.525  -1.879  11.789
   91    HA   LYS  92           HA       LYS  92 117.593  -0.910   9.080
   92   1HB   LYS  92          2HB       LYS  92 120.006  -1.691   9.204
   93   2HB   LYS  92          1HB       LYS  92 119.532  -0.445  10.351
   94   1HG   LYS  92          2HG       LYS  92 119.197  -3.158  11.374
   95   2HG   LYS  92          1HG       LYS  92 120.864  -2.750  10.961
   96   1HD   LYS  92          2HD       LYS  92 119.089  -1.032  12.692
   97   2HD   LYS  92          1HD       LYS  92 120.214  -2.236  13.325
   98   1HE   LYS  92          2HE       LYS  92 121.598  -0.446  13.410
   99   2HE   LYS  92          1HE       LYS  92 121.882  -0.888  11.727
  100   1HZ   LYS  92          1HZ       LYS  92 120.830   0.935  10.984
  101   2HZ   LYS  92          2HZ       LYS  92 121.158   1.550  12.525
  102   3HZ   LYS  92          3HZ       LYS  92 119.638   0.889  12.186
  103    H    THR  93           H        THR  93 117.623  -2.059   7.229
  104    HA   THR  93           HA       THR  93 117.399  -4.986   7.475
  105    HB   THR  93           HB       THR  93 116.221  -4.760   5.198
  106    HG1  THR  93           HG1      THR  93 115.962  -2.092   6.120
  107   1HG2  THR  93          1HG2      THR  93 114.946  -3.701   7.703
  108   2HG2  THR  93          2HG2      THR  93 114.902  -5.351   7.080
  109   3HG2  THR  93          3HG2      THR  93 114.062  -4.059   6.221
  110    H    GLU  94           H        GLU  94 117.903  -6.044   5.226
  111    HA   GLU  94           HA       GLU  94 120.664  -5.416   4.656
  112   1HB   GLU  94          2HB       GLU  94 118.877  -7.678   4.351
  113   2HB   GLU  94          1HB       GLU  94 119.833  -7.412   2.900
  114   1HG   GLU  94          2HG       GLU  94 121.812  -7.883   3.943
  115   2HG   GLU  94          1HG       GLU  94 121.216  -7.397   5.530
  116    H    GLU  95           H        GLU  95 117.881  -4.137   3.553
  117    HA   GLU  95           HA       GLU  95 118.705  -3.949   0.753
  118   1HB   GLU  95          2HB       GLU  95 116.214  -4.200   1.938
  119   2HB   GLU  95          1HB       GLU  95 116.280  -2.500   1.496
  120   1HG   GLU  95          2HG       GLU  95 117.258  -3.984  -0.701
  121   2HG   GLU  95          1HG       GLU  95 115.775  -4.762  -0.150
  122    H    GLU  96           H        GLU  96 118.413  -2.048   3.663
  123    HA   GLU  96           HA       GLU  96 118.518   0.529   2.595
  124   1HB   GLU  96          2HB       GLU  96 119.814  -0.398   5.164
  125   2HB   GLU  96          1HB       GLU  96 119.329   1.244   4.766
  126   1HG   GLU  96          2HG       GLU  96 117.531  -1.119   5.237
  127   2HG   GLU  96          1HG       GLU  96 117.727   0.301   6.265
  128    H    LEU  97           H        LEU  97 121.035  -1.843   3.114
  129    HA   LEU  97           HA       LEU  97 123.259  -0.139   2.813
  130   1HB   LEU  97          2HB       LEU  97 122.801  -3.079   2.574
  131   2HB   LEU  97          1HB       LEU  97 124.316  -2.412   1.998
  132    HG   LEU  97           HG       LEU  97 123.487  -1.626   4.732
  133   1HD1  LEU  97          1HD1      LEU  97 123.127  -4.219   4.216
  134   2HD1  LEU  97          2HD1      LEU  97 123.748  -3.626   5.756
  135   3HD1  LEU  97          3HD1      LEU  97 124.862  -4.234   4.533
  136   1HD2  LEU  97          1HD2      LEU  97 125.908  -1.930   5.120
  137   2HD2  LEU  97          2HD2      LEU  97 125.559  -0.800   3.813
  138   3HD2  LEU  97          3HD2      LEU  97 126.087  -2.441   3.442
  139    H    SER  98           H        SER  98 121.094  -1.596   0.512
  140    HA   SER  98           HA       SER  98 122.746  -1.427  -1.774
  141   1HB   SER  98          2HB       SER  98 120.028  -2.149  -1.184
  142   2HB   SER  98          1HB       SER  98 120.054  -1.073  -2.580
  143    HG   SER  98           HG       SER  98 121.785  -2.529  -3.369
  144    H    ASP  99           H        ASP  99 120.221   0.753  -0.532
  145    HA   ASP  99           HA       ASP  99 120.493   2.728  -2.505
  146   1HB   ASP  99          2HB       ASP  99 118.675   2.413  -0.664
  147   2HB   ASP  99          1HB       ASP  99 119.746   3.403   0.325
  148    H    LEU 100           H        LEU 100 122.348   2.033   0.352
  149    HA   LEU 100           HA       LEU 100 123.743   4.575   0.287
  150   1HB   LEU 100          2HB       LEU 100 123.964   2.124   2.017
  151   2HB   LEU 100          1HB       LEU 100 125.125   3.433   2.116
  152    HG   LEU 100           HG       LEU 100 122.205   4.020   2.416
  153   1HD1  LEU 100          1HD1      LEU 100 123.928   2.529   4.296
  154   2HD1  LEU 100          2HD1      LEU 100 122.176   2.511   4.099
  155   3HD1  LEU 100          3HD1      LEU 100 122.950   3.830   4.977
  156   1HD2  LEU 100          1HD2      LEU 100 123.561   5.947   2.259
  157   2HD2  LEU 100          2HD2      LEU 100 124.778   5.270   3.341
  158   3HD2  LEU 100          3HD2      LEU 100 123.204   5.747   3.974
  159    H    PHE 101           H        PHE 101 124.217   1.277  -0.758
  160    HA   PHE 101           HA       PHE 101 127.002   1.364  -1.169
  161   1HB   PHE 101          2HB       PHE 101 125.716  -0.736  -1.143
  162   2HB   PHE 101          1HB       PHE 101 124.923  -0.268  -2.644
  163    HD1  PHE 101           HD1      PHE 101 126.424   0.127  -4.685
  164    HD2  PHE 101           HD2      PHE 101 127.700  -1.932  -1.186
  165    HE1  PHE 101           HE1      PHE 101 128.238  -0.927  -5.971
  166    HE2  PHE 101           HE2      PHE 101 129.516  -2.990  -2.465
  167    HZ   PHE 101           HZ       PHE 101 129.787  -2.487  -4.860
  168    H    ARG 102           H        ARG 102 124.274   2.140  -3.301
  169    HA   ARG 102           HA       ARG 102 125.684   2.575  -5.658
  170   1HB   ARG 102          2HB       ARG 102 123.135   3.740  -4.569
  171   2HB   ARG 102          1HB       ARG 102 123.763   4.235  -6.133
  172   1HG   ARG 102          2HG       ARG 102 123.548   2.045  -7.013
  173   2HG   ARG 102          1HG       ARG 102 123.224   1.367  -5.417
  174   1HD   ARG 102          2HD       ARG 102 121.189   2.934  -5.392
  175   2HD   ARG 102          1HD       ARG 102 121.456   3.087  -7.126
  176    HE   ARG 102           HE       ARG 102 121.416   0.380  -6.588
  177   1HH1  ARG 102          1HH1      ARG 102 119.219   3.072  -6.270
  178   2HH1  ARG 102          2HH1      ARG 102 117.799   2.102  -6.476
  179   1HH2  ARG 102          1HH2      ARG 102 119.550  -0.900  -6.860
  180   2HH2  ARG 102          2HH2      ARG 102 117.989  -0.154  -6.811
  181    H    MET 103           H        MET 103 125.166   4.696  -2.898
  182    HA   MET 103           HA       MET 103 126.031   7.109  -3.979
  183   1HB   MET 103          2HB       MET 103 126.330   6.035  -1.172
  184   2HB   MET 103          1HB       MET 103 126.654   7.703  -1.626
  185   1HG   MET 103          2HG       MET 103 124.294   7.852  -2.432
  186   2HG   MET 103          1HG       MET 103 124.021   6.260  -1.729
  187   1HE   MET 103          1HE       MET 103 123.143   9.391  -1.549
  188   2HE   MET 103          2HE       MET 103 124.329  10.254  -0.570
  189   3HE   MET 103          3HE       MET 103 122.785   9.771   0.136
  190    H    PHE 104           H        PHE 104 127.839   4.306  -3.011
  191    HA   PHE 104           HA       PHE 104 130.381   5.705  -3.099
  192   1HB   PHE 104          2HB       PHE 104 129.512   2.928  -2.400
  193   2HB   PHE 104          1HB       PHE 104 131.198   3.225  -2.810
  194    HD1  PHE 104           HD1      PHE 104 128.622   5.023  -0.788
  195    HD2  PHE 104           HD2      PHE 104 132.533   3.352  -0.959
  196    HE1  PHE 104           HE1      PHE 104 129.043   5.782   1.514
  197    HE2  PHE 104           HE2      PHE 104 132.961   4.107   1.344
  198    HZ   PHE 104           HZ       PHE 104 131.214   5.325   2.583
  199    H    ASP 105           H        ASP 105 128.313   4.254  -5.331
  200    HA   ASP 105           HA       ASP 105 130.515   3.578  -7.148
  201   1HB   ASP 105          2HB       ASP 105 128.268   2.146  -6.565
  202   2HB   ASP 105          1HB       ASP 105 127.752   3.012  -8.011
  203    H    LYS 106           H        LYS 106 130.858   4.678  -9.006
  204    HA   LYS 106           HA       LYS 106 129.042   6.927  -9.578
  205   1HB   LYS 106          2HB       LYS 106 132.019   6.730 -10.075
  206   2HB   LYS 106          1HB       LYS 106 131.003   8.096 -10.513
  207   1HG   LYS 106          2HG       LYS 106 131.072   7.192  -7.675
  208   2HG   LYS 106          1HG       LYS 106 132.420   8.131  -8.320
  209   1HD   LYS 106          2HD       LYS 106 131.195  10.028  -8.477
  210   2HD   LYS 106          1HD       LYS 106 129.722   9.164  -8.921
  211   1HE   LYS 106          2HE       LYS 106 130.797   8.911  -6.147
  212   2HE   LYS 106          1HE       LYS 106 129.913  10.368  -6.604
  213   1HZ   LYS 106          1HZ       LYS 106 128.704   7.794  -7.273
  214   2HZ   LYS 106          2HZ       LYS 106 127.969   9.242  -6.796
  215   3HZ   LYS 106          3HZ       LYS 106 128.708   8.246  -5.643
  216    H    ASN 107           H        ASN 107 131.107   4.432 -10.990
  217    HA   ASN 107           HA       ASN 107 130.274   5.035 -13.681
  218   1HB   ASN 107          2HB       ASN 107 131.711   2.550 -12.756
  219   2HB   ASN 107          1HB       ASN 107 131.717   3.268 -14.363
  220   1HD2  ASN 107          1HD2      ASN 107 132.858   5.229 -14.685
  221   2HD2  ASN 107          2HD2      ASN 107 134.158   5.675 -13.639
  222    H    ALA 108           H        ALA 108 128.658   3.625 -11.205
  223    HA   ALA 108           HA       ALA 108 126.929   2.151 -11.006
  224   1HB   ALA 108          1HB       ALA 108 125.432   2.110 -13.107
  225   2HB   ALA 108          2HB       ALA 108 126.558   3.310 -13.742
  226   3HB   ALA 108          3HB       ALA 108 125.662   3.641 -12.261
  227    H    ASP 109           H        ASP 109 128.988   0.621 -11.127
  228    HA   ASP 109           HA       ASP 109 128.405  -1.413 -13.179
  229   1HB   ASP 109          2HB       ASP 109 130.762  -2.085 -13.072
  230   2HB   ASP 109          1HB       ASP 109 130.602  -0.396 -13.543
  231    H    GLY 110           H        GLY 110 128.268  -0.729  -9.906
  232   1HA   GLY 110          2HA       GLY 110 127.389  -2.201  -8.297
  233   2HA   GLY 110          1HA       GLY 110 127.870  -3.557  -9.305
  234    H    TYR 111           H        TYR 111 130.570  -1.963  -9.476
  235    HA   TYR 111           HA       TYR 111 131.607  -2.861  -6.870
  236   1HB   TYR 111          2HB       TYR 111 133.072  -3.083  -9.507
  237   2HB   TYR 111          1HB       TYR 111 133.608  -3.690  -7.942
  238    HD1  TYR 111           HD1      TYR 111 132.779  -5.766  -7.069
  239    HD2  TYR 111           HD2      TYR 111 131.229  -4.198 -10.707
  240    HE1  TYR 111           HE1      TYR 111 131.701  -7.926  -7.534
  241    HE2  TYR 111           HE2      TYR 111 130.145  -6.353 -11.181
  242    HH   TYR 111           HH       TYR 111 130.841  -9.192  -9.396
  243    H    ILE 112           H        ILE 112 133.334  -1.672  -5.999
  244    HA   ILE 112           HA       ILE 112 133.727   0.973  -7.241
  245    HB   ILE 112           HB       ILE 112 133.864   0.298  -4.301
  246   1HG1  ILE 112          2HG1      ILE 112 131.795   2.159  -4.922
  247   2HG1  ILE 112          1HG1      ILE 112 131.609   0.770  -5.988
  248   1HG2  ILE 112          1HG2      ILE 112 134.706   2.327  -3.940
  249   2HG2  ILE 112          2HG2      ILE 112 133.528   3.088  -5.010
  250   3HG2  ILE 112          3HG2      ILE 112 135.014   2.409  -5.674
  251   1HD1  ILE 112          1HD1      ILE 112 131.966  -0.532  -3.702
  252   2HD1  ILE 112          2HD1      ILE 112 130.386   0.037  -4.239
  253   3HD1  ILE 112          3HD1      ILE 112 131.304   0.971  -3.059
  254    H    ASP 113           H        ASP 113 135.729   1.519  -7.798
  255    HA   ASP 113           HA       ASP 113 137.951  -0.136  -6.805
  256   1HB   ASP 113          2HB       ASP 113 137.243   0.262  -9.387
  257   2HB   ASP 113          1HB       ASP 113 138.381   1.590  -9.170
  258    H    LEU 114           H        LEU 114 140.129   1.204  -7.103
  259    HA   LEU 114           HA       LEU 114 140.138   3.149  -5.090
  260   1HB   LEU 114          2HB       LEU 114 142.047   1.692  -6.277
  261   2HB   LEU 114          1HB       LEU 114 142.302   3.211  -7.115
  262    HG   LEU 114           HG       LEU 114 142.529   4.324  -4.879
  263   1HD1  LEU 114          1HD1      LEU 114 142.260   1.481  -3.981
  264   2HD1  LEU 114          2HD1      LEU 114 141.463   2.926  -3.360
  265   3HD1  LEU 114          3HD1      LEU 114 143.175   2.654  -3.034
  266   1HD2  LEU 114          1HD2      LEU 114 144.602   4.068  -5.747
  267   2HD2  LEU 114          2HD2      LEU 114 144.387   2.341  -6.039
  268   3HD2  LEU 114          3HD2      LEU 114 144.763   2.924  -4.416
  269    H    GLU 115           H        GLU 115 140.067   3.459  -8.611
  270    HA   GLU 115           HA       GLU 115 140.361   6.289  -8.635
  271   1HB   GLU 115          2HB       GLU 115 139.878   4.159 -10.588
  272   2HB   GLU 115          1HB       GLU 115 139.081   5.673 -10.993
  273   1HG   GLU 115          2HG       GLU 115 141.890   5.902 -10.153
  274   2HG   GLU 115          1HG       GLU 115 141.611   5.060 -11.677
  275    H    GLU 116           H        GLU 116 137.600   4.103  -8.614
  276    HA   GLU 116           HA       GLU 116 135.629   6.099  -9.064
  277   1HB   GLU 116          2HB       GLU 116 135.381   3.584  -9.371
  278   2HB   GLU 116          1HB       GLU 116 135.205   3.482  -7.624
  279   1HG   GLU 116          2HG       GLU 116 133.330   5.236  -7.965
  280   2HG   GLU 116          1HG       GLU 116 133.369   4.691  -9.642
  281    H    LEU 117           H        LEU 117 136.355   4.262  -6.097
  282    HA   LEU 117           HA       LEU 117 134.837   5.695  -4.314
  283   1HB   LEU 117          2HB       LEU 117 136.250   3.593  -3.936
  284   2HB   LEU 117          1HB       LEU 117 137.582   4.687  -3.614
  285    HG   LEU 117           HG       LEU 117 136.180   5.720  -1.795
  286   1HD1  LEU 117          1HD1      LEU 117 134.135   4.950  -1.230
  287   2HD1  LEU 117          2HD1      LEU 117 134.520   3.286  -1.674
  288   3HD1  LEU 117          3HD1      LEU 117 134.097   4.458  -2.923
  289   1HD2  LEU 117          1HD2      LEU 117 137.950   4.173  -1.258
  290   2HD2  LEU 117          2HD2      LEU 117 136.893   2.799  -1.582
  291   3HD2  LEU 117          3HD2      LEU 117 136.563   3.862  -0.214
  292    H    LYS 118           H        LYS 118 137.846   6.620  -5.791
  293    HA   LYS 118           HA       LYS 118 138.684   8.610  -4.013
  294   1HB   LYS 118          2HB       LYS 118 139.227   7.870  -6.806
  295   2HB   LYS 118          1HB       LYS 118 139.465   9.577  -6.456
  296   1HG   LYS 118          2HG       LYS 118 140.923   8.889  -4.539
  297   2HG   LYS 118          1HG       LYS 118 140.807   7.233  -5.137
  298   1HD   LYS 118          2HD       LYS 118 141.664   8.095  -7.346
  299   2HD   LYS 118          1HD       LYS 118 142.001   9.623  -6.529
  300   1HE   LYS 118          2HE       LYS 118 143.081   6.969  -5.602
  301   2HE   LYS 118          1HE       LYS 118 143.946   8.032  -6.710
  302   1HZ   LYS 118          1HZ       LYS 118 143.500   8.300  -3.855
  303   2HZ   LYS 118          2HZ       LYS 118 143.364   9.730  -4.748
  304   3HZ   LYS 118          3HZ       LYS 118 144.796   8.830  -4.803
  305    H    ILE 119           H        ILE 119 136.169   8.600  -6.425
  306    HA   ILE 119           HA       ILE 119 135.842  11.468  -6.424
  307    HB   ILE 119           HB       ILE 119 133.948   9.384  -7.513
  308   1HG1  ILE 119          2HG1      ILE 119 135.721  10.880  -9.347
  309   2HG1  ILE 119          1HG1      ILE 119 136.519   9.679  -8.338
  310   1HG2  ILE 119          1HG2      ILE 119 133.054  11.157  -8.857
  311   2HG2  ILE 119          2HG2      ILE 119 134.283  12.280  -8.276
  312   3HG2  ILE 119          3HG2      ILE 119 133.047  11.676  -7.173
  313   1HD1  ILE 119          1HD1      ILE 119 134.111   8.618  -9.511
  314   2HD1  ILE 119          2HD1      ILE 119 135.769   8.022  -9.598
  315   3HD1  ILE 119          3HD1      ILE 119 135.211   9.244 -10.740
  316    H    MET 120           H        MET 120 134.183   8.676  -5.022
  317    HA   MET 120           HA       MET 120 131.936   9.919  -3.986
  318   1HB   MET 120          2HB       MET 120 132.163   7.519  -3.942
  319   2HB   MET 120          1HB       MET 120 133.555   7.624  -2.874
  320   1HG   MET 120          2HG       MET 120 131.414   8.972  -1.611
  321   2HG   MET 120          1HG       MET 120 130.797   7.433  -2.212
  322   1HE   MET 120          1HE       MET 120 134.550   8.033  -1.195
  323   2HE   MET 120          2HE       MET 120 134.488   7.735   0.543
  324   3HE   MET 120          3HE       MET 120 133.664   9.135  -0.142
  325    H    LEU 121           H        LEU 121 135.162   9.610  -2.554
  326    HA   LEU 121           HA       LEU 121 134.468  10.945  -0.130
  327   1HB   LEU 121          2HB       LEU 121 136.915  11.033   0.243
  328   2HB   LEU 121          1HB       LEU 121 136.319   9.425  -0.123
  329    HG   LEU 121           HG       LEU 121 137.025  10.251  -2.604
  330   1HD1  LEU 121          1HD1      LEU 121 139.133  11.414  -2.503
  331   2HD1  LEU 121          2HD1      LEU 121 139.051  11.482  -0.743
  332   3HD1  LEU 121          3HD1      LEU 121 137.890  12.386  -1.717
  333   1HD2  LEU 121          1HD2      LEU 121 138.412   8.736  -0.454
  334   2HD2  LEU 121          2HD2      LEU 121 139.307   9.111  -1.927
  335   3HD2  LEU 121          3HD2      LEU 121 137.808   8.188  -2.018
  336    H    GLN 122           H        GLN 122 135.787  11.948  -3.224
  337    HA   GLN 122           HA       GLN 122 136.605  14.539  -2.489
  338   1HB   GLN 122          2HB       GLN 122 135.933  13.172  -5.053
  339   2HB   GLN 122          1HB       GLN 122 136.031  14.927  -5.056
  340   1HG   GLN 122          2HG       GLN 122 138.309  14.116  -3.702
  341   2HG   GLN 122          1HG       GLN 122 138.139  12.951  -5.015
  342   1HE2  GLN 122          1HE2      GLN 122 137.998  16.439  -4.398
  343   2HE2  GLN 122          2HE2      GLN 122 138.751  16.907  -5.880
  344    H    ALA 123           H        ALA 123 133.490  13.178  -3.210
  345    HA   ALA 123           HA       ALA 123 132.065  15.502  -3.846
  346   1HB   ALA 123          1HB       ALA 123 130.770  13.699  -4.281
  347   2HB   ALA 123          2HB       ALA 123 130.161  14.037  -2.663
  348   3HB   ALA 123          3HB       ALA 123 131.383  12.788  -2.902
  349    H    THR 124           H        THR 124 133.176  14.253  -0.786
  350    HA   THR 124           HA       THR 124 131.453  15.836   0.848
  351    HB   THR 124           HB       THR 124 132.835  15.122   2.694
  352    HG1  THR 124           HG1      THR 124 134.862  14.628   2.464
  353   1HG2  THR 124          1HG2      THR 124 132.282  12.960   2.666
  354   2HG2  THR 124          2HG2      THR 124 133.136  12.655   1.153
  355   3HG2  THR 124          3HG2      THR 124 131.517  13.353   1.126
  356    H    GLY 125           H        GLY 125 132.793  17.212   2.626
  357   1HA   GLY 125          2HA       GLY 125 134.225  19.243   1.035
  358   2HA   GLY 125          1HA       GLY 125 133.263  19.592   2.462
  359    H    GLU 126           H        GLU 126 135.152  16.779   2.760
  360    HA   GLU 126           HA       GLU 126 137.036  18.237   4.475
  361   1HB   GLU 126          2HB       GLU 126 136.212  15.332   4.444
  362   2HB   GLU 126          1HB       GLU 126 137.476  15.982   5.478
  363   1HG   GLU 126          2HG       GLU 126 134.718  17.131   5.530
  364   2HG   GLU 126          1HG       GLU 126 135.113  15.673   6.438
  365    H    THR 127           H        THR 127 139.196  16.870   4.689
  366    HA   THR 127           HA       THR 127 140.190  16.505   1.943
  367    HB   THR 127           HB       THR 127 142.410  17.088   2.832
  368    HG1  THR 127           HG1      THR 127 142.653  17.696   4.942
  369   1HG2  THR 127          1HG2      THR 127 140.524  18.864   2.235
  370   2HG2  THR 127          2HG2      THR 127 142.130  19.326   2.801
  371   3HG2  THR 127          3HG2      THR 127 140.775  19.287   3.929
  372    H    ILE 128           H        ILE 128 140.762  14.524   1.355
  373    HA   ILE 128           HA       ILE 128 141.496  12.587   3.454
  374    HB   ILE 128           HB       ILE 128 140.158  11.843   0.861
  375   1HG1  ILE 128          2HG1      ILE 128 138.662  13.305   2.187
  376   2HG1  ILE 128          1HG1      ILE 128 138.059  11.654   2.081
  377   1HG2  ILE 128          1HG2      ILE 128 141.300  10.000   1.785
  378   2HG2  ILE 128          2HG2      ILE 128 139.606   9.785   2.228
  379   3HG2  ILE 128          3HG2      ILE 128 140.761  10.387   3.419
  380   1HD1  ILE 128          1HD1      ILE 128 139.162  11.288   4.345
  381   2HD1  ILE 128          2HD1      ILE 128 137.709  12.286   4.297
  382   3HD1  ILE 128          3HD1      ILE 128 139.296  13.045   4.426
  383    H    THR 129           H        THR 129 143.345  11.471   3.177
  384    HA   THR 129           HA       THR 129 145.034  12.190   0.934
  385    HB   THR 129           HB       THR 129 146.012  12.184   3.161
  386    HG1  THR 129           HG1      THR 129 147.796  10.878   2.702
  387   1HG2  THR 129          1HG2      THR 129 144.521   9.908   3.633
  388   2HG2  THR 129          2HG2      THR 129 145.747  10.606   4.691
  389   3HG2  THR 129          3HG2      THR 129 146.186   9.329   3.555
  390    H    GLU 130           H        GLU 130 146.447  10.328   0.041
  391    HA   GLU 130           HA       GLU 130 144.689   8.502  -1.271
  392   1HB   GLU 130          2HB       GLU 130 146.847   7.603  -2.246
  393   2HB   GLU 130          1HB       GLU 130 146.521   9.306  -2.544
  394   1HG   GLU 130          2HG       GLU 130 148.134   9.999  -0.987
  395   2HG   GLU 130          1HG       GLU 130 148.251   8.392  -0.272
  396    H    ASP 131           H        ASP 131 147.024   8.263   1.345
  397    HA   ASP 131           HA       ASP 131 147.181   5.471   1.525
  398   1HB   ASP 131          2HB       ASP 131 147.724   7.748   3.359
  399   2HB   ASP 131          1HB       ASP 131 147.561   6.151   4.085
  400    H    ASP 132           H        ASP 132 145.013   7.761   3.164
  401    HA   ASP 132           HA       ASP 132 143.627   5.913   4.732
  402   1HB   ASP 132          2HB       ASP 132 142.995   8.632   3.657
  403   2HB   ASP 132          1HB       ASP 132 141.713   7.703   4.428
  404    H    ILE 133           H        ILE 133 143.114   6.936   1.397
  405    HA   ILE 133           HA       ILE 133 140.646   5.567   1.046
  406    HB   ILE 133           HB       ILE 133 142.622   6.354  -1.097
  407   1HG1  ILE 133          2HG1      ILE 133 140.247   7.996  -0.267
  408   2HG1  ILE 133          1HG1      ILE 133 141.781   8.165   0.580
  409   1HG2  ILE 133          1HG2      ILE 133 140.561   6.481  -2.496
  410   2HG2  ILE 133          2HG2      ILE 133 139.669   5.759  -1.158
  411   3HG2  ILE 133          3HG2      ILE 133 140.962   4.854  -1.946
  412   1HD1  ILE 133          1HD1      ILE 133 142.808   9.150  -1.197
  413   2HD1  ILE 133          2HD1      ILE 133 141.153   9.700  -1.455
  414   3HD1  ILE 133          3HD1      ILE 133 141.785   8.339  -2.382
  415    H    GLU 134           H        GLU 134 144.004   4.775   0.180
  416    HA   GLU 134           HA       GLU 134 143.499   2.334  -1.081
  417   1HB   GLU 134          2HB       GLU 134 145.861   3.595   0.215
  418   2HB   GLU 134          1HB       GLU 134 145.935   1.864  -0.092
  419   1HG   GLU 134          2HG       GLU 134 145.610   2.199  -2.436
  420   2HG   GLU 134          1HG       GLU 134 145.294   3.917  -2.195
  421    H    GLU 135           H        GLU 135 144.286   3.017   2.318
  422    HA   GLU 135           HA       GLU 135 144.269   0.359   3.213
  423   1HB   GLU 135          2HB       GLU 135 144.067   1.277   5.450
  424   2HB   GLU 135          1HB       GLU 135 145.195   2.243   4.510
  425   1HG   GLU 135          2HG       GLU 135 143.579   3.972   4.214
  426   2HG   GLU 135          1HG       GLU 135 142.308   2.976   4.921
  427    H    LEU 136           H        LEU 136 141.685   2.640   2.647
  428    HA   LEU 136           HA       LEU 136 139.657   1.298   4.086
  429   1HB   LEU 136          2HB       LEU 136 139.852   3.664   2.706
  430   2HB   LEU 136          1HB       LEU 136 138.783   2.726   1.680
  431    HG   LEU 136           HG       LEU 136 137.748   2.338   4.224
  432   1HD1  LEU 136          1HD1      LEU 136 139.389   4.389   4.659
  433   2HD1  LEU 136          2HD1      LEU 136 137.823   4.238   5.456
  434   3HD1  LEU 136          3HD1      LEU 136 137.997   5.279   4.043
  435   1HD2  LEU 136          1HD2      LEU 136 136.802   4.514   2.394
  436   2HD2  LEU 136          2HD2      LEU 136 135.853   3.407   3.388
  437   3HD2  LEU 136          3HD2      LEU 136 136.671   2.815   1.941
  438    H    MET 137           H        MET 137 140.981   0.888   0.878
  439    HA   MET 137           HA       MET 137 138.895  -0.770  -0.127
  440   1HB   MET 137          2HB       MET 137 141.660  -0.056  -0.988
  441   2HB   MET 137          1HB       MET 137 140.907  -1.472  -1.709
  442   1HG   MET 137          2HG       MET 137 139.117   0.797  -1.694
  443   2HG   MET 137          1HG       MET 137 140.631   1.162  -2.517
  444   1HE   MET 137          1HE       MET 137 137.085  -1.107  -3.777
  445   2HE   MET 137          2HE       MET 137 137.363   0.553  -4.306
  446   3HE   MET 137          3HE       MET 137 137.373   0.162  -2.586
  447    H    LYS 138           H        LYS 138 142.054  -1.422   1.344
  448    HA   LYS 138           HA       LYS 138 141.951  -4.230   1.080
  449   1HB   LYS 138          2HB       LYS 138 143.916  -2.592   1.728
  450   2HB   LYS 138          1HB       LYS 138 143.388  -2.951   3.366
  451   1HG   LYS 138          2HG       LYS 138 143.766  -5.308   3.018
  452   2HG   LYS 138          1HG       LYS 138 144.177  -5.020   1.327
  453   1HD   LYS 138          2HD       LYS 138 146.300  -4.860   1.996
  454   2HD   LYS 138          1HD       LYS 138 145.858  -3.314   2.720
  455   1HE   LYS 138          2HE       LYS 138 145.214  -5.676   4.345
  456   2HE   LYS 138          1HE       LYS 138 146.936  -5.408   4.075
  457   1HZ   LYS 138          1HZ       LYS 138 145.348  -3.090   4.851
  458   2HZ   LYS 138          2HZ       LYS 138 146.924  -3.516   5.289
  459   3HZ   LYS 138          3HZ       LYS 138 145.608  -4.263   6.043
  460    H    ASP 139           H        ASP 139 140.600  -2.018   3.407
  461    HA   ASP 139           HA       ASP 139 139.984  -4.075   5.334
  462   1HB   ASP 139          2HB       ASP 139 140.466  -1.630   5.876
  463   2HB   ASP 139          1HB       ASP 139 138.849  -1.281   5.271
  464    H    GLY 140           H        GLY 140 138.634  -3.185   2.407
  465   1HA   GLY 140          2HA       GLY 140 136.001  -4.227   3.250
  466   2HA   GLY 140          1HA       GLY 140 136.176  -2.962   2.042
  467    H    ASP 141           H        ASP 141 138.714  -4.946   1.488
  468    HA   ASP 141           HA       ASP 141 137.212  -6.457  -0.536
  469   1HB   ASP 141          2HB       ASP 141 139.302  -4.796  -0.945
  470   2HB   ASP 141          1HB       ASP 141 140.167  -6.310  -0.705
  471    H    LYS 142           H        LYS 142 136.689  -8.376   0.343
  472    HA   LYS 142           HA       LYS 142 138.529  -9.786   2.072
  473   1HB   LYS 142          2HB       LYS 142 135.951 -10.886   0.979
  474   2HB   LYS 142          1HB       LYS 142 136.775 -11.316   2.471
  475   1HG   LYS 142          2HG       LYS 142 135.304  -8.761   1.875
  476   2HG   LYS 142          1HG       LYS 142 134.843 -10.026   3.017
  477   1HD   LYS 142          2HD       LYS 142 136.976  -9.546   4.253
  478   2HD   LYS 142          1HD       LYS 142 137.195  -8.149   3.200
  479   1HE   LYS 142          2HE       LYS 142 136.180  -7.359   5.196
  480   2HE   LYS 142          1HE       LYS 142 134.934  -7.356   3.948
  481   1HZ   LYS 142          1HZ       LYS 142 135.140  -8.957   6.360
  482   2HZ   LYS 142          2HZ       LYS 142 134.591  -9.780   4.987
  483   3HZ   LYS 142          3HZ       LYS 142 133.768  -8.410   5.536
  484    H    ASN 143           H        ASN 143 137.317 -10.051  -1.224
  485    HA   ASN 143           HA       ASN 143 138.701 -12.546  -1.688
  486   1HB   ASN 143          2HB       ASN 143 137.899 -12.203  -4.053
  487   2HB   ASN 143          1HB       ASN 143 136.625 -12.280  -2.840
  488   1HD2  ASN 143          1HD2      ASN 143 135.538 -11.245  -4.767
  489   2HD2  ASN 143          2HD2      ASN 143 135.544  -9.517  -4.818
  490    H    ASN 144           H        ASN 144 139.619  -9.341  -1.584
  491    HA   ASN 144           HA       ASN 144 141.399  -8.152  -2.333
  492   1HB   ASN 144          2HB       ASN 144 142.379 -10.937  -2.012
  493   2HB   ASN 144          1HB       ASN 144 143.433  -9.818  -2.871
  494   1HD2  ASN 144          1HD2      ASN 144 141.582 -10.203   0.110
  495   2HD2  ASN 144          2HD2      ASN 144 142.650  -9.276   1.102
  496    H    ASP 145           H        ASP 145 139.465  -9.154  -4.362
  497    HA   ASP 145           HA       ASP 145 140.906  -9.831  -6.716
  498   1HB   ASP 145          2HB       ASP 145 138.790  -9.368  -7.890
  499   2HB   ASP 145          1HB       ASP 145 138.531 -10.375  -6.468
  500    H    GLY 146           H        GLY 146 139.823  -6.815  -5.282
  501   1HA   GLY 146          2HA       GLY 146 141.476  -4.964  -5.852
  502   2HA   GLY 146          1HA       GLY 146 141.072  -5.349  -7.519
  503    H    ARG 147           H        ARG 147 138.286  -5.794  -5.833
  504    HA   ARG 147           HA       ARG 147 137.486  -3.003  -5.718
  505   1HB   ARG 147          2HB       ARG 147 136.154  -4.984  -7.576
  506   2HB   ARG 147          1HB       ARG 147 135.528  -3.385  -7.193
  507   1HG   ARG 147          2HG       ARG 147 137.920  -2.640  -8.035
  508   2HG   ARG 147          1HG       ARG 147 137.816  -4.169  -8.909
  509   1HD   ARG 147          2HD       ARG 147 135.326  -2.871  -9.211
  510   2HD   ARG 147          1HD       ARG 147 136.575  -1.663  -9.505
  511    HE   ARG 147           HE       ARG 147 137.137  -2.757 -11.437
  512   1HH1  ARG 147          1HH1      ARG 147 135.121  -4.842  -9.495
  513   2HH1  ARG 147          2HH1      ARG 147 134.937  -6.031 -10.742
  514   1HH2  ARG 147          1HH2      ARG 147 136.895  -4.319 -13.076
  515   2HH2  ARG 147          2HH2      ARG 147 135.944  -5.734 -12.774
  516    H    ILE 148           H        ILE 148 135.301  -2.742  -4.803
  517    HA   ILE 148           HA       ILE 148 134.693  -4.954  -2.958
  518    HB   ILE 148           HB       ILE 148 133.945  -2.049  -2.624
  519   1HG1  ILE 148          2HG1      ILE 148 136.131  -3.502  -1.141
  520   2HG1  ILE 148          1HG1      ILE 148 136.450  -2.596  -2.617
  521   1HG2  ILE 148          1HG2      ILE 148 132.510  -3.647  -1.445
  522   2HG2  ILE 148          2HG2      ILE 148 133.462  -2.675  -0.325
  523   3HG2  ILE 148          3HG2      ILE 148 133.931  -4.342  -0.665
  524   1HD1  ILE 148          1HD1      ILE 148 135.663  -0.563  -1.565
  525   2HD1  ILE 148          2HD1      ILE 148 136.942  -1.302  -0.604
  526   3HD1  ILE 148          3HD1      ILE 148 135.258  -1.457  -0.099
  527    H    ASP 149           H        ASP 149 132.812  -5.961  -3.105
  528    HA   ASP 149           HA       ASP 149 130.764  -4.837  -4.886
  529   1HB   ASP 149          2HB       ASP 149 129.881  -7.150  -5.009
  530   2HB   ASP 149          1HB       ASP 149 131.553  -7.039  -5.552
  531    H    TYR 150           H        TYR 150 128.479  -5.849  -4.200
  532    HA   TYR 150           HA       TYR 150 127.701  -4.458  -1.894
  533   1HB   TYR 150          2HB       TYR 150 126.233  -5.114  -3.848
  534   2HB   TYR 150          1HB       TYR 150 126.172  -6.734  -3.162
  535    HD1  TYR 150           HD1      TYR 150 125.913  -3.333  -1.630
  536    HD2  TYR 150           HD2      TYR 150 124.068  -7.110  -2.283
  537    HE1  TYR 150           HE1      TYR 150 124.027  -2.650  -0.212
  538    HE2  TYR 150           HE2      TYR 150 122.174  -6.437  -0.867
  539    HH   TYR 150           HH       TYR 150 121.644  -4.866   0.874
  540    H    ASP 151           H        ASP 151 128.775  -7.739  -2.347
  541    HA   ASP 151           HA       ASP 151 127.804  -8.747   0.135
  542   1HB   ASP 151          2HB       ASP 151 130.169  -9.815  -1.410
  543   2HB   ASP 151          1HB       ASP 151 129.106 -10.696  -0.317
  544    H    GLU 152           H        GLU 152 131.053  -7.785  -0.955
  545    HA   GLU 152           HA       GLU 152 132.268  -8.007   1.577
  546   1HB   GLU 152          2HB       GLU 152 133.176  -6.184  -0.647
  547   2HB   GLU 152          1HB       GLU 152 134.161  -6.932   0.604
  548   1HG   GLU 152          2HG       GLU 152 133.567  -9.153  -0.384
  549   2HG   GLU 152          1HG       GLU 152 132.816  -8.281  -1.719
  550    H    PHE 153           H        PHE 153 130.809  -5.243  -0.111
  551    HA   PHE 153           HA       PHE 153 131.558  -3.338   1.860
  552   1HB   PHE 153          2HB       PHE 153 130.267  -3.277  -0.651
  553   2HB   PHE 153          1HB       PHE 153 129.163  -2.529   0.496
  554    HD1  PHE 153           HD1      PHE 153 131.504  -1.745  -1.814
  555    HD2  PHE 153           HD2      PHE 153 130.654  -1.013   2.291
  556    HE1  PHE 153           HE1      PHE 153 132.817   0.334  -1.916
  557    HE2  PHE 153           HE2      PHE 153 131.963   1.067   2.196
  558    HZ   PHE 153           HZ       PHE 153 133.047   1.742   0.089
  559    H    LEU 154           H        LEU 154 128.952  -5.608   1.604
  560    HA   LEU 154           HA       LEU 154 127.082  -4.419   3.315
  561   1HB   LEU 154          2HB       LEU 154 127.499  -6.983   2.087
  562   2HB   LEU 154          1HB       LEU 154 127.003  -7.211   3.751
  563    HG   LEU 154           HG       LEU 154 124.958  -6.022   3.397
  564   1HD1  LEU 154          1HD1      LEU 154 126.388  -4.732   1.334
  565   2HD1  LEU 154          2HD1      LEU 154 124.755  -4.394   1.906
  566   3HD1  LEU 154          3HD1      LEU 154 125.008  -5.534   0.586
  567   1HD2  LEU 154          1HD2      LEU 154 124.801  -8.295   2.741
  568   2HD2  LEU 154          2HD2      LEU 154 125.587  -7.975   1.195
  569   3HD2  LEU 154          3HD2      LEU 154 123.966  -7.353   1.507
  570    H    GLU 155           H        GLU 155 129.948  -6.346   3.973
  571    HA   GLU 155           HA       GLU 155 129.449  -6.524   6.799
  572   1HB   GLU 155          2HB       GLU 155 131.602  -7.381   4.938
  573   2HB   GLU 155          1HB       GLU 155 132.048  -7.151   6.622
  574   1HG   GLU 155          2HG       GLU 155 129.764  -8.615   6.851
  575   2HG   GLU 155          1HG       GLU 155 130.460  -9.255   5.363
  576    H    PHE 156           H        PHE 156 131.154  -4.376   4.647
  577    HA   PHE 156           HA       PHE 156 132.851  -3.100   6.454
  578   1HB   PHE 156          2HB       PHE 156 132.290  -2.828   3.782
  579   2HB   PHE 156          1HB       PHE 156 131.656  -1.324   4.442
  580    HD1  PHE 156           HD1      PHE 156 134.109  -1.937   2.565
  581    HD2  PHE 156           HD2      PHE 156 133.681  -1.067   6.709
  582    HE1  PHE 156           HE1      PHE 156 136.382  -1.000   2.600
  583    HE2  PHE 156           HE2      PHE 156 135.953  -0.127   6.750
  584    HZ   PHE 156           HZ       PHE 156 137.307  -0.092   4.693
  585    H    MET 157           H        MET 157 129.436  -3.013   6.262
  586    HA   MET 157           HA       MET 157 129.382  -0.643   8.009
  587   1HB   MET 157          2HB       MET 157 127.944  -1.145   5.670
  588   2HB   MET 157          1HB       MET 157 126.790  -1.442   6.964
  589   1HG   MET 157          2HG       MET 157 126.660   0.725   7.523
  590   2HG   MET 157          1HG       MET 157 128.380   1.005   7.263
  591   1HE   MET 157          1HE       MET 157 129.304   2.212   5.678
  592   2HE   MET 157          2HE       MET 157 128.648   2.793   4.147
  593   3HE   MET 157          3HE       MET 157 129.263   1.145   4.274
  594    H    LYS 158           H        LYS 158 129.738  -3.654   8.525
  595    HA   LYS 158           HA       LYS 158 127.414  -4.442   9.986
  596   1HB   LYS 158          2HB       LYS 158 129.479  -5.802   8.901
  597   2HB   LYS 158          1HB       LYS 158 129.978  -5.775  10.587
  598   1HG   LYS 158          2HG       LYS 158 127.176  -6.530  10.082
  599   2HG   LYS 158          1HG       LYS 158 128.404  -7.669   9.525
  600   1HD   LYS 158          2HD       LYS 158 129.417  -7.517  11.831
  601   2HD   LYS 158          1HD       LYS 158 127.968  -6.638  12.321
  602   1HE   LYS 158          2HE       LYS 158 128.129  -9.455  11.264
  603   2HE   LYS 158          1HE       LYS 158 127.687  -8.949  12.894
  604   1HZ   LYS 158          1HZ       LYS 158 126.136  -8.643  10.396
  605   2HZ   LYS 158          2HZ       LYS 158 125.791  -7.719  11.770
  606   3HZ   LYS 158          3HZ       LYS 158 125.676  -9.404  11.835
  607    H    GLY 159           H        GLY 159 129.109  -1.934  10.796
  608   1HA   GLY 159          2HA       GLY 159 128.628  -1.132  13.082
  609   2HA   GLY 159          1HA       GLY 159 129.229  -2.675  13.654
  610    H    VAL 160           H        VAL 160 131.316  -2.102  11.277
  611    HA   VAL 160           HA       VAL 160 133.520  -1.594  12.803
  612    HB   VAL 160           HB       VAL 160 134.652  -0.794  10.776
  613   1HG1  VAL 160          1HG1      VAL 160 132.856  -3.184  10.604
  614   2HG1  VAL 160          2HG1      VAL 160 134.597  -3.114  10.888
  615   3HG1  VAL 160          3HG1      VAL 160 133.951  -2.773   9.282
  616   1HG2  VAL 160          1HG2      VAL 160 131.869  -0.748   9.619
  617   2HG2  VAL 160          2HG2      VAL 160 133.346  -0.654   8.660
  618   3HG2  VAL 160          3HG2      VAL 160 132.967   0.619   9.819
  619    H    GLU 161           H        GLU 161 131.422   0.808  11.258
  620    HA   GLU 161           HA       GLU 161 132.778   2.898  12.833
  621   1HB   GLU 161          2HB       GLU 161 131.936   4.491  11.094
  622   2HB   GLU 161          1HB       GLU 161 133.116   3.332  10.500
  623   1HG   GLU 161          2HG       GLU 161 131.636   2.310   9.140
  624   2HG   GLU 161          1HG       GLU 161 130.284   2.559  10.242
  Start of MODEL    6
    1   1H    MET  81          1HT       MET  81  88.174 -11.446  13.868
    2   2H    MET  81          2HT       MET  81  89.179 -10.198  14.485
    3   3H    MET  81          3HT       MET  81  89.855 -11.719  14.066
    4    HA   MET  81           HA       MET  81  89.005 -11.272  11.768
    5   1HB   MET  81          2HB       MET  81  88.395  -8.781  13.225
    6   2HB   MET  81          1HB       MET  81  89.173  -8.551  11.666
    7   1HG   MET  81          2HG       MET  81  87.004 -10.483  11.565
    8   2HG   MET  81          1HG       MET  81  86.482  -8.891  12.111
    9   1HE   MET  81          1HE       MET  81  85.088  -8.749   8.868
   10   2HE   MET  81          2HE       MET  81  85.578  -7.184   9.515
   11   3HE   MET  81          3HE       MET  81  85.024  -8.456  10.605
   12    H    VAL  82           H        VAL  82  91.122  -9.811  14.136
   13    HA   VAL  82           HA       VAL  82  93.383  -9.528  14.175
   14    HB   VAL  82           HB       VAL  82  93.499 -10.856  11.468
   15   1HG1  VAL  82          1HG1      VAL  82  95.553 -10.863  13.663
   16   2HG1  VAL  82          2HG1      VAL  82  95.513  -9.637  12.395
   17   3HG1  VAL  82          3HG1      VAL  82  95.754 -11.333  11.975
   18   1HG2  VAL  82          1HG2      VAL  82  92.335 -12.427  12.755
   19   2HG2  VAL  82          2HG2      VAL  82  93.255 -12.050  14.211
   20   3HG2  VAL  82          3HG2      VAL  82  94.021 -12.926  12.886
   21    H    ARG  83           H        ARG  83  92.517  -9.221  10.723
   22    HA   ARG  83           HA       ARG  83  92.694  -7.487   9.259
   23   1HB   ARG  83          2HB       ARG  83  91.638  -6.324  11.413
   24   2HB   ARG  83          1HB       ARG  83  93.185  -5.489  11.411
   25   1HG   ARG  83          2HG       ARG  83  92.334  -4.067   9.943
   26   2HG   ARG  83          1HG       ARG  83  92.297  -5.381   8.768
   27   1HD   ARG  83          2HD       ARG  83  90.060  -5.388  10.663
   28   2HD   ARG  83          1HD       ARG  83  90.122  -3.969   9.618
   29    HE   ARG  83           HE       ARG  83  90.449  -6.428   8.185
   30   1HH1  ARG  83          1HH1      ARG  83  88.105  -4.231   9.547
   31   2HH1  ARG  83          2HH1      ARG  83  86.838  -4.716   8.470
   32   1HH2  ARG  83          1HH2      ARG  83  88.785  -7.066   6.766
   33   2HH2  ARG  83          2HH2      ARG  83  87.224  -6.325   6.891
   34    H    CYS  84           H        CYS  84  94.567  -7.883   8.218
   35    HA   CYS  84           HA       CYS  84  97.027  -6.750   9.382
   36   1HB   CYS  84          2HB       CYS  84  96.509  -9.297   7.938
   37   2HB   CYS  84          1HB       CYS  84  98.032  -8.480   7.601
   38    HG   CYS  84           HG       CYS  84  98.799  -9.702   9.586
   39    H    MET  85           H        MET  85  97.279  -4.817   8.431
   40    HA   MET  85           HA       MET  85  96.652  -4.488   5.604
   41   1HB   MET  85          2HB       MET  85  97.091  -2.671   7.909
   42   2HB   MET  85          1HB       MET  85  97.546  -2.060   6.325
   43   1HG   MET  85          2HG       MET  85  95.211  -2.766   5.578
   44   2HG   MET  85          1HG       MET  85  94.844  -2.912   7.296
   45   1HE   MET  85          1HE       MET  85  92.939  -0.307   5.851
   46   2HE   MET  85          2HE       MET  85  93.079   0.074   7.567
   47   3HE   MET  85          3HE       MET  85  93.014  -1.607   7.038
   48    H    LYS  86           H        LYS  86  98.247  -5.458   4.440
   49    HA   LYS  86           HA       LYS  86 100.268  -5.762   3.447
   50   1HB   LYS  86          2HB       LYS  86  99.905  -3.062   3.633
   51   2HB   LYS  86          1HB       LYS  86 101.457  -3.258   4.438
   52   1HG   LYS  86          2HG       LYS  86 102.149  -2.952   2.290
   53   2HG   LYS  86          1HG       LYS  86 102.004  -4.711   2.317
   54   1HD   LYS  86          2HD       LYS  86  99.762  -2.913   1.431
   55   2HD   LYS  86          1HD       LYS  86 100.991  -3.517   0.318
   56   1HE   LYS  86          2HE       LYS  86 100.394  -5.831   1.024
   57   2HE   LYS  86          1HE       LYS  86  99.073  -5.151   1.974
   58   1HZ   LYS  86          1HZ       LYS  86  98.561  -4.044  -0.368
   59   2HZ   LYS  86          2HZ       LYS  86  97.951  -5.559   0.074
   60   3HZ   LYS  86          3HZ       LYS  86  99.322  -5.454  -0.912
   61    H    ASP  87           H        ASP  87 102.842  -5.085   4.085
   62    HA   ASP  87           HA       ASP  87 103.270  -6.713   6.466
   63   1HB   ASP  87          2HB       ASP  87 105.530  -7.003   5.662
   64   2HB   ASP  87          1HB       ASP  87 104.423  -7.257   4.318
   65    H    ASP  88           H        ASP  88 105.892  -5.770   7.074
   66    HA   ASP  88           HA       ASP  88 105.407  -3.897   9.035
   67   1HB   ASP  88          2HB       ASP  88 107.886  -3.476   8.988
   68   2HB   ASP  88          1HB       ASP  88 107.434  -5.174   9.084
   69    H    SER  89           H        SER  89 106.736  -1.712   9.084
   70    HA   SER  89           HA       SER  89 105.892  -0.179   6.715
   71   1HB   SER  89          2HB       SER  89 105.711   1.769   8.257
   72   2HB   SER  89          1HB       SER  89 104.615   0.454   8.677
   73    HG   SER  89           HG       SER  89 105.854  -0.051  10.397
   74    H    LYS  90           H        LYS  90 108.489  -0.817   8.959
   75    HA   LYS  90           HA       LYS  90 110.186   1.170   7.629
   76   1HB   LYS  90          2HB       LYS  90 111.801   0.593   9.492
   77   2HB   LYS  90          1HB       LYS  90 110.309   1.380   9.986
   78   1HG   LYS  90          2HG       LYS  90 109.523  -0.467  11.058
   79   2HG   LYS  90          1HG       LYS  90 110.374  -1.586   9.992
   80   1HD   LYS  90          2HD       LYS  90 112.071  -1.741  11.425
   81   2HD   LYS  90          1HD       LYS  90 112.265   0.013  11.452
   82   1HE   LYS  90          2HE       LYS  90 110.584   0.209  13.178
   83   2HE   LYS  90          1HE       LYS  90 110.253  -1.521  13.094
   84   1HZ   LYS  90          1HZ       LYS  90 112.787  -1.677  13.628
   85   2HZ   LYS  90          2HZ       LYS  90 111.665  -1.426  14.870
   86   3HZ   LYS  90          3HZ       LYS  90 112.555  -0.123  14.259
   87    H    GLY  91           H        GLY  91 111.857   0.620   6.347
   88   1HA   GLY  91          2HA       GLY  91 112.491  -2.257   6.115
   89   2HA   GLY  91          1HA       GLY  91 112.331  -1.216   4.709
   90    H    LYS  92           H        LYS  92 113.862  -0.117   7.649
   91    HA   LYS  92           HA       LYS  92 116.300   0.407   6.195
   92   1HB   LYS  92          2HB       LYS  92 115.411   0.978   9.019
   93   2HB   LYS  92          1HB       LYS  92 117.035   1.340   8.449
   94   1HG   LYS  92          2HG       LYS  92 116.369   3.173   7.367
   95   2HG   LYS  92          1HG       LYS  92 114.946   2.374   6.699
   96   1HD   LYS  92          2HD       LYS  92 113.604   3.036   8.410
   97   2HD   LYS  92          1HD       LYS  92 114.907   2.973   9.599
   98   1HE   LYS  92          2HE       LYS  92 114.781   5.072   7.450
   99   2HE   LYS  92          1HE       LYS  92 113.986   5.273   9.010
  100   1HZ   LYS  92          1HZ       LYS  92 116.478   6.043   8.533
  101   2HZ   LYS  92          2HZ       LYS  92 116.779   4.476   9.093
  102   3HZ   LYS  92          3HZ       LYS  92 115.937   5.573  10.066
  103    H    THR  93           H        THR  93 116.277  -2.138   5.974
  104    HA   THR  93           HA       THR  93 117.902  -3.252   8.164
  105    HB   THR  93           HB       THR  93 117.071  -5.412   7.639
  106    HG1  THR  93           HG1      THR  93 115.792  -4.323   5.358
  107   1HG2  THR  93          1HG2      THR  93 114.458  -4.525   7.092
  108   2HG2  THR  93          2HG2      THR  93 115.207  -3.322   8.142
  109   3HG2  THR  93          3HG2      THR  93 115.148  -5.012   8.641
  110    H    GLU  94           H        GLU  94 118.580  -5.561   6.374
  111    HA   GLU  94           HA       GLU  94 121.010  -4.518   5.324
  112   1HB   GLU  94          2HB       GLU  94 119.837  -7.097   5.828
  113   2HB   GLU  94          1HB       GLU  94 120.569  -7.074   4.230
  114   1HG   GLU  94          2HG       GLU  94 122.689  -6.713   5.057
  115   2HG   GLU  94          1HG       GLU  94 122.096  -6.036   6.573
  116    H    GLU  95           H        GLU  95 117.944  -4.368   4.102
  117    HA   GLU  95           HA       GLU  95 118.699  -4.730   1.309
  118   1HB   GLU  95          2HB       GLU  95 116.367  -5.243   2.641
  119   2HB   GLU  95          1HB       GLU  95 116.012  -3.685   1.908
  120   1HG   GLU  95          2HG       GLU  95 116.981  -4.845  -0.241
  121   2HG   GLU  95          1HG       GLU  95 116.531  -6.313   0.627
  122    H    GLU  96           H        GLU  96 118.047  -2.202   3.619
  123    HA   GLU  96           HA       GLU  96 117.722  -0.101   1.717
  124   1HB   GLU  96          2HB       GLU  96 117.812   1.393   3.592
  125   2HB   GLU  96          1HB       GLU  96 116.884  -0.021   4.070
  126   1HG   GLU  96          2HG       GLU  96 118.192  -0.223   5.837
  127   2HG   GLU  96          1HG       GLU  96 119.537  -0.587   4.758
  128    H    LEU  97           H        LEU  97 120.448  -1.653   3.204
  129    HA   LEU  97           HA       LEU  97 122.407   0.299   2.978
  130   1HB   LEU  97          2HB       LEU  97 122.355  -2.647   3.096
  131   2HB   LEU  97          1HB       LEU  97 123.807  -1.952   2.402
  132    HG   LEU  97           HG       LEU  97 122.812  -0.915   5.023
  133   1HD1  LEU  97          1HD1      LEU  97 124.677  -3.247   4.928
  134   2HD1  LEU  97          2HD1      LEU  97 122.933  -3.504   4.948
  135   3HD1  LEU  97          3HD1      LEU  97 123.712  -2.637   6.272
  136   1HD2  LEU  97          1HD2      LEU  97 125.642  -1.407   4.178
  137   2HD2  LEU  97          2HD2      LEU  97 125.010  -0.236   5.335
  138   3HD2  LEU  97          3HD2      LEU  97 124.764   0.010   3.606
  139    H    SER  98           H        SER  98 120.795  -1.486   0.499
  140    HA   SER  98           HA       SER  98 122.716  -1.372  -1.541
  141   1HB   SER  98          2HB       SER  98 119.792  -1.087  -2.141
  142   2HB   SER  98          1HB       SER  98 121.017  -2.029  -2.991
  143    HG   SER  98           HG       SER  98 119.372  -2.788  -1.002
  144    H    ASP  99           H        ASP  99 120.346   0.973  -0.422
  145    HA   ASP  99           HA       ASP  99 120.609   2.809  -2.545
  146   1HB   ASP  99          2HB       ASP  99 119.014   2.622  -0.321
  147   2HB   ASP  99          1HB       ASP  99 120.051   3.984   0.090
  148    H    LEU 100           H        LEU 100 122.385   2.358   0.455
  149    HA   LEU 100           HA       LEU 100 123.928   4.762   0.168
  150   1HB   LEU 100          2HB       LEU 100 124.452   2.353   1.909
  151   2HB   LEU 100          1HB       LEU 100 125.210   3.927   2.065
  152    HG   LEU 100           HG       LEU 100 122.239   3.775   2.254
  153   1HD1  LEU 100          1HD1      LEU 100 124.147   2.537   4.143
  154   2HD1  LEU 100          2HD1      LEU 100 122.459   2.148   3.812
  155   3HD1  LEU 100          3HD1      LEU 100 122.862   3.525   4.839
  156   1HD2  LEU 100          1HD2      LEU 100 123.289   5.943   2.298
  157   2HD2  LEU 100          2HD2      LEU 100 124.381   5.428   3.585
  158   3HD2  LEU 100          3HD2      LEU 100 122.652   5.574   3.900
  159    H    PHE 101           H        PHE 101 124.274   1.410  -0.751
  160    HA   PHE 101           HA       PHE 101 127.027   1.343  -1.248
  161   1HB   PHE 101          2HB       PHE 101 125.612  -0.668  -1.204
  162   2HB   PHE 101          1HB       PHE 101 124.825  -0.149  -2.690
  163    HD1  PHE 101           HD1      PHE 101 127.650  -1.832  -1.244
  164    HD2  PHE 101           HD2      PHE 101 126.172  -0.011  -4.796
  165    HE1  PHE 101           HE1      PHE 101 129.371  -3.005  -2.556
  166    HE2  PHE 101           HE2      PHE 101 127.890  -1.182  -6.115
  167    HZ   PHE 101           HZ       PHE 101 129.490  -2.681  -4.995
  168    H    ARG 102           H        ARG 102 124.325   2.286  -3.344
  169    HA   ARG 102           HA       ARG 102 125.712   2.632  -5.725
  170   1HB   ARG 102          2HB       ARG 102 123.391   4.270  -4.689
  171   2HB   ARG 102          1HB       ARG 102 123.911   4.178  -6.365
  172   1HG   ARG 102          2HG       ARG 102 123.205   1.951  -6.578
  173   2HG   ARG 102          1HG       ARG 102 123.071   1.742  -4.830
  174   1HD   ARG 102          2HD       ARG 102 121.270   3.532  -4.908
  175   2HD   ARG 102          1HD       ARG 102 121.294   3.337  -6.659
  176    HE   ARG 102           HE       ARG 102 120.966   0.843  -5.320
  177   1HH1  ARG 102          1HH1      ARG 102 119.260   3.717  -6.328
  178   2HH1  ARG 102          2HH1      ARG 102 117.722   2.925  -6.409
  179   1HH2  ARG 102          1HH2      ARG 102 118.945  -0.200  -5.430
  180   2HH2  ARG 102          2HH2      ARG 102 117.543   0.702  -5.899
  181    H    MET 103           H        MET 103 125.357   4.824  -2.983
  182    HA   MET 103           HA       MET 103 126.402   7.144  -4.096
  183   1HB   MET 103          2HB       MET 103 126.099   6.057  -1.368
  184   2HB   MET 103          1HB       MET 103 127.321   7.308  -1.548
  185   1HG   MET 103          2HG       MET 103 124.536   7.673  -2.588
  186   2HG   MET 103          1HG       MET 103 124.955   8.016  -0.910
  187   1HE   MET 103          1HE       MET 103 124.328  10.263  -0.787
  188   2HE   MET 103          2HE       MET 103 123.806  10.641  -2.428
  189   3HE   MET 103          3HE       MET 103 125.022  11.644  -1.636
  190    H    PHE 104           H        PHE 104 127.997   4.211  -3.184
  191    HA   PHE 104           HA       PHE 104 130.637   5.390  -3.146
  192   1HB   PHE 104          2HB       PHE 104 129.495   2.682  -2.680
  193   2HB   PHE 104          1HB       PHE 104 131.178   2.775  -3.186
  194    HD1  PHE 104           HD1      PHE 104 132.304   4.993  -1.849
  195    HD2  PHE 104           HD2      PHE 104 129.343   2.286  -0.430
  196    HE1  PHE 104           HE1      PHE 104 132.976   5.478   0.467
  197    HE2  PHE 104           HE2      PHE 104 130.008   2.768   1.888
  198    HZ   PHE 104           HZ       PHE 104 131.827   4.366   2.341
  199    H    ASP 105           H        ASP 105 128.513   3.976  -5.466
  200    HA   ASP 105           HA       ASP 105 130.695   3.569  -7.377
  201   1HB   ASP 105          2HB       ASP 105 128.325   2.161  -6.869
  202   2HB   ASP 105          1HB       ASP 105 128.050   2.975  -8.405
  203    H    LYS 106           H        LYS 106 130.932   4.783  -9.199
  204    HA   LYS 106           HA       LYS 106 129.165   7.122  -9.439
  205   1HB   LYS 106          2HB       LYS 106 131.954   6.804 -10.549
  206   2HB   LYS 106          1HB       LYS 106 131.001   8.281 -10.487
  207   1HG   LYS 106          2HG       LYS 106 132.025   6.768  -8.093
  208   2HG   LYS 106          1HG       LYS 106 132.751   8.225  -8.776
  209   1HD   LYS 106          2HD       LYS 106 129.906   8.093  -7.794
  210   2HD   LYS 106          1HD       LYS 106 131.261   8.588  -6.777
  211   1HE   LYS 106          2HE       LYS 106 131.763  10.280  -8.659
  212   2HE   LYS 106          1HE       LYS 106 130.114   9.950  -9.190
  213   1HZ   LYS 106          1HZ       LYS 106 130.536  11.884  -7.576
  214   2HZ   LYS 106          2HZ       LYS 106 130.658  10.686  -6.388
  215   3HZ   LYS 106          3HZ       LYS 106 129.227  10.855  -7.274
  216    H    ASN 107           H        ASN 107 130.683   4.505 -11.238
  217    HA   ASN 107           HA       ASN 107 129.244   5.322 -13.658
  218   1HB   ASN 107          2HB       ASN 107 130.684   3.725 -14.839
  219   2HB   ASN 107          1HB       ASN 107 131.640   4.882 -13.916
  220   1HD2  ASN 107          1HD2      ASN 107 132.813   2.603 -14.722
  221   2HD2  ASN 107          2HD2      ASN 107 133.081   1.547 -13.382
  222    H    ALA 108           H        ALA 108 128.473   3.587 -11.062
  223    HA   ALA 108           HA       ALA 108 127.161   1.776 -10.591
  224   1HB   ALA 108          1HB       ALA 108 125.950   3.179 -12.891
  225   2HB   ALA 108          2HB       ALA 108 125.293   2.844 -11.289
  226   3HB   ALA 108          3HB       ALA 108 125.307   1.578 -12.517
  227    H    ASP 109           H        ASP 109 129.033   0.340 -10.989
  228    HA   ASP 109           HA       ASP 109 128.543  -1.411 -13.308
  229   1HB   ASP 109          2HB       ASP 109 130.966  -1.974 -13.232
  230   2HB   ASP 109          1HB       ASP 109 130.657  -0.283 -13.613
  231    H    GLY 110           H        GLY 110 128.314  -1.217 -10.005
  232   1HA   GLY 110          2HA       GLY 110 127.533  -2.991  -8.657
  233   2HA   GLY 110          1HA       GLY 110 128.230  -4.132  -9.797
  234    H    TYR 111           H        TYR 111 130.729  -2.293  -9.661
  235    HA   TYR 111           HA       TYR 111 131.721  -3.168  -7.040
  236   1HB   TYR 111          2HB       TYR 111 133.190  -3.532  -9.662
  237   2HB   TYR 111          1HB       TYR 111 133.824  -3.918  -8.064
  238    HD1  TYR 111           HD1      TYR 111 133.523  -6.051  -7.179
  239    HD2  TYR 111           HD2      TYR 111 131.047  -4.776 -10.396
  240    HE1  TYR 111           HE1      TYR 111 132.587  -8.319  -7.349
  241    HE2  TYR 111           HE2      TYR 111 130.104  -7.040 -10.574
  242    HH   TYR 111           HH       TYR 111 130.484  -9.384  -8.202
  243    H    ILE 112           H        ILE 112 133.219  -1.826  -6.086
  244    HA   ILE 112           HA       ILE 112 133.646   0.747  -7.451
  245    HB   ILE 112           HB       ILE 112 133.809   0.218  -4.485
  246   1HG1  ILE 112          2HG1      ILE 112 131.590   1.770  -4.844
  247   2HG1  ILE 112          1HG1      ILE 112 131.510   0.726  -6.260
  248   1HG2  ILE 112          1HG2      ILE 112 134.273   2.407  -4.202
  249   2HG2  ILE 112          2HG2      ILE 112 133.270   2.909  -5.563
  250   3HG2  ILE 112          3HG2      ILE 112 134.887   2.269  -5.850
  251   1HD1  ILE 112          1HD1      ILE 112 130.560   0.142  -3.754
  252   2HD1  ILE 112          2HD1      ILE 112 132.088  -0.738  -3.821
  253   3HD1  ILE 112          3HD1      ILE 112 130.855  -1.017  -5.051
  254    H    ASP 113           H        ASP 113 135.653   1.517  -7.775
  255    HA   ASP 113           HA       ASP 113 137.892  -0.175  -6.889
  256   1HB   ASP 113          2HB       ASP 113 137.295   0.463  -9.424
  257   2HB   ASP 113          1HB       ASP 113 138.291   1.859  -9.021
  258    H    LEU 114           H        LEU 114 140.033   1.289  -6.976
  259    HA   LEU 114           HA       LEU 114 139.803   3.042  -4.759
  260   1HB   LEU 114          2HB       LEU 114 142.072   2.406  -6.630
  261   2HB   LEU 114          1HB       LEU 114 142.237   3.528  -5.293
  262    HG   LEU 114           HG       LEU 114 141.126   1.149  -4.230
  263   1HD1  LEU 114          1HD1      LEU 114 143.161   0.690  -6.339
  264   2HD1  LEU 114          2HD1      LEU 114 141.824  -0.331  -5.810
  265   3HD1  LEU 114          3HD1      LEU 114 143.298  -0.236  -4.845
  266   1HD2  LEU 114          1HD2      LEU 114 142.487   2.608  -2.936
  267   2HD2  LEU 114          2HD2      LEU 114 143.840   2.441  -4.055
  268   3HD2  LEU 114          3HD2      LEU 114 143.344   1.072  -3.060
  269    H    GLU 115           H        GLU 115 139.869   3.501  -8.213
  270    HA   GLU 115           HA       GLU 115 140.507   6.267  -8.201
  271   1HB   GLU 115          2HB       GLU 115 139.447   4.322 -10.185
  272   2HB   GLU 115          1HB       GLU 115 139.194   6.031 -10.515
  273   1HG   GLU 115          2HG       GLU 115 141.185   5.422 -11.612
  274   2HG   GLU 115          1HG       GLU 115 141.662   6.352 -10.193
  275    H    GLU 116           H        GLU 116 137.395   4.576  -8.654
  276    HA   GLU 116           HA       GLU 116 135.785   6.857  -8.715
  277   1HB   GLU 116          2HB       GLU 116 135.373   3.967  -8.325
  278   2HB   GLU 116          1HB       GLU 116 134.127   4.986  -7.616
  279   1HG   GLU 116          2HG       GLU 116 133.292   5.568  -9.609
  280   2HG   GLU 116          1HG       GLU 116 134.885   5.713 -10.351
  281    H    LEU 117           H        LEU 117 136.571   4.728  -5.975
  282    HA   LEU 117           HA       LEU 117 135.121   5.954  -3.984
  283   1HB   LEU 117          2HB       LEU 117 136.359   3.881  -3.655
  284   2HB   LEU 117          1HB       LEU 117 137.879   4.746  -3.783
  285    HG   LEU 117           HG       LEU 117 137.434   5.931  -1.714
  286   1HD1  LEU 117          1HD1      LEU 117 135.472   5.528  -0.382
  287   2HD1  LEU 117          2HD1      LEU 117 134.868   4.360  -1.557
  288   3HD1  LEU 117          3HD1      LEU 117 134.979   6.066  -1.989
  289   1HD2  LEU 117          1HD2      LEU 117 138.157   3.346  -1.910
  290   2HD2  LEU 117          2HD2      LEU 117 136.738   3.193  -0.874
  291   3HD2  LEU 117          3HD2      LEU 117 138.079   4.228  -0.385
  292    H    LYS 118           H        LYS 118 138.016   7.079  -5.549
  293    HA   LYS 118           HA       LYS 118 138.844   8.960  -3.617
  294   1HB   LYS 118          2HB       LYS 118 140.166   8.117  -5.612
  295   2HB   LYS 118          1HB       LYS 118 139.220   9.221  -6.599
  296   1HG   LYS 118          2HG       LYS 118 140.340  10.570  -4.306
  297   2HG   LYS 118          1HG       LYS 118 141.591   9.773  -5.263
  298   1HD   LYS 118          2HD       LYS 118 140.186  10.886  -7.247
  299   2HD   LYS 118          1HD       LYS 118 139.808  12.034  -5.961
  300   1HE   LYS 118          2HE       LYS 118 142.351  12.054  -5.534
  301   2HE   LYS 118          1HE       LYS 118 142.475  11.327  -7.135
  302   1HZ   LYS 118          1HZ       LYS 118 141.722  13.217  -8.154
  303   2HZ   LYS 118          2HZ       LYS 118 142.560  13.895  -6.850
  304   3HZ   LYS 118          3HZ       LYS 118 140.874  13.766  -6.795
  305    H    ILE 119           H        ILE 119 136.435   9.054  -6.149
  306    HA   ILE 119           HA       ILE 119 136.039  11.890  -6.051
  307    HB   ILE 119           HB       ILE 119 134.139   9.801  -7.121
  308   1HG1  ILE 119          2HG1      ILE 119 135.825  11.299  -9.014
  309   2HG1  ILE 119          1HG1      ILE 119 136.708  10.171  -7.991
  310   1HG2  ILE 119          1HG2      ILE 119 132.878  11.695  -7.145
  311   2HG2  ILE 119          2HG2      ILE 119 133.725  11.909  -8.677
  312   3HG2  ILE 119          3HG2      ILE 119 134.280  12.761  -7.237
  313   1HD1  ILE 119          1HD1      ILE 119 134.723   8.568  -8.749
  314   2HD1  ILE 119          2HD1      ILE 119 136.206   8.767  -9.682
  315   3HD1  ILE 119          3HD1      ILE 119 134.752   9.655 -10.137
  316    H    MET 120           H        MET 120 134.349   9.071  -4.719
  317    HA   MET 120           HA       MET 120 132.148  10.306  -3.599
  318   1HB   MET 120          2HB       MET 120 133.039   7.778  -3.629
  319   2HB   MET 120          1HB       MET 120 133.466   8.199  -1.976
  320   1HG   MET 120          2HG       MET 120 130.716   8.482  -3.162
  321   2HG   MET 120          1HG       MET 120 131.258   7.121  -2.185
  322   1HE   MET 120          1HE       MET 120 132.948   9.197   0.396
  323   2HE   MET 120          2HE       MET 120 132.592   7.547  -0.112
  324   3HE   MET 120          3HE       MET 120 131.704   8.266   1.231
  325    H    LEU 121           H        LEU 121 135.447  10.144  -2.389
  326    HA   LEU 121           HA       LEU 121 134.763  11.373   0.133
  327   1HB   LEU 121          2HB       LEU 121 137.281  10.430  -1.169
  328   2HB   LEU 121          1HB       LEU 121 137.392  11.553   0.174
  329    HG   LEU 121           HG       LEU 121 137.653   9.341   1.038
  330   1HD1  LEU 121          1HD1      LEU 121 134.837   9.731   1.814
  331   2HD1  LEU 121          2HD1      LEU 121 135.907  11.115   2.041
  332   3HD1  LEU 121          3HD1      LEU 121 136.282   9.573   2.812
  333   1HD2  LEU 121          1HD2      LEU 121 136.721   7.587   0.052
  334   2HD2  LEU 121          2HD2      LEU 121 135.782   8.656  -0.988
  335   3HD2  LEU 121          3HD2      LEU 121 135.127   8.139   0.565
  336    H    GLN 122           H        GLN 122 135.975  12.372  -2.988
  337    HA   GLN 122           HA       GLN 122 136.885  14.944  -2.213
  338   1HB   GLN 122          2HB       GLN 122 136.124  13.698  -4.839
  339   2HB   GLN 122          1HB       GLN 122 136.510  15.409  -4.738
  340   1HG   GLN 122          2HG       GLN 122 138.528  13.897  -3.394
  341   2HG   GLN 122          1HG       GLN 122 138.276  13.245  -5.012
  342   1HE2  GLN 122          1HE2      GLN 122 138.022  15.071  -6.705
  343   2HE2  GLN 122          2HE2      GLN 122 139.224  16.311  -6.631
  344    H    ALA 123           H        ALA 123 133.764  13.626  -2.988
  345    HA   ALA 123           HA       ALA 123 132.384  15.972  -3.643
  346   1HB   ALA 123          1HB       ALA 123 131.066  14.192  -4.103
  347   2HB   ALA 123          2HB       ALA 123 130.440  14.533  -2.489
  348   3HB   ALA 123          3HB       ALA 123 131.645  13.266  -2.717
  349    H    THR 124           H        THR 124 133.309  14.610  -0.548
  350    HA   THR 124           HA       THR 124 131.652  16.354   1.008
  351    HB   THR 124           HB       THR 124 132.984  15.511   2.924
  352    HG1  THR 124           HG1      THR 124 134.619  14.040   2.552
  353   1HG2  THR 124          1HG2      THR 124 132.680  12.924   1.933
  354   2HG2  THR 124          2HG2      THR 124 131.425  13.885   1.150
  355   3HG2  THR 124          3HG2      THR 124 131.535  13.843   2.910
  356    H    GLY 125           H        GLY 125 132.765  17.738   2.762
  357   1HA   GLY 125          2HA       GLY 125 134.529  19.591   1.346
  358   2HA   GLY 125          1HA       GLY 125 133.643  19.928   2.825
  359    H    GLU 126           H        GLU 126 135.378  16.956   2.692
  360    HA   GLU 126           HA       GLU 126 137.343  18.066   4.572
  361   1HB   GLU 126          2HB       GLU 126 136.750  15.145   4.115
  362   2HB   GLU 126          1HB       GLU 126 137.586  15.877   5.478
  363   1HG   GLU 126          2HG       GLU 126 135.081  17.089   5.436
  364   2HG   GLU 126          1HG       GLU 126 134.776  15.388   5.088
  365    H    THR 127           H        THR 127 139.501  16.832   4.531
  366    HA   THR 127           HA       THR 127 140.343  16.470   1.735
  367    HB   THR 127           HB       THR 127 141.364  18.472   2.309
  368    HG1  THR 127           HG1      THR 127 143.477  17.980   2.325
  369   1HG2  THR 127          1HG2      THR 127 142.755  18.390   4.595
  370   2HG2  THR 127          2HG2      THR 127 141.372  17.389   5.034
  371   3HG2  THR 127          3HG2      THR 127 141.121  19.037   4.457
  372    H    ILE 128           H        ILE 128 140.815  14.405   1.379
  373    HA   ILE 128           HA       ILE 128 142.292  12.935   3.463
  374    HB   ILE 128           HB       ILE 128 140.270  11.704   1.589
  375   1HG1  ILE 128          2HG1      ILE 128 139.706  11.745   4.481
  376   2HG1  ILE 128          1HG1      ILE 128 139.647  13.323   3.704
  377   1HG2  ILE 128          1HG2      ILE 128 141.931  10.640   3.852
  378   2HG2  ILE 128          2HG2      ILE 128 141.836  10.062   2.189
  379   3HG2  ILE 128          3HG2      ILE 128 140.477   9.817   3.285
  380   1HD1  ILE 128          1HD1      ILE 128 138.224  11.113   2.357
  381   2HD1  ILE 128          2HD1      ILE 128 137.797  12.816   2.510
  382   3HD1  ILE 128          3HD1      ILE 128 137.541  11.718   3.866
  383    H    THR 129           H        THR 129 143.982  11.671   2.801
  384    HA   THR 129           HA       THR 129 144.975  12.173   0.126
  385    HB   THR 129           HB       THR 129 146.446  12.315   2.135
  386    HG1  THR 129           HG1      THR 129 147.320  10.260   0.403
  387   1HG2  THR 129          1HG2      THR 129 146.730  10.677   3.594
  388   2HG2  THR 129          2HG2      THR 129 147.023   9.499   2.316
  389   3HG2  THR 129          3HG2      THR 129 145.373   9.854   2.826
  390    H    GLU 130           H        GLU 130 146.015  10.305  -1.068
  391    HA   GLU 130           HA       GLU 130 144.030   8.377  -1.662
  392   1HB   GLU 130          2HB       GLU 130 145.849   9.331  -3.199
  393   2HB   GLU 130          1HB       GLU 130 146.923   8.153  -2.460
  394   1HG   GLU 130          2HG       GLU 130 144.448   6.945  -3.341
  395   2HG   GLU 130          1HG       GLU 130 145.291   7.762  -4.656
  396    H    ASP 131           H        ASP 131 146.671   8.419   0.563
  397    HA   ASP 131           HA       ASP 131 147.099   5.642   0.818
  398   1HB   ASP 131          2HB       ASP 131 148.368   7.804   1.785
  399   2HB   ASP 131          1HB       ASP 131 147.445   7.355   3.215
  400    H    ASP 132           H        ASP 132 145.267   7.864   2.926
  401    HA   ASP 132           HA       ASP 132 144.171   5.936   4.603
  402   1HB   ASP 132          2HB       ASP 132 143.199   8.668   3.778
  403   2HB   ASP 132          1HB       ASP 132 142.326   7.681   4.946
  404    H    ILE 133           H        ILE 133 143.075   7.107   1.472
  405    HA   ILE 133           HA       ILE 133 140.551   5.790   1.532
  406    HB   ILE 133           HB       ILE 133 142.104   6.647  -0.911
  407   1HG1  ILE 133          2HG1      ILE 133 139.982   8.290   0.447
  408   2HG1  ILE 133          1HG1      ILE 133 141.665   8.403   0.954
  409   1HG2  ILE 133          1HG2      ILE 133 139.165   6.167  -0.443
  410   2HG2  ILE 133          2HG2      ILE 133 140.250   5.193  -1.435
  411   3HG2  ILE 133          3HG2      ILE 133 139.857   6.843  -1.918
  412   1HD1  ILE 133          1HD1      ILE 133 142.007   9.876  -0.654
  413   2HD1  ILE 133          2HD1      ILE 133 140.357   9.663  -1.240
  414   3HD1  ILE 133          3HD1      ILE 133 141.649   8.629  -1.848
  415    H    GLU 134           H        GLU 134 143.777   4.862   0.569
  416    HA   GLU 134           HA       GLU 134 143.032   2.550  -0.916
  417   1HB   GLU 134          2HB       GLU 134 145.333   3.941  -0.653
  418   2HB   GLU 134          1HB       GLU 134 145.673   2.591   0.419
  419   1HG   GLU 134          2HG       GLU 134 144.913   1.120  -1.554
  420   2HG   GLU 134          1HG       GLU 134 145.153   2.574  -2.523
  421    H    GLU 135           H        GLU 135 144.274   3.001   2.389
  422    HA   GLU 135           HA       GLU 135 144.220   0.309   3.150
  423   1HB   GLU 135          2HB       GLU 135 144.205   1.165   5.473
  424   2HB   GLU 135          1HB       GLU 135 145.408   1.956   4.464
  425   1HG   GLU 135          2HG       GLU 135 144.044   3.909   4.258
  426   2HG   GLU 135          1HG       GLU 135 142.700   3.112   5.075
  427    H    LEU 136           H        LEU 136 141.694   2.715   3.003
  428    HA   LEU 136           HA       LEU 136 139.787   1.417   4.621
  429   1HB   LEU 136          2HB       LEU 136 139.893   3.817   3.427
  430   2HB   LEU 136          1HB       LEU 136 138.847   2.987   2.291
  431    HG   LEU 136           HG       LEU 136 138.120   2.724   5.147
  432   1HD1  LEU 136          1HD1      LEU 136 137.636   5.304   3.669
  433   2HD1  LEU 136          2HD1      LEU 136 138.842   5.095   4.938
  434   3HD1  LEU 136          3HD1      LEU 136 137.129   4.898   5.307
  435   1HD2  LEU 136          1HD2      LEU 136 135.885   3.409   3.874
  436   2HD2  LEU 136          2HD2      LEU 136 136.516   1.763   3.858
  437   3HD2  LEU 136          3HD2      LEU 136 136.815   2.833   2.489
  438    H    MET 137           H        MET 137 140.736   1.003   1.286
  439    HA   MET 137           HA       MET 137 138.475  -0.651   0.613
  440   1HB   MET 137          2HB       MET 137 141.049  -0.018  -0.832
  441   2HB   MET 137          1HB       MET 137 139.810  -1.078  -1.490
  442   1HG   MET 137          2HG       MET 137 139.435   1.818  -0.762
  443   2HG   MET 137          1HG       MET 137 139.655   1.183  -2.391
  444   1HE   MET 137          1HE       MET 137 137.951   0.366  -3.852
  445   2HE   MET 137          2HE       MET 137 136.359  -0.250  -3.411
  446   3HE   MET 137          3HE       MET 137 137.806  -1.162  -2.982
  447    H    LYS 138           H        LYS 138 141.876  -1.140   1.430
  448    HA   LYS 138           HA       LYS 138 142.044  -3.879   0.920
  449   1HB   LYS 138          2HB       LYS 138 143.936  -2.285   1.472
  450   2HB   LYS 138          1HB       LYS 138 143.475  -2.453   3.162
  451   1HG   LYS 138          2HG       LYS 138 144.991  -4.098   3.161
  452   2HG   LYS 138          1HG       LYS 138 143.690  -5.049   2.443
  453   1HD   LYS 138          2HD       LYS 138 144.755  -3.836   0.249
  454   2HD   LYS 138          1HD       LYS 138 146.186  -4.060   1.256
  455   1HE   LYS 138          2HE       LYS 138 144.233  -6.282   0.730
  456   2HE   LYS 138          1HE       LYS 138 145.580  -5.943  -0.357
  457   1HZ   LYS 138          1HZ       LYS 138 146.295  -6.151   2.438
  458   2HZ   LYS 138          2HZ       LYS 138 147.055  -6.802   1.074
  459   3HZ   LYS 138          3HZ       LYS 138 145.718  -7.586   1.752
  460    H    ASP 139           H        ASP 139 140.523  -2.159   3.517
  461    HA   ASP 139           HA       ASP 139 140.312  -4.533   5.183
  462   1HB   ASP 139          2HB       ASP 139 140.629  -2.053   5.966
  463   2HB   ASP 139          1HB       ASP 139 138.881  -1.965   5.765
  464    H    GLY 140           H        GLY 140 138.837  -3.832   2.456
  465   1HA   GLY 140          2HA       GLY 140 136.199  -4.747   3.423
  466   2HA   GLY 140          1HA       GLY 140 136.377  -3.610   2.095
  467    H    ASP 141           H        ASP 141 138.649  -4.965   0.911
  468    HA   ASP 141           HA       ASP 141 137.189  -6.929  -0.606
  469   1HB   ASP 141          2HB       ASP 141 139.802  -5.539  -0.842
  470   2HB   ASP 141          1HB       ASP 141 139.674  -7.118  -1.612
  471    H    LYS 142           H        LYS 142 136.823  -8.736   0.601
  472    HA   LYS 142           HA       LYS 142 138.813  -9.945   2.251
  473   1HB   LYS 142          2HB       LYS 142 136.174 -10.989   1.214
  474   2HB   LYS 142          1HB       LYS 142 137.184 -11.841   2.376
  475   1HG   LYS 142          2HG       LYS 142 136.029  -9.096   2.813
  476   2HG   LYS 142          1HG       LYS 142 135.310 -10.594   3.402
  477   1HD   LYS 142          2HD       LYS 142 138.107  -9.692   4.080
  478   2HD   LYS 142          1HD       LYS 142 136.697  -9.358   5.086
  479   1HE   LYS 142          2HE       LYS 142 136.951 -12.166   4.322
  480   2HE   LYS 142          1HE       LYS 142 138.309 -11.569   5.274
  481   1HZ   LYS 142          1HZ       LYS 142 137.039 -11.341   7.099
  482   2HZ   LYS 142          2HZ       LYS 142 136.048 -12.479   6.338
  483   3HZ   LYS 142          3HZ       LYS 142 135.674 -10.833   6.240
  484    H    ASN 143           H        ASN 143 137.832 -10.283  -1.074
  485    HA   ASN 143           HA       ASN 143 139.491 -12.668  -1.406
  486   1HB   ASN 143          2HB       ASN 143 138.555 -12.618  -3.759
  487   2HB   ASN 143          1HB       ASN 143 137.376 -12.869  -2.476
  488   1HD2  ASN 143          1HD2      ASN 143 135.724 -12.143  -3.844
  489   2HD2  ASN 143          2HD2      ASN 143 135.511 -10.463  -4.185
  490    H    ASN 144           H        ASN 144 140.071  -9.474  -1.317
  491    HA   ASN 144           HA       ASN 144 141.662  -8.080  -2.149
  492   1HB   ASN 144          2HB       ASN 144 142.912 -10.787  -2.501
  493   2HB   ASN 144          1HB       ASN 144 143.753  -9.339  -3.046
  494   1HD2  ASN 144          1HD2      ASN 144 142.809 -11.246  -0.365
  495   2HD2  ASN 144          2HD2      ASN 144 143.584 -10.309   0.861
  496    H    ASP 145           H        ASP 145 139.514  -9.123  -3.979
  497    HA   ASP 145           HA       ASP 145 140.545  -9.474  -6.570
  498   1HB   ASP 145          2HB       ASP 145 138.144  -9.856  -5.625
  499   2HB   ASP 145          1HB       ASP 145 137.889  -8.170  -6.066
  500    H    GLY 146           H        GLY 146 140.372  -6.685  -4.606
  501   1HA   GLY 146          2HA       GLY 146 141.468  -4.665  -5.167
  502   2HA   GLY 146          1HA       GLY 146 141.271  -5.057  -6.868
  503    H    ARG 147           H        ARG 147 138.352  -5.729  -5.621
  504    HA   ARG 147           HA       ARG 147 137.359  -2.984  -5.592
  505   1HB   ARG 147          2HB       ARG 147 136.276  -5.121  -7.437
  506   2HB   ARG 147          1HB       ARG 147 135.589  -3.517  -7.215
  507   1HG   ARG 147          2HG       ARG 147 138.191  -2.963  -7.869
  508   2HG   ARG 147          1HG       ARG 147 137.837  -4.385  -8.852
  509   1HD   ARG 147          2HD       ARG 147 135.610  -3.029  -9.334
  510   2HD   ARG 147          1HD       ARG 147 136.653  -1.661  -8.942
  511    HE   ARG 147           HE       ARG 147 138.073  -3.167 -10.747
  512   1HH1  ARG 147          1HH1      ARG 147 134.978  -1.556 -10.716
  513   2HH1  ARG 147          2HH1      ARG 147 134.981  -1.246 -12.420
  514   1HH2  ARG 147          1HH2      ARG 147 138.080  -2.760 -12.989
  515   2HH2  ARG 147          2HH2      ARG 147 136.742  -1.931 -13.710
  516    H    ILE 148           H        ILE 148 135.223  -2.780  -4.696
  517    HA   ILE 148           HA       ILE 148 134.542  -5.045  -2.944
  518    HB   ILE 148           HB       ILE 148 133.858  -2.130  -2.555
  519   1HG1  ILE 148          2HG1      ILE 148 135.921  -3.812  -1.115
  520   2HG1  ILE 148          1HG1      ILE 148 136.296  -2.636  -2.369
  521   1HG2  ILE 148          1HG2      ILE 148 133.543  -4.505  -0.724
  522   2HG2  ILE 148          2HG2      ILE 148 132.243  -3.623  -1.526
  523   3HG2  ILE 148          3HG2      ILE 148 133.217  -2.826  -0.291
  524   1HD1  ILE 148          1HD1      ILE 148 135.011  -2.036   0.284
  525   2HD1  ILE 148          2HD1      ILE 148 135.383  -0.857  -0.973
  526   3HD1  ILE 148          3HD1      ILE 148 136.688  -1.720  -0.160
  527    H    ASP 149           H        ASP 149 132.661  -6.034  -3.174
  528    HA   ASP 149           HA       ASP 149 130.672  -4.852  -4.984
  529   1HB   ASP 149          2HB       ASP 149 129.758  -7.169  -5.139
  530   2HB   ASP 149          1HB       ASP 149 131.422  -7.038  -5.700
  531    H    TYR 150           H        TYR 150 128.346  -5.623  -4.416
  532    HA   TYR 150           HA       TYR 150 127.582  -4.363  -2.048
  533   1HB   TYR 150          2HB       TYR 150 126.066  -4.705  -3.965
  534   2HB   TYR 150          1HB       TYR 150 126.030  -6.431  -3.623
  535    HD1  TYR 150           HD1      TYR 150 125.612  -3.323  -1.572
  536    HD2  TYR 150           HD2      TYR 150 124.025  -7.103  -2.713
  537    HE1  TYR 150           HE1      TYR 150 123.706  -2.974  -0.055
  538    HE2  TYR 150           HE2      TYR 150 122.114  -6.762  -1.199
  539    HH   TYR 150           HH       TYR 150 121.322  -3.805   0.127
  540    H    ASP 151           H        ASP 151 128.632  -7.607  -2.604
  541    HA   ASP 151           HA       ASP 151 127.507  -8.690  -0.192
  542   1HB   ASP 151          2HB       ASP 151 128.678  -9.749  -2.504
  543   2HB   ASP 151          1HB       ASP 151 129.798 -10.159  -1.208
  544    H    GLU 152           H        GLU 152 130.807  -7.866  -1.243
  545    HA   GLU 152           HA       GLU 152 131.996  -8.282   1.286
  546   1HB   GLU 152          2HB       GLU 152 132.992  -6.505  -0.947
  547   2HB   GLU 152          1HB       GLU 152 133.953  -7.194   0.356
  548   1HG   GLU 152          2HG       GLU 152 133.341  -9.461  -0.528
  549   2HG   GLU 152          1HG       GLU 152 132.641  -8.645  -1.925
  550    H    PHE 153           H        PHE 153 130.616  -5.426  -0.271
  551    HA   PHE 153           HA       PHE 153 131.523  -3.588   1.704
  552   1HB   PHE 153          2HB       PHE 153 130.118  -3.441  -0.755
  553   2HB   PHE 153          1HB       PHE 153 129.123  -2.645   0.457
  554    HD1  PHE 153           HD1      PHE 153 131.325  -1.583   2.208
  555    HD2  PHE 153           HD2      PHE 153 130.842  -1.610  -2.020
  556    HE1  PHE 153           HE1      PHE 153 132.733   0.428   2.039
  557    HE2  PHE 153           HE2      PHE 153 132.249   0.400  -2.196
  558    HZ   PHE 153           HZ       PHE 153 133.198   1.421  -0.166
  559    H    LEU 154           H        LEU 154 128.828  -5.756   1.500
  560    HA   LEU 154           HA       LEU 154 127.073  -4.518   3.305
  561   1HB   LEU 154          2HB       LEU 154 127.081  -6.842   1.816
  562   2HB   LEU 154          1HB       LEU 154 127.106  -7.435   3.465
  563    HG   LEU 154           HG       LEU 154 124.826  -7.302   2.720
  564   1HD1  LEU 154          1HD1      LEU 154 124.019  -5.413   4.330
  565   2HD1  LEU 154          2HD1      LEU 154 125.726  -5.332   4.769
  566   3HD1  LEU 154          3HD1      LEU 154 124.834  -6.839   4.972
  567   1HD2  LEU 154          1HD2      LEU 154 124.850  -4.362   2.410
  568   2HD2  LEU 154          2HD2      LEU 154 123.888  -5.583   1.580
  569   3HD2  LEU 154          3HD2      LEU 154 125.563  -5.309   1.105
  570    H    GLU 155           H        GLU 155 129.719  -6.816   3.832
  571    HA   GLU 155           HA       GLU 155 129.296  -7.028   6.642
  572   1HB   GLU 155          2HB       GLU 155 131.587  -7.766   4.831
  573   2HB   GLU 155          1HB       GLU 155 131.675  -7.981   6.575
  574   1HG   GLU 155          2HG       GLU 155 129.344  -9.115   5.124
  575   2HG   GLU 155          1HG       GLU 155 130.905  -9.921   4.981
  576    H    PHE 156           H        PHE 156 131.194  -4.927   4.587
  577    HA   PHE 156           HA       PHE 156 132.958  -3.857   6.455
  578   1HB   PHE 156          2HB       PHE 156 132.496  -3.441   3.812
  579   2HB   PHE 156          1HB       PHE 156 131.849  -1.950   4.489
  580    HD1  PHE 156           HD1      PHE 156 133.694  -1.542   6.768
  581    HD2  PHE 156           HD2      PHE 156 134.455  -2.764   2.765
  582    HE1  PHE 156           HE1      PHE 156 135.969  -0.621   6.926
  583    HE2  PHE 156           HE2      PHE 156 136.733  -1.846   2.915
  584    HZ   PHE 156           HZ       PHE 156 137.493  -0.774   4.997
  585    H    MET 157           H        MET 157 129.606  -3.018   5.754
  586    HA   MET 157           HA       MET 157 129.678  -0.967   7.845
  587   1HB   MET 157          2HB       MET 157 128.231  -1.280   5.373
  588   2HB   MET 157          1HB       MET 157 127.103  -1.070   6.705
  589   1HG   MET 157          2HG       MET 157 127.429   1.108   6.453
  590   2HG   MET 157          1HG       MET 157 129.004   0.850   7.199
  591   1HE   MET 157          1HE       MET 157 130.704  -0.592   5.408
  592   2HE   MET 157          2HE       MET 157 131.378   1.001   5.745
  593   3HE   MET 157          3HE       MET 157 131.312   0.406   4.088
  594    H    LYS 158           H        LYS 158 129.160  -4.188   7.722
  595    HA   LYS 158           HA       LYS 158 126.906  -4.188   9.597
  596   1HB   LYS 158          2HB       LYS 158 126.982  -5.757   7.597
  597   2HB   LYS 158          1HB       LYS 158 128.294  -6.592   8.414
  598   1HG   LYS 158          2HG       LYS 158 126.861  -7.748   9.642
  599   2HG   LYS 158          1HG       LYS 158 126.088  -6.268  10.212
  600   1HD   LYS 158          2HD       LYS 158 124.453  -6.340   8.604
  601   2HD   LYS 158          1HD       LYS 158 125.465  -7.226   7.462
  602   1HE   LYS 158          2HE       LYS 158 124.480  -9.115   8.086
  603   2HE   LYS 158          1HE       LYS 158 125.110  -8.890   9.717
  604   1HZ   LYS 158          1HZ       LYS 158 123.157  -7.886  10.417
  605   2HZ   LYS 158          2HZ       LYS 158 122.598  -9.124   9.409
  606   3HZ   LYS 158          3HZ       LYS 158 122.639  -7.530   8.845
  607    H    GLY 159           H        GLY 159 129.321  -3.097  10.487
  608   1HA   GLY 159          2HA       GLY 159 130.046  -3.406  12.810
  609   2HA   GLY 159          1HA       GLY 159 130.178  -5.126  12.458
  610    H    VAL 160           H        VAL 160 131.970  -2.433  12.935
  611    HA   VAL 160           HA       VAL 160 134.183  -3.524  11.340
  612    HB   VAL 160           HB       VAL 160 134.313  -0.616  11.688
  613   1HG1  VAL 160          1HG1      VAL 160 134.855  -2.642   9.571
  614   2HG1  VAL 160          2HG1      VAL 160 135.936  -1.450  10.294
  615   3HG1  VAL 160          3HG1      VAL 160 134.718  -0.943   9.123
  616   1HG2  VAL 160          1HG2      VAL 160 132.079  -1.837  10.085
  617   2HG2  VAL 160          2HG2      VAL 160 132.738  -0.240   9.725
  618   3HG2  VAL 160          3HG2      VAL 160 131.991  -0.554  11.292
  619    H    GLU 161           H        GLU 161 133.737  -4.112  14.013
  620    HA   GLU 161           HA       GLU 161 135.271  -2.356  15.695
  621   1HB   GLU 161          2HB       GLU 161 134.281  -5.170  16.196
  622   2HB   GLU 161          1HB       GLU 161 134.959  -4.096  17.412
  623   1HG   GLU 161          2HG       GLU 161 132.883  -3.447  17.828
  624   2HG   GLU 161          1HG       GLU 161 132.931  -2.604  16.279
  Start of MODEL    7
    1   1H    MET  81          1HT       MET  81  96.880  -1.419   8.182
    2   2H    MET  81          2HT       MET  81  98.036  -2.540   7.588
    3   3H    MET  81          3HT       MET  81  98.277  -1.782   9.108
    4    HA   MET  81           HA       MET  81  97.493  -4.122   9.142
    5   1HB   MET  81          2HB       MET  81  96.760  -1.783  10.649
    6   2HB   MET  81          1HB       MET  81  95.434  -2.937  10.682
    7   1HG   MET  81          2HG       MET  81  96.564  -3.738  12.451
    8   2HG   MET  81          1HG       MET  81  97.464  -4.597  11.201
    9   1HE   MET  81          1HE       MET  81  98.750  -4.943  13.248
   10   2HE   MET  81          2HE       MET  81  99.632  -3.727  14.170
   11   3HE   MET  81          3HE       MET  81 100.371  -4.461  12.748
   12    H    VAL  82           H        VAL  82  96.285  -5.458   7.979
   13    HA   VAL  82           HA       VAL  82  93.563  -4.628   7.241
   14    HB   VAL  82           HB       VAL  82  95.378  -6.185   5.398
   15   1HG1  VAL  82          1HG1      VAL  82  93.451  -5.176   3.831
   16   2HG1  VAL  82          2HG1      VAL  82  92.549  -5.334   5.339
   17   3HG1  VAL  82          3HG1      VAL  82  93.327  -6.746   4.625
   18   1HG2  VAL  82          1HG2      VAL  82  96.054  -3.768   5.821
   19   2HG2  VAL  82          2HG2      VAL  82  94.546  -3.320   5.022
   20   3HG2  VAL  82          3HG2      VAL  82  95.774  -4.233   4.143
   21    H    ARG  83           H        ARG  83  95.828  -7.350   7.526
   22    HA   ARG  83           HA       ARG  83  93.699  -8.940   8.733
   23   1HB   ARG  83          2HB       ARG  83  95.403 -10.116   6.541
   24   2HB   ARG  83          1HB       ARG  83  93.977 -10.814   7.301
   25   1HG   ARG  83          2HG       ARG  83  92.591  -9.069   6.278
   26   2HG   ARG  83          1HG       ARG  83  94.025  -8.406   5.492
   27   1HD   ARG  83          2HD       ARG  83  94.218 -10.184   4.040
   28   2HD   ARG  83          1HD       ARG  83  93.355 -11.287   5.111
   29    HE   ARG  83           HE       ARG  83  91.456  -9.492   4.411
   30   1HH1  ARG  83          1HH1      ARG  83  93.683 -11.457   2.578
   31   2HH1  ARG  83          2HH1      ARG  83  92.628 -11.599   1.212
   32   1HH2  ARG  83          1HH2      ARG  83  90.067  -9.678   2.615
   33   2HH2  ARG  83          2HH2      ARG  83  90.576 -10.590   1.233
   34    H    CYS  84           H        CYS  84  97.016  -9.466   7.521
   35    HA   CYS  84           HA       CYS  84  97.955  -9.859  10.249
   36   1HB   CYS  84          2HB       CYS  84  97.134 -12.075   8.982
   37   2HB   CYS  84          1HB       CYS  84  98.769 -11.984   8.335
   38    HG   CYS  84           HG       CYS  84  99.720 -12.517  10.584
   39    H    MET  85           H        MET  85  98.937 -10.241   6.840
   40    HA   MET  85           HA       MET  85 101.624  -9.388   7.404
   41   1HB   MET  85          2HB       MET  85 100.209  -9.856   4.772
   42   2HB   MET  85          1HB       MET  85 101.931  -9.549   4.950
   43   1HG   MET  85          2HG       MET  85 100.461 -11.895   6.129
   44   2HG   MET  85          1HG       MET  85 101.410 -11.928   4.645
   45   1HE   MET  85          1HE       MET  85 101.874 -13.102   8.346
   46   2HE   MET  85          2HE       MET  85 103.206 -13.938   7.551
   47   3HE   MET  85          3HE       MET  85 101.624 -13.868   6.777
   48    H    LYS  86           H        LYS  86 102.521  -7.672   5.729
   49    HA   LYS  86           HA       LYS  86 102.693  -5.465   5.210
   50   1HB   LYS  86          2HB       LYS  86  99.878  -6.148   4.621
   51   2HB   LYS  86          1HB       LYS  86 100.224  -4.432   4.783
   52   1HG   LYS  86          2HG       LYS  86 102.209  -5.026   3.155
   53   2HG   LYS  86          1HG       LYS  86 101.147  -6.371   2.733
   54   1HD   LYS  86          2HD       LYS  86  99.334  -4.479   2.576
   55   2HD   LYS  86          1HD       LYS  86 100.743  -3.439   2.358
   56   1HE   LYS  86          2HE       LYS  86 100.577  -3.971   0.191
   57   2HE   LYS  86          1HE       LYS  86 101.286  -5.516   0.661
   58   1HZ   LYS  86          1HZ       LYS  86  98.856  -6.182   1.103
   59   2HZ   LYS  86          2HZ       LYS  86  99.401  -6.130  -0.496
   60   3HZ   LYS  86          3HZ       LYS  86  98.465  -4.863   0.118
   61    H    ASP  87           H        ASP  87 103.256  -5.443   7.609
   62    HA   ASP  87           HA       ASP  87 101.398  -3.649   9.030
   63   1HB   ASP  87          2HB       ASP  87 103.239  -5.785  10.107
   64   2HB   ASP  87          1HB       ASP  87 102.528  -4.540  11.130
   65    H    ASP  88           H        ASP  88 104.832  -4.578   9.300
   66    HA   ASP  88           HA       ASP  88 105.696  -2.093  10.258
   67   1HB   ASP  88          2HB       ASP  88 106.876  -4.460  10.122
   68   2HB   ASP  88          1HB       ASP  88 107.556  -3.784   8.646
   69    H    SER  89           H        SER  89 107.508  -0.853   9.016
   70    HA   SER  89           HA       SER  89 106.374  -0.091   6.414
   71   1HB   SER  89          2HB       SER  89 106.761   1.511   8.539
   72   2HB   SER  89          1HB       SER  89 108.340   1.678   7.773
   73    HG   SER  89           HG       SER  89 107.455   2.863   6.287
   74    H    LYS  90           H        LYS  90 108.837   1.490   5.823
   75    HA   LYS  90           HA       LYS  90 110.281  -0.620   4.498
   76   1HB   LYS  90          2HB       LYS  90 109.759   1.709   3.556
   77   2HB   LYS  90          1HB       LYS  90 111.069   2.288   4.576
   78   1HG   LYS  90          2HG       LYS  90 112.306   1.913   2.744
   79   2HG   LYS  90          1HG       LYS  90 112.308   0.248   3.331
   80   1HD   LYS  90          2HD       LYS  90 109.987   0.988   1.682
   81   2HD   LYS  90          1HD       LYS  90 111.536   1.002   0.839
   82   1HE   LYS  90          2HE       LYS  90 110.524  -1.307   2.491
   83   2HE   LYS  90          1HE       LYS  90 110.326  -1.181   0.743
   84   1HZ   LYS  90          1HZ       LYS  90 112.805  -0.992   0.624
   85   2HZ   LYS  90          2HZ       LYS  90 112.229  -2.499   1.132
   86   3HZ   LYS  90          3HZ       LYS  90 112.861  -1.412   2.263
   87    H    GLY  91           H        GLY  91 110.889  -1.618   6.612
   88   1HA   GLY  91          2HA       GLY  91 112.593  -0.466   8.477
   89   2HA   GLY  91          1HA       GLY  91 112.535  -2.182   8.107
   90    H    LYS  92           H        LYS  92 114.761  -0.218   8.705
   91    HA   LYS  92           HA       LYS  92 116.331  -0.373   6.250
   92   1HB   LYS  92          2HB       LYS  92 116.967   0.882   8.927
   93   2HB   LYS  92          1HB       LYS  92 117.992   0.968   7.502
   94   1HG   LYS  92          2HG       LYS  92 116.799   2.623   6.603
   95   2HG   LYS  92          1HG       LYS  92 115.262   1.857   7.007
   96   1HD   LYS  92          2HD       LYS  92 116.848   3.016   9.233
   97   2HD   LYS  92          1HD       LYS  92 116.055   4.139   8.127
   98   1HE   LYS  92          2HE       LYS  92 113.937   3.416   8.701
   99   2HE   LYS  92          1HE       LYS  92 114.514   1.849   9.266
  100   1HZ   LYS  92          1HZ       LYS  92 114.084   2.892  11.235
  101   2HZ   LYS  92          2HZ       LYS  92 114.484   4.430  10.658
  102   3HZ   LYS  92          3HZ       LYS  92 115.707   3.326  11.038
  103    H    THR  93           H        THR  93 116.701  -2.605   6.123
  104    HA   THR  93           HA       THR  93 118.414  -3.719   8.242
  105    HB   THR  93           HB       THR  93 117.611  -5.893   7.687
  106    HG1  THR  93           HG1      THR  93 116.671  -6.376   5.840
  107   1HG2  THR  93          1HG2      THR  93 115.000  -5.410   7.498
  108   2HG2  THR  93          2HG2      THR  93 115.543  -3.814   8.012
  109   3HG2  THR  93          3HG2      THR  93 115.906  -5.228   9.000
  110    H    GLU  94           H        GLU  94 119.266  -5.960   6.647
  111    HA   GLU  94           HA       GLU  94 121.503  -4.779   5.348
  112   1HB   GLU  94          2HB       GLU  94 120.557  -7.491   5.978
  113   2HB   GLU  94          1HB       GLU  94 121.537  -7.381   4.522
  114   1HG   GLU  94          2HG       GLU  94 123.409  -7.118   5.685
  115   2HG   GLU  94          1HG       GLU  94 122.687  -5.892   6.726
  116    H    GLU  95           H        GLU  95 118.365  -5.191   4.301
  117    HA   GLU  95           HA       GLU  95 119.023  -5.741   1.525
  118   1HB   GLU  95          2HB       GLU  95 116.867  -6.420   2.963
  119   2HB   GLU  95          1HB       GLU  95 116.284  -4.896   2.307
  120   1HG   GLU  95          2HG       GLU  95 116.763  -5.712   0.040
  121   2HG   GLU  95          1HG       GLU  95 117.284  -7.252   0.721
  122    H    GLU  96           H        GLU  96 118.131  -3.045   3.566
  123    HA   GLU  96           HA       GLU  96 117.592  -1.221   1.437
  124   1HB   GLU  96          2HB       GLU  96 117.512   0.481   3.137
  125   2HB   GLU  96          1HB       GLU  96 116.709  -0.958   3.751
  126   1HG   GLU  96          2HG       GLU  96 118.059  -1.029   5.498
  127   2HG   GLU  96          1HG       GLU  96 119.480  -1.036   4.454
  128    H    LEU  97           H        LEU  97 120.455  -2.333   3.019
  129    HA   LEU  97           HA       LEU  97 122.162  -0.160   2.531
  130   1HB   LEU  97          2HB       LEU  97 122.437  -2.977   3.282
  131   2HB   LEU  97          1HB       LEU  97 123.805  -2.353   2.382
  132    HG   LEU  97           HG       LEU  97 122.711  -1.089   4.893
  133   1HD1  LEU  97          1HD1      LEU  97 125.326  -2.502   4.783
  134   2HD1  LEU  97          2HD1      LEU  97 123.853  -3.457   4.955
  135   3HD1  LEU  97          3HD1      LEU  97 124.248  -2.221   6.150
  136   1HD2  LEU  97          1HD2      LEU  97 125.428  -0.616   3.758
  137   2HD2  LEU  97          2HD2      LEU  97 124.439   0.423   4.784
  138   3HD2  LEU  97          3HD2      LEU  97 124.042   0.236   3.076
  139    H    SER  98           H        SER  98 120.729  -2.354   0.348
  140    HA   SER  98           HA       SER  98 122.764  -2.419  -1.632
  141   1HB   SER  98          2HB       SER  98 121.082  -3.353  -3.089
  142   2HB   SER  98          1HB       SER  98 120.858  -4.043  -1.481
  143    HG   SER  98           HG       SER  98 119.107  -2.732  -1.165
  144    H    ASP  99           H        ASP  99 120.101  -0.246  -0.929
  145    HA   ASP  99           HA       ASP  99 120.194   1.201  -3.367
  146   1HB   ASP  99          2HB       ASP  99 118.439   1.133  -1.329
  147   2HB   ASP  99          1HB       ASP  99 119.311   2.602  -0.904
  148    H    LEU 100           H        LEU 100 121.781   1.588  -0.243
  149    HA   LEU 100           HA       LEU 100 123.008   4.086  -0.947
  150   1HB   LEU 100          2HB       LEU 100 123.301   2.177   1.350
  151   2HB   LEU 100          1HB       LEU 100 124.404   3.525   1.154
  152    HG   LEU 100           HG       LEU 100 122.106   4.876   0.995
  153   1HD1  LEU 100          1HD1      LEU 100 121.363   2.818   3.027
  154   2HD1  LEU 100          2HD1      LEU 100 120.942   2.578   1.331
  155   3HD1  LEU 100          3HD1      LEU 100 120.346   3.995   2.196
  156   1HD2  LEU 100          1HD2      LEU 100 123.740   5.522   2.549
  157   2HD2  LEU 100          2HD2      LEU 100 123.640   3.994   3.421
  158   3HD2  LEU 100          3HD2      LEU 100 122.315   5.153   3.522
  159    H    PHE 101           H        PHE 101 123.671   0.855  -1.700
  160    HA   PHE 101           HA       PHE 101 126.501   0.902  -1.708
  161   1HB   PHE 101          2HB       PHE 101 125.195  -1.187  -1.764
  162   2HB   PHE 101          1HB       PHE 101 124.622  -0.781  -3.377
  163    HD1  PHE 101           HD1      PHE 101 127.493  -1.877  -1.391
  164    HD2  PHE 101           HD2      PHE 101 126.053  -1.000  -5.298
  165    HE1  PHE 101           HE1      PHE 101 129.459  -2.995  -2.362
  166    HE2  PHE 101           HE2      PHE 101 128.015  -2.118  -6.277
  167    HZ   PHE 101           HZ       PHE 101 129.720  -3.117  -4.807
  168    H    ARG 102           H        ARG 102 124.074   1.612  -4.195
  169    HA   ARG 102           HA       ARG 102 125.822   1.959  -6.350
  170   1HB   ARG 102          2HB       ARG 102 123.976   3.464  -7.253
  171   2HB   ARG 102          1HB       ARG 102 123.523   1.812  -6.856
  172   1HG   ARG 102          2HG       ARG 102 122.245   2.441  -5.070
  173   2HG   ARG 102          1HG       ARG 102 123.172   3.916  -4.785
  174   1HD   ARG 102          2HD       ARG 102 122.199   4.579  -7.139
  175   2HD   ARG 102          1HD       ARG 102 120.963   3.395  -6.715
  176    HE   ARG 102           HE       ARG 102 121.474   5.330  -4.650
  177   1HH1  ARG 102          1HH1      ARG 102 119.649   4.646  -7.546
  178   2HH1  ARG 102          2HH1      ARG 102 118.377   5.757  -7.156
  179   1HH2  ARG 102          1HH2      ARG 102 119.803   6.787  -4.136
  180   2HH2  ARG 102          2HH2      ARG 102 118.464   6.971  -5.220
  181    H    MET 103           H        MET 103 124.961   4.092  -3.718
  182    HA   MET 103           HA       MET 103 125.818   6.534  -4.754
  183   1HB   MET 103          2HB       MET 103 125.641   5.418  -1.977
  184   2HB   MET 103          1HB       MET 103 126.367   6.995  -2.242
  185   1HG   MET 103          2HG       MET 103 124.233   7.607  -3.469
  186   2HG   MET 103          1HG       MET 103 123.549   6.131  -2.791
  187   1HE   MET 103          1HE       MET 103 122.207   8.486  -2.624
  188   2HE   MET 103          2HE       MET 103 122.484   9.674  -1.350
  189   3HE   MET 103          3HE       MET 103 121.572   8.205  -1.003
  190    H    PHE 104           H        PHE 104 127.625   3.842  -3.465
  191    HA   PHE 104           HA       PHE 104 130.108   5.281  -3.279
  192   1HB   PHE 104          2HB       PHE 104 129.161   2.547  -2.717
  193   2HB   PHE 104          1HB       PHE 104 130.834   2.654  -3.251
  194    HD1  PHE 104           HD1      PHE 104 128.443   3.959  -0.738
  195    HD2  PHE 104           HD2      PHE 104 132.518   3.311  -1.779
  196    HE1  PHE 104           HE1      PHE 104 129.122   4.605   1.538
  197    HE2  PHE 104           HE2      PHE 104 133.205   3.956   0.495
  198    HZ   PHE 104           HZ       PHE 104 131.506   4.603   2.155
  199    H    ASP 105           H        ASP 105 128.370   3.712  -5.779
  200    HA   ASP 105           HA       ASP 105 130.767   3.377  -7.423
  201   1HB   ASP 105          2HB       ASP 105 128.326   1.952  -7.208
  202   2HB   ASP 105          1HB       ASP 105 128.356   2.676  -8.813
  203    H    LYS 106           H        LYS 106 131.043   4.423  -9.394
  204    HA   LYS 106           HA       LYS 106 129.293   6.757  -9.815
  205   1HB   LYS 106          2HB       LYS 106 132.263   6.418 -10.102
  206   2HB   LYS 106          1HB       LYS 106 131.416   7.672 -10.999
  207   1HG   LYS 106          2HG       LYS 106 130.828   7.553  -8.118
  208   2HG   LYS 106          1HG       LYS 106 132.476   8.018  -8.550
  209   1HD   LYS 106          2HD       LYS 106 131.828  10.005  -9.386
  210   2HD   LYS 106          1HD       LYS 106 130.372   9.334 -10.123
  211   1HE   LYS 106          2HE       LYS 106 129.532  10.756  -8.489
  212   2HE   LYS 106          1HE       LYS 106 129.489   9.176  -7.708
  213   1HZ   LYS 106          1HZ       LYS 106 131.074   9.759  -6.239
  214   2HZ   LYS 106          2HZ       LYS 106 130.551  11.330  -6.584
  215   3HZ   LYS 106          3HZ       LYS 106 131.930  10.713  -7.345
  216    H    ASN 107           H        ASN 107 131.337   4.364 -11.459
  217    HA   ASN 107           HA       ASN 107 130.247   5.044 -14.045
  218   1HB   ASN 107          2HB       ASN 107 131.674   3.179 -14.858
  219   2HB   ASN 107          1HB       ASN 107 132.569   4.373 -13.923
  220   1HD2  ASN 107          1HD2      ASN 107 133.985   2.335 -14.007
  221   2HD2  ASN 107          2HD2      ASN 107 133.844   1.278 -12.649
  222    H    ALA 108           H        ALA 108 128.988   3.374 -11.521
  223    HA   ALA 108           HA       ALA 108 127.403   1.758 -11.259
  224   1HB   ALA 108          1HB       ALA 108 125.648   1.725 -13.033
  225   2HB   ALA 108          2HB       ALA 108 126.668   2.801 -13.989
  226   3HB   ALA 108          3HB       ALA 108 126.038   3.337 -12.430
  227    H    ASP 109           H        ASP 109 129.596   0.439 -11.663
  228    HA   ASP 109           HA       ASP 109 129.152  -1.433 -13.883
  229   1HB   ASP 109          2HB       ASP 109 131.526  -2.171 -13.336
  230   2HB   ASP 109          1HB       ASP 109 131.349  -0.550 -14.004
  231    H    GLY 110           H        GLY 110 128.745  -1.140 -10.542
  232   1HA   GLY 110          2HA       GLY 110 127.592  -2.835  -9.316
  233   2HA   GLY 110          1HA       GLY 110 128.347  -4.046 -10.342
  234    H    TYR 111           H        TYR 111 130.860  -2.157  -9.792
  235    HA   TYR 111           HA       TYR 111 131.471  -3.157  -7.108
  236   1HB   TYR 111          2HB       TYR 111 133.307  -3.513  -9.487
  237   2HB   TYR 111          1HB       TYR 111 133.651  -3.990  -7.828
  238    HD1  TYR 111           HD1      TYR 111 131.342  -4.644 -10.667
  239    HD2  TYR 111           HD2      TYR 111 133.037  -6.112  -7.051
  240    HE1  TYR 111           HE1      TYR 111 130.346  -6.849 -11.102
  241    HE2  TYR 111           HE2      TYR 111 132.046  -8.321  -7.476
  242    HH   TYR 111           HH       TYR 111 129.760  -9.038  -9.062
  243    H    ILE 112           H        ILE 112 133.203  -2.036  -6.053
  244    HA   ILE 112           HA       ILE 112 133.621   0.661  -7.156
  245    HB   ILE 112           HB       ILE 112 133.931  -0.162  -4.272
  246   1HG1  ILE 112          2HG1      ILE 112 131.640   1.477  -4.637
  247   2HG1  ILE 112          1HG1      ILE 112 131.523   0.159  -5.798
  248   1HG2  ILE 112          1HG2      ILE 112 134.398   1.992  -3.810
  249   2HG2  ILE 112          2HG2      ILE 112 133.284   2.608  -5.030
  250   3HG2  ILE 112          3HG2      ILE 112 134.884   2.037  -5.504
  251   1HD1  ILE 112          1HD1      ILE 112 132.323  -0.817  -3.210
  252   2HD1  ILE 112          2HD1      ILE 112 130.944  -1.270  -4.213
  253   3HD1  ILE 112          3HD1      ILE 112 130.822   0.104  -3.115
  254    H    ASP 113           H        ASP 113 135.626   1.411  -7.519
  255    HA   ASP 113           HA       ASP 113 137.875  -0.355  -6.813
  256   1HB   ASP 113          2HB       ASP 113 139.047   0.822  -8.736
  257   2HB   ASP 113          1HB       ASP 113 137.716  -0.241  -9.182
  258    H    LEU 114           H        LEU 114 140.029   1.004  -6.865
  259    HA   LEU 114           HA       LEU 114 139.905   2.764  -4.655
  260   1HB   LEU 114          2HB       LEU 114 142.062   1.933  -6.558
  261   2HB   LEU 114          1HB       LEU 114 142.350   3.234  -5.420
  262    HG   LEU 114           HG       LEU 114 141.392   1.352  -3.735
  263   1HD1  LEU 114          1HD1      LEU 114 142.372  -0.047  -6.149
  264   2HD1  LEU 114          2HD1      LEU 114 141.169  -0.540  -4.958
  265   3HD1  LEU 114          3HD1      LEU 114 142.887  -0.685  -4.588
  266   1HD2  LEU 114          1HD2      LEU 114 143.384   2.490  -3.237
  267   2HD2  LEU 114          2HD2      LEU 114 144.193   1.886  -4.683
  268   3HD2  LEU 114          3HD2      LEU 114 143.847   0.791  -3.344
  269    H    GLU 115           H        GLU 115 139.902   3.255  -8.111
  270    HA   GLU 115           HA       GLU 115 140.590   6.009  -8.081
  271   1HB   GLU 115          2HB       GLU 115 140.797   4.606 -10.089
  272   2HB   GLU 115          1HB       GLU 115 139.049   4.430 -10.147
  273   1HG   GLU 115          2HG       GLU 115 139.371   6.086 -11.685
  274   2HG   GLU 115          1HG       GLU 115 139.077   7.037 -10.230
  275    H    GLU 116           H        GLU 116 137.615   4.263  -7.605
  276    HA   GLU 116           HA       GLU 116 136.002   6.674  -7.851
  277   1HB   GLU 116          2HB       GLU 116 135.519   3.889  -8.117
  278   2HB   GLU 116          1HB       GLU 116 134.512   4.471  -6.799
  279   1HG   GLU 116          2HG       GLU 116 133.166   5.622  -8.166
  280   2HG   GLU 116          1HG       GLU 116 134.498   6.175  -9.180
  281    H    LEU 117           H        LEU 117 136.994   4.358  -5.368
  282    HA   LEU 117           HA       LEU 117 135.542   5.304  -3.213
  283   1HB   LEU 117          2HB       LEU 117 136.995   3.261  -3.280
  284   2HB   LEU 117          1HB       LEU 117 138.387   4.311  -3.091
  285    HG   LEU 117           HG       LEU 117 137.548   5.047  -0.906
  286   1HD1  LEU 117          1HD1      LEU 117 135.651   3.364  -0.064
  287   2HD1  LEU 117          2HD1      LEU 117 135.191   3.487  -1.762
  288   3HD1  LEU 117          3HD1      LEU 117 135.294   4.940  -0.768
  289   1HD2  LEU 117          1HD2      LEU 117 139.051   3.115  -1.055
  290   2HD2  LEU 117          2HD2      LEU 117 137.653   2.045  -1.172
  291   3HD2  LEU 117          3HD2      LEU 117 137.931   2.974   0.301
  292    H    LYS 118           H        LYS 118 138.260   6.743  -4.809
  293    HA   LYS 118           HA       LYS 118 138.851   8.560  -2.638
  294   1HB   LYS 118          2HB       LYS 118 140.514   9.511  -4.163
  295   2HB   LYS 118          1HB       LYS 118 140.664   7.762  -4.064
  296   1HG   LYS 118          2HG       LYS 118 139.423   7.568  -6.188
  297   2HG   LYS 118          1HG       LYS 118 139.386   9.329  -6.295
  298   1HD   LYS 118          2HD       LYS 118 142.044   8.144  -5.848
  299   2HD   LYS 118          1HD       LYS 118 141.303   7.774  -7.408
  300   1HE   LYS 118          2HE       LYS 118 140.803  10.400  -7.305
  301   2HE   LYS 118          1HE       LYS 118 142.264  10.353  -6.319
  302   1HZ   LYS 118          1HZ       LYS 118 143.099  10.630  -8.428
  303   2HZ   LYS 118          2HZ       LYS 118 141.920   9.662  -9.158
  304   3HZ   LYS 118          3HZ       LYS 118 143.171   8.947  -8.272
  305    H    ILE 119           H        ILE 119 136.844   8.507  -5.453
  306    HA   ILE 119           HA       ILE 119 136.610  11.290  -5.884
  307    HB   ILE 119           HB       ILE 119 134.505   9.204  -6.458
  308   1HG1  ILE 119          2HG1      ILE 119 136.852  10.096  -8.149
  309   2HG1  ILE 119          1HG1      ILE 119 136.648   8.510  -7.413
  310   1HG2  ILE 119          1HG2      ILE 119 135.070  11.841  -7.808
  311   2HG2  ILE 119          2HG2      ILE 119 133.797  11.568  -6.617
  312   3HG2  ILE 119          3HG2      ILE 119 133.749  10.729  -8.168
  313   1HD1  ILE 119          1HD1      ILE 119 134.354   8.777  -8.876
  314   2HD1  ILE 119          2HD1      ILE 119 135.806   7.914  -9.385
  315   3HD1  ILE 119          3HD1      ILE 119 135.554   9.586  -9.885
  316    H    MET 120           H        MET 120 134.358   9.036  -4.273
  317    HA   MET 120           HA       MET 120 132.567  10.937  -3.323
  318   1HB   MET 120          2HB       MET 120 131.873   9.233  -1.693
  319   2HB   MET 120          1HB       MET 120 132.077   8.552  -3.300
  320   1HG   MET 120          2HG       MET 120 133.819   7.257  -2.686
  321   2HG   MET 120          1HG       MET 120 134.422   8.430  -1.517
  322   1HE   MET 120          1HE       MET 120 134.574   8.146   0.518
  323   2HE   MET 120          2HE       MET 120 134.598   6.424   0.903
  324   3HE   MET 120          3HE       MET 120 133.427   7.487   1.684
  325    H    LEU 121           H        LEU 121 135.689   9.988  -2.097
  326    HA   LEU 121           HA       LEU 121 135.358  11.181   0.485
  327   1HB   LEU 121          2HB       LEU 121 137.427   9.730  -0.958
  328   2HB   LEU 121          1HB       LEU 121 138.088  11.047  -0.008
  329    HG   LEU 121           HG       LEU 121 136.386   8.782   1.039
  330   1HD1  LEU 121          1HD1      LEU 121 138.434   7.804   0.787
  331   2HD1  LEU 121          2HD1      LEU 121 138.636   8.530   2.383
  332   3HD1  LEU 121          3HD1      LEU 121 139.308   9.326   0.959
  333   1HD2  LEU 121          1HD2      LEU 121 136.691  11.373   2.068
  334   2HD2  LEU 121          2HD2      LEU 121 137.736  10.339   3.043
  335   3HD2  LEU 121          3HD2      LEU 121 136.020   9.961   2.884
  336    H    GLN 122           H        GLN 122 136.747  12.189  -2.595
  337    HA   GLN 122           HA       GLN 122 137.885  14.609  -1.674
  338   1HB   GLN 122          2HB       GLN 122 137.074  13.581  -4.378
  339   2HB   GLN 122          1HB       GLN 122 137.642  15.233  -4.181
  340   1HG   GLN 122          2HG       GLN 122 139.421  13.391  -2.873
  341   2HG   GLN 122          1HG       GLN 122 139.175  12.933  -4.558
  342   1HE2  GLN 122          1HE2      GLN 122 139.999  14.192  -6.164
  343   2HE2  GLN 122          2HE2      GLN 122 141.022  15.555  -5.884
  344    H    ALA 123           H        ALA 123 134.668  13.702  -2.664
  345    HA   ALA 123           HA       ALA 123 133.631  16.285  -3.132
  346   1HB   ALA 123          1HB       ALA 123 132.401  13.632  -2.494
  347   2HB   ALA 123          2HB       ALA 123 132.317  14.576  -3.983
  348   3HB   ALA 123          3HB       ALA 123 131.408  15.088  -2.561
  349    H    THR 124           H        THR 124 134.381  14.578  -0.222
  350    HA   THR 124           HA       THR 124 132.605  15.859   1.550
  351    HB   THR 124           HB       THR 124 133.981  15.020   3.309
  352    HG1  THR 124           HG1      THR 124 136.098  14.250   2.860
  353   1HG2  THR 124          1HG2      THR 124 133.205  13.342   1.199
  354   2HG2  THR 124          2HG2      THR 124 133.500  12.910   2.884
  355   3HG2  THR 124          3HG2      THR 124 134.810  12.815   1.706
  356    H    GLY 125           H        GLY 125 134.071  17.010   3.541
  357   1HA   GLY 125          2HA       GLY 125 135.082  19.446   2.214
  358   2HA   GLY 125          1HA       GLY 125 134.261  19.430   3.768
  359    H    GLU 126           H        GLU 126 136.333  16.807   3.594
  360    HA   GLU 126           HA       GLU 126 138.379  18.280   5.106
  361   1HB   GLU 126          2HB       GLU 126 138.935  16.136   6.157
  362   2HB   GLU 126          1HB       GLU 126 137.245  16.551   6.401
  363   1HG   GLU 126          2HG       GLU 126 136.534  14.975   4.782
  364   2HG   GLU 126          1HG       GLU 126 138.186  14.702   4.232
  365    H    THR 127           H        THR 127 140.555  16.918   5.048
  366    HA   THR 127           HA       THR 127 141.218  16.636   2.199
  367    HB   THR 127           HB       THR 127 143.632  16.807   3.269
  368    HG1  THR 127           HG1      THR 127 142.060  18.229   5.148
  369   1HG2  THR 127          1HG2      THR 127 143.751  18.968   2.604
  370   2HG2  THR 127          2HG2      THR 127 142.219  19.405   3.360
  371   3HG2  THR 127          3HG2      THR 127 142.228  18.523   1.832
  372    H    ILE 128           H        ILE 128 141.919  14.750   1.397
  373    HA   ILE 128           HA       ILE 128 142.634  12.612   3.293
  374    HB   ILE 128           HB       ILE 128 141.126  12.115   0.731
  375   1HG1  ILE 128          2HG1      ILE 128 139.294  11.586   2.640
  376   2HG1  ILE 128          1HG1      ILE 128 140.147  12.918   3.415
  377   1HG2  ILE 128          1HG2      ILE 128 141.967  10.079   1.244
  378   2HG2  ILE 128          2HG2      ILE 128 140.573  10.034   2.325
  379   3HG2  ILE 128          3HG2      ILE 128 142.163  10.468   2.954
  380   1HD1  ILE 128          1HD1      ILE 128 139.518  14.432   1.792
  381   2HD1  ILE 128          2HD1      ILE 128 138.087  13.412   1.944
  382   3HD1  ILE 128          3HD1      ILE 128 139.200  13.175   0.596
  383    H    THR 129           H        THR 129 144.474  11.559   2.862
  384    HA   THR 129           HA       THR 129 146.002  12.351   0.524
  385    HB   THR 129           HB       THR 129 147.217  12.344   2.580
  386    HG1  THR 129           HG1      THR 129 148.858  10.870   2.084
  387   1HG2  THR 129          1HG2      THR 129 146.562  11.016   4.227
  388   2HG2  THR 129          2HG2      THR 129 147.490   9.745   3.433
  389   3HG2  THR 129          3HG2      THR 129 145.762   9.900   3.120
  390    H    GLU 130           H        GLU 130 147.419  10.445  -0.401
  391    HA   GLU 130           HA       GLU 130 145.619   8.713  -1.752
  392   1HB   GLU 130          2HB       GLU 130 148.548   9.192  -1.759
  393   2HB   GLU 130          1HB       GLU 130 148.002   7.629  -2.353
  394   1HG   GLU 130          2HG       GLU 130 146.314   9.344  -3.638
  395   2HG   GLU 130          1HG       GLU 130 147.809  10.275  -3.567
  396    H    ASP 131           H        ASP 131 147.725   8.351   1.016
  397    HA   ASP 131           HA       ASP 131 147.747   5.542   1.163
  398   1HB   ASP 131          2HB       ASP 131 148.733   7.705   2.706
  399   2HB   ASP 131          1HB       ASP 131 147.797   6.687   3.796
  400    H    ASP 132           H        ASP 132 145.620   7.940   2.699
  401    HA   ASP 132           HA       ASP 132 144.046   6.225   4.202
  402   1HB   ASP 132          2HB       ASP 132 143.963   8.700   4.329
  403   2HB   ASP 132          1HB       ASP 132 143.131   8.731   2.777
  404    H    ILE 133           H        ILE 133 143.653   7.221   0.823
  405    HA   ILE 133           HA       ILE 133 141.214   5.970   0.307
  406    HB   ILE 133           HB       ILE 133 143.494   6.309  -1.644
  407   1HG1  ILE 133          2HG1      ILE 133 142.995   8.437  -0.584
  408   2HG1  ILE 133          1HG1      ILE 133 142.376   8.447  -2.232
  409   1HG2  ILE 133          1HG2      ILE 133 141.629   4.816  -2.348
  410   2HG2  ILE 133          2HG2      ILE 133 141.830   6.244  -3.363
  411   3HG2  ILE 133          3HG2      ILE 133 140.530   6.183  -2.171
  412   1HD1  ILE 133          1HD1      ILE 133 140.835   8.186   0.327
  413   2HD1  ILE 133          2HD1      ILE 133 140.136   7.828  -1.252
  414   3HD1  ILE 133          3HD1      ILE 133 140.726   9.452  -0.895
  415    H    GLU 134           H        GLU 134 144.477   4.677   0.377
  416    HA   GLU 134           HA       GLU 134 143.857   2.186  -0.843
  417   1HB   GLU 134          2HB       GLU 134 146.142   3.049   0.929
  418   2HB   GLU 134          1HB       GLU 134 146.044   1.463   0.180
  419   1HG   GLU 134          2HG       GLU 134 146.236   2.359  -1.988
  420   2HG   GLU 134          1HG       GLU 134 145.940   4.002  -1.416
  421    H    GLU 135           H        GLU 135 144.460   3.053   2.568
  422    HA   GLU 135           HA       GLU 135 143.824   0.543   3.635
  423   1HB   GLU 135          2HB       GLU 135 143.497   1.774   5.780
  424   2HB   GLU 135          1HB       GLU 135 145.016   2.140   4.973
  425   1HG   GLU 135          2HG       GLU 135 144.326   4.267   4.359
  426   2HG   GLU 135          1HG       GLU 135 142.618   3.881   4.574
  427    H    LEU 136           H        LEU 136 141.794   3.313   2.857
  428    HA   LEU 136           HA       LEU 136 139.452   2.495   4.156
  429   1HB   LEU 136          2HB       LEU 136 140.137   4.689   2.788
  430   2HB   LEU 136          1HB       LEU 136 139.215   3.875   1.539
  431    HG   LEU 136           HG       LEU 136 138.191   4.621   4.279
  432   1HD1  LEU 136          1HD1      LEU 136 138.617   6.366   2.332
  433   2HD1  LEU 136          2HD1      LEU 136 137.191   6.448   3.366
  434   3HD1  LEU 136          3HD1      LEU 136 137.076   5.725   1.763
  435   1HD2  LEU 136          1HD2      LEU 136 135.996   3.941   3.349
  436   2HD2  LEU 136          2HD2      LEU 136 137.127   2.599   3.527
  437   3HD2  LEU 136          3HD2      LEU 136 136.833   3.298   1.935
  438    H    MET 137           H        MET 137 140.687   1.768   0.924
  439    HA   MET 137           HA       MET 137 138.391   0.283   0.109
  440   1HB   MET 137          2HB       MET 137 139.983   1.351  -1.474
  441   2HB   MET 137          1HB       MET 137 141.202   0.180  -0.996
  442   1HG   MET 137          2HG       MET 137 140.460  -1.208  -2.541
  443   2HG   MET 137          1HG       MET 137 138.904  -1.281  -1.717
  444   1HE   MET 137          1HE       MET 137 137.133  -1.429  -3.475
  445   2HE   MET 137          2HE       MET 137 136.560   0.077  -4.193
  446   3HE   MET 137          3HE       MET 137 136.772  -0.041  -2.446
  447    H    LYS 138           H        LYS 138 141.465  -0.522   1.615
  448    HA   LYS 138           HA       LYS 138 141.252  -3.333   1.343
  449   1HB   LYS 138          2HB       LYS 138 143.196  -1.605   2.210
  450   2HB   LYS 138          1HB       LYS 138 142.694  -2.366   3.713
  451   1HG   LYS 138          2HG       LYS 138 144.124  -3.986   3.192
  452   2HG   LYS 138          1HG       LYS 138 142.933  -4.498   1.995
  453   1HD   LYS 138          2HD       LYS 138 144.046  -2.932   0.372
  454   2HD   LYS 138          1HD       LYS 138 145.322  -2.710   1.570
  455   1HE   LYS 138          2HE       LYS 138 144.515  -5.439   0.619
  456   2HE   LYS 138          1HE       LYS 138 145.681  -4.463  -0.271
  457   1HZ   LYS 138          1HZ       LYS 138 145.965  -5.171   2.597
  458   2HZ   LYS 138          2HZ       LYS 138 147.119  -4.423   1.612
  459   3HZ   LYS 138          3HZ       LYS 138 146.689  -6.035   1.334
  460    H    ASP 139           H        ASP 139 139.964  -1.043   3.630
  461    HA   ASP 139           HA       ASP 139 139.307  -2.899   5.675
  462   1HB   ASP 139          2HB       ASP 139 139.341  -0.197   5.536
  463   2HB   ASP 139          1HB       ASP 139 137.611  -0.493   5.385
  464    H    GLY 140           H        GLY 140 138.002  -2.418   2.589
  465   1HA   GLY 140          2HA       GLY 140 135.513  -3.784   3.406
  466   2HA   GLY 140          1HA       GLY 140 135.558  -2.588   2.121
  467    H    ASP 141           H        ASP 141 138.246  -3.763   1.280
  468    HA   ASP 141           HA       ASP 141 137.216  -5.518  -0.695
  469   1HB   ASP 141          2HB       ASP 141 139.461  -3.997  -0.497
  470   2HB   ASP 141          1HB       ASP 141 140.123  -5.599  -0.186
  471    H    LYS 142           H        LYS 142 136.185  -7.158   0.560
  472    HA   LYS 142           HA       LYS 142 137.749  -8.844   2.289
  473   1HB   LYS 142          2HB       LYS 142 134.984  -9.331   1.167
  474   2HB   LYS 142          1HB       LYS 142 135.719 -10.153   2.535
  475   1HG   LYS 142          2HG       LYS 142 135.103  -7.208   2.447
  476   2HG   LYS 142          1HG       LYS 142 134.064  -8.434   3.179
  477   1HD   LYS 142          2HD       LYS 142 136.900  -8.388   4.034
  478   2HD   LYS 142          1HD       LYS 142 135.881  -7.052   4.572
  479   1HE   LYS 142          2HE       LYS 142 134.360  -8.537   5.641
  480   2HE   LYS 142          1HE       LYS 142 135.121  -9.946   4.900
  481   1HZ   LYS 142          1HZ       LYS 142 136.951  -9.787   6.288
  482   2HZ   LYS 142          2HZ       LYS 142 135.675  -9.390   7.323
  483   3HZ   LYS 142          3HZ       LYS 142 136.656  -8.169   6.687
  484    H    ASN 143           H        ASN 143 136.513  -8.979  -1.005
  485    HA   ASN 143           HA       ASN 143 137.456 -11.673  -1.427
  486   1HB   ASN 143          2HB       ASN 143 135.428 -10.902  -2.555
  487   2HB   ASN 143          1HB       ASN 143 136.340  -9.633  -3.363
  488   1HD2  ASN 143          1HD2      ASN 143 137.044 -13.061  -2.810
  489   2HD2  ASN 143          2HD2      ASN 143 137.236 -13.467  -4.478
  490    H    ASN 144           H        ASN 144 138.877  -8.623  -1.430
  491    HA   ASN 144           HA       ASN 144 140.786  -7.735  -2.300
  492   1HB   ASN 144          2HB       ASN 144 141.429  -9.790  -0.772
  493   2HB   ASN 144          1HB       ASN 144 141.999 -10.466  -2.296
  494   1HD2  ASN 144          1HD2      ASN 144 143.469  -9.627   0.096
  495   2HD2  ASN 144          2HD2      ASN 144 144.626  -8.464  -0.447
  496    H    ASP 145           H        ASP 145 139.029  -8.212  -4.350
  497    HA   ASP 145           HA       ASP 145 140.677  -9.399  -6.476
  498   1HB   ASP 145          2HB       ASP 145 138.575  -9.495  -7.790
  499   2HB   ASP 145          1HB       ASP 145 138.484 -10.415  -6.291
  500    H    GLY 146           H        GLY 146 140.572  -6.540  -5.203
  501   1HA   GLY 146          2HA       GLY 146 141.473  -4.617  -6.246
  502   2HA   GLY 146          1HA       GLY 146 140.852  -5.189  -7.785
  503    H    ARG 147           H        ARG 147 138.230  -5.740  -6.214
  504    HA   ARG 147           HA       ARG 147 137.310  -3.001  -5.819
  505   1HB   ARG 147          2HB       ARG 147 135.941  -4.882  -7.748
  506   2HB   ARG 147          1HB       ARG 147 135.430  -3.250  -7.340
  507   1HG   ARG 147          2HG       ARG 147 137.684  -2.490  -8.247
  508   2HG   ARG 147          1HG       ARG 147 137.823  -4.113  -8.928
  509   1HD   ARG 147          2HD       ARG 147 135.237  -2.949  -9.493
  510   2HD   ARG 147          1HD       ARG 147 136.545  -1.913 -10.065
  511    HE   ARG 147           HE       ARG 147 137.080  -4.555 -10.840
  512   1HH1  ARG 147          1HH1      ARG 147 134.835  -1.975 -11.535
  513   2HH1  ARG 147          2HH1      ARG 147 134.555  -2.489 -13.165
  514   1HH2  ARG 147          1HH2      ARG 147 136.712  -5.234 -12.982
  515   2HH2  ARG 147          2HH2      ARG 147 135.619  -4.342 -13.987
  516    H    ILE 148           H        ILE 148 135.207  -2.872  -4.794
  517    HA   ILE 148           HA       ILE 148 134.649  -5.267  -3.178
  518    HB   ILE 148           HB       ILE 148 133.980  -2.388  -2.548
  519   1HG1  ILE 148          2HG1      ILE 148 135.973  -4.017  -1.022
  520   2HG1  ILE 148          1HG1      ILE 148 136.466  -3.262  -2.533
  521   1HG2  ILE 148          1HG2      ILE 148 133.820  -4.822  -0.776
  522   2HG2  ILE 148          2HG2      ILE 148 132.441  -4.075  -1.582
  523   3HG2  ILE 148          3HG2      ILE 148 133.344  -3.174  -0.365
  524   1HD1  ILE 148          1HD1      ILE 148 135.307  -1.164  -1.331
  525   2HD1  ILE 148          2HD1      ILE 148 137.017  -1.571  -1.160
  526   3HD1  ILE 148          3HD1      ILE 148 135.865  -2.060   0.082
  527    H    ASP 149           H        ASP 149 132.711  -6.203  -3.232
  528    HA   ASP 149           HA       ASP 149 130.649  -4.987  -4.933
  529   1HB   ASP 149          2HB       ASP 149 129.707  -7.259  -5.109
  530   2HB   ASP 149          1HB       ASP 149 131.387  -7.213  -5.636
  531    H    TYR 150           H        TYR 150 128.345  -5.767  -4.223
  532    HA   TYR 150           HA       TYR 150 127.774  -4.506  -1.775
  533   1HB   TYR 150          2HB       TYR 150 126.163  -4.691  -3.647
  534   2HB   TYR 150          1HB       TYR 150 126.013  -6.415  -3.324
  535    HD1  TYR 150           HD1      TYR 150 126.038  -3.420  -1.080
  536    HD2  TYR 150           HD2      TYR 150 123.916  -6.845  -2.450
  537    HE1  TYR 150           HE1      TYR 150 124.247  -2.952   0.537
  538    HE2  TYR 150           HE2      TYR 150 122.120  -6.384  -0.836
  539    HH   TYR 150           HH       TYR 150 121.221  -4.566   0.448
  540    H    ASP 151           H        ASP 151 128.448  -7.831  -2.562
  541    HA   ASP 151           HA       ASP 151 127.341  -9.039  -0.271
  542   1HB   ASP 151          2HB       ASP 151 129.809 -10.056  -1.670
  543   2HB   ASP 151          1HB       ASP 151 128.548 -10.983  -0.863
  544    H    GLU 152           H        GLU 152 130.726  -8.141  -0.937
  545    HA   GLU 152           HA       GLU 152 131.524  -8.637   1.765
  546   1HB   GLU 152          2HB       GLU 152 133.673  -7.479   0.969
  547   2HB   GLU 152          1HB       GLU 152 133.226  -9.001   0.213
  548   1HG   GLU 152          2HG       GLU 152 132.481  -7.921  -1.747
  549   2HG   GLU 152          1HG       GLU 152 132.538  -6.335  -0.979
  550    H    PHE 153           H        PHE 153 130.640  -5.755  -0.068
  551    HA   PHE 153           HA       PHE 153 131.585  -3.867   1.811
  552   1HB   PHE 153          2HB       PHE 153 130.518  -3.689  -0.690
  553   2HB   PHE 153          1HB       PHE 153 129.185  -3.091   0.289
  554    HD1  PHE 153           HD1      PHE 153 131.478  -1.869  -1.720
  555    HD2  PHE 153           HD2      PHE 153 130.521  -1.647   2.422
  556    HE1  PHE 153           HE1      PHE 153 132.582   0.324  -1.586
  557    HE2  PHE 153           HE2      PHE 153 131.622   0.548   2.562
  558    HZ   PHE 153           HZ       PHE 153 132.654   1.538   0.557
  559    H    LEU 154           H        LEU 154 128.576  -5.664   1.560
  560    HA   LEU 154           HA       LEU 154 126.937  -4.244   3.261
  561   1HB   LEU 154          2HB       LEU 154 127.193  -7.108   2.531
  562   2HB   LEU 154          1HB       LEU 154 126.240  -6.743   3.957
  563    HG   LEU 154           HG       LEU 154 125.733  -5.786   1.142
  564   1HD1  LEU 154          1HD1      LEU 154 123.588  -6.985   1.484
  565   2HD1  LEU 154          2HD1      LEU 154 124.222  -7.595   3.013
  566   3HD1  LEU 154          3HD1      LEU 154 125.003  -8.040   1.494
  567   1HD2  LEU 154          1HD2      LEU 154 125.003  -3.936   2.235
  568   2HD2  LEU 154          2HD2      LEU 154 124.733  -4.799   3.749
  569   3HD2  LEU 154          3HD2      LEU 154 123.573  -4.950   2.429
  570    H    GLU 155           H        GLU 155 129.707  -6.207   4.033
  571    HA   GLU 155           HA       GLU 155 129.163  -6.302   6.861
  572   1HB   GLU 155          2HB       GLU 155 131.348  -7.235   5.064
  573   2HB   GLU 155          1HB       GLU 155 131.740  -6.988   6.761
  574   1HG   GLU 155          2HG       GLU 155 130.059  -8.558   7.438
  575   2HG   GLU 155          1HG       GLU 155 129.482  -8.717   5.780
  576    H    PHE 156           H        PHE 156 130.785  -4.159   4.672
  577    HA   PHE 156           HA       PHE 156 132.597  -2.873   6.319
  578   1HB   PHE 156          2HB       PHE 156 131.775  -2.499   3.773
  579   2HB   PHE 156          1HB       PHE 156 130.988  -1.127   4.543
  580    HD1  PHE 156           HD1      PHE 156 133.767  -2.002   2.768
  581    HD2  PHE 156           HD2      PHE 156 132.707   0.044   6.345
  582    HE1  PHE 156           HE1      PHE 156 135.874  -0.734   2.668
  583    HE2  PHE 156           HE2      PHE 156 134.811   1.311   6.252
  584    HZ   PHE 156           HZ       PHE 156 136.398   0.924   4.410
  585    H    MET 157           H        MET 157 129.134  -2.788   6.385
  586    HA   MET 157           HA       MET 157 129.159  -0.539   8.268
  587   1HB   MET 157          2HB       MET 157 126.858  -1.891   6.849
  588   2HB   MET 157          1HB       MET 157 126.696  -0.543   7.966
  589   1HG   MET 157          2HG       MET 157 128.165  -0.506   5.339
  590   2HG   MET 157          1HG       MET 157 126.587   0.209   5.665
  591   1HE   MET 157          1HE       MET 157 128.422   1.849   4.261
  592   2HE   MET 157          2HE       MET 157 130.015   1.460   4.912
  593   3HE   MET 157          3HE       MET 157 129.342   3.075   5.136
  594    H    LYS 158           H        LYS 158 129.998  -3.373   8.854
  595    HA   LYS 158           HA       LYS 158 127.967  -4.447  10.568
  596   1HB   LYS 158          2HB       LYS 158 130.713  -5.204   9.775
  597   2HB   LYS 158          1HB       LYS 158 130.184  -5.769  11.352
  598   1HG   LYS 158          2HG       LYS 158 128.669  -6.228   8.794
  599   2HG   LYS 158          1HG       LYS 158 129.786  -7.386   9.520
  600   1HD   LYS 158          2HD       LYS 158 128.386  -7.321  11.589
  601   2HD   LYS 158          1HD       LYS 158 127.223  -6.329  10.707
  602   1HE   LYS 158          2HE       LYS 158 127.401  -8.312   8.966
  603   2HE   LYS 158          1HE       LYS 158 127.890  -9.212  10.402
  604   1HZ   LYS 158          1HZ       LYS 158 125.734  -7.933  11.310
  605   2HZ   LYS 158          2HZ       LYS 158 125.684  -9.480  10.629
  606   3HZ   LYS 158          3HZ       LYS 158 125.295  -8.131   9.687
  607    H    GLY 159           H        GLY 159 129.424  -1.680  11.056
  608   1HA   GLY 159          2HA       GLY 159 129.053  -0.759  13.313
  609   2HA   GLY 159          1HA       GLY 159 129.850  -2.194  13.933
  610    H    VAL 160           H        VAL 160 131.526  -1.388  11.215
  611    HA   VAL 160           HA       VAL 160 133.891  -0.747  12.398
  612    HB   VAL 160           HB       VAL 160 134.589   0.293  10.281
  613   1HG1  VAL 160          1HG1      VAL 160 133.202  -2.307  10.430
  614   2HG1  VAL 160          2HG1      VAL 160 134.866  -1.929   9.987
  615   3HG1  VAL 160          3HG1      VAL 160 133.570  -1.709   8.812
  616   1HG2  VAL 160          1HG2      VAL 160 132.664   1.577   9.696
  617   2HG2  VAL 160          2HG2      VAL 160 131.653   0.133   9.621
  618   3HG2  VAL 160          3HG2      VAL 160 132.919   0.388   8.418
  619    H    GLU 161           H        GLU 161 131.389   1.546  11.357
  620    HA   GLU 161           HA       GLU 161 132.568   3.538  13.158
  621   1HB   GLU 161          2HB       GLU 161 132.251   5.309  11.517
  622   2HB   GLU 161          1HB       GLU 161 133.322   4.068  10.878
  623   1HG   GLU 161          2HG       GLU 161 131.785   3.338   9.339
  624   2HG   GLU 161          1HG       GLU 161 130.411   3.928  10.270
  Start of MODEL    8
    1   1H    MET  81          1HT       MET  81  98.303 -12.291  21.524
    2   2H    MET  81          2HT       MET  81  99.713 -13.136  21.033
    3   3H    MET  81          3HT       MET  81  98.918 -13.566  22.492
    4    HA   MET  81           HA       MET  81  98.295 -15.176  21.013
    5   1HB   MET  81          2HB       MET  81  96.458 -14.155  22.303
    6   2HB   MET  81          1HB       MET  81  96.176 -13.015  20.995
    7   1HG   MET  81          2HG       MET  81  95.092 -14.523  19.725
    8   2HG   MET  81          1HG       MET  81  96.111 -15.862  20.253
    9   1HE   MET  81          1HE       MET  81  95.289 -17.650  22.092
   10   2HE   MET  81          2HE       MET  81  94.549 -17.004  23.557
   11   3HE   MET  81          3HE       MET  81  96.082 -16.350  22.982
   12    H    VAL  82           H        VAL  82  97.375 -12.091  19.466
   13    HA   VAL  82           HA       VAL  82  97.540 -13.321  16.844
   14    HB   VAL  82           HB       VAL  82  96.988 -10.424  17.491
   15   1HG1  VAL  82          1HG1      VAL  82  96.104 -10.253  15.313
   16   2HG1  VAL  82          2HG1      VAL  82  96.112 -12.003  15.087
   17   3HG1  VAL  82          3HG1      VAL  82  97.634 -11.114  15.137
   18   1HG2  VAL  82          1HG2      VAL  82  94.561 -11.429  16.912
   19   2HG2  VAL  82          2HG2      VAL  82  95.184 -11.275  18.554
   20   3HG2  VAL  82          3HG2      VAL  82  95.283 -12.824  17.714
   21    H    ARG  83           H        ARG  83  99.277 -13.286  15.580
   22    HA   ARG  83           HA       ARG  83 101.256 -11.146  15.921
   23   1HB   ARG  83          2HB       ARG  83 103.083 -12.806  15.698
   24   2HB   ARG  83          1HB       ARG  83 102.142 -13.021  17.168
   25   1HG   ARG  83          2HG       ARG  83 100.812 -14.740  15.722
   26   2HG   ARG  83          1HG       ARG  83 102.274 -14.734  14.733
   27   1HD   ARG  83          2HD       ARG  83 103.614 -15.373  16.634
   28   2HD   ARG  83          1HD       ARG  83 102.220 -15.242  17.705
   29    HE   ARG  83           HE       ARG  83 101.772 -17.099  15.588
   30   1HH1  ARG  83          1HH1      ARG  83 103.310 -16.715  18.696
   31   2HH1  ARG  83          2HH1      ARG  83 103.240 -18.401  19.081
   32   1HH2  ARG  83          1HH2      ARG  83 101.676 -19.319  16.092
   33   2HH2  ARG  83          2HH2      ARG  83 102.312 -19.880  17.603
   34    H    CYS  84           H        CYS  84 101.385 -10.132  14.038
   35    HA   CYS  84           HA       CYS  84 100.995 -11.671  11.565
   36   1HB   CYS  84          2HB       CYS  84 100.456  -8.849  12.352
   37   2HB   CYS  84          1HB       CYS  84 100.892  -9.160  10.676
   38    HG   CYS  84           HG       CYS  84  98.772 -10.667  10.470
   39    H    MET  85           H        MET  85 102.862  -8.792  12.551
   40    HA   MET  85           HA       MET  85 105.305  -9.985  11.551
   41   1HB   MET  85          2HB       MET  85 103.851  -8.589   9.730
   42   2HB   MET  85          1HB       MET  85 104.837  -7.301  10.411
   43   1HG   MET  85          2HG       MET  85 106.785  -8.170   9.598
   44   2HG   MET  85          1HG       MET  85 106.178  -9.823   9.600
   45   1HE   MET  85          1HE       MET  85 107.390  -7.142   7.773
   46   2HE   MET  85          2HE       MET  85 105.880  -6.310   7.396
   47   3HE   MET  85          3HE       MET  85 106.732  -7.206   6.137
   48    H    LYS  86           H        LYS  86 107.204  -8.804  12.149
   49    HA   LYS  86           HA       LYS  86 106.794  -7.240  14.572
   50   1HB   LYS  86          2HB       LYS  86 109.113  -8.694  13.361
   51   2HB   LYS  86          1HB       LYS  86 109.411  -7.438  14.556
   52   1HG   LYS  86          2HG       LYS  86 108.031  -8.622  16.171
   53   2HG   LYS  86          1HG       LYS  86 107.682  -9.869  14.971
   54   1HD   LYS  86          2HD       LYS  86 110.485  -9.185  15.825
   55   2HD   LYS  86          1HD       LYS  86 109.505 -10.389  16.666
   56   1HE   LYS  86          2HE       LYS  86 110.029 -10.485  13.705
   57   2HE   LYS  86          1HE       LYS  86 111.078 -11.266  14.887
   58   1HZ   LYS  86          1HZ       LYS  86 109.260 -12.665  13.834
   59   2HZ   LYS  86          2HZ       LYS  86 108.173 -11.803  14.802
   60   3HZ   LYS  86          3HZ       LYS  86 109.393 -12.728  15.520
   61    H    ASP  87           H        ASP  87 107.259  -5.119  14.793
   62    HA   ASP  87           HA       ASP  87 108.414  -3.737  12.461
   63   1HB   ASP  87          2HB       ASP  87 105.861  -3.447  13.111
   64   2HB   ASP  87          1HB       ASP  87 106.525  -2.306  14.277
   65    H    ASP  88           H        ASP  88 108.167  -3.896  15.963
   66    HA   ASP  88           HA       ASP  88 110.248  -1.838  16.201
   67   1HB   ASP  88          2HB       ASP  88 108.113  -2.849  18.022
   68   2HB   ASP  88          1HB       ASP  88 109.594  -2.231  18.748
   69    H    SER  89           H        SER  89 111.128  -4.249  15.208
   70    HA   SER  89           HA       SER  89 112.662  -5.310  17.485
   71   1HB   SER  89          2HB       SER  89 112.677  -7.515  16.385
   72   2HB   SER  89          1HB       SER  89 111.033  -6.986  16.741
   73    HG   SER  89           HG       SER  89 110.998  -6.217  14.508
   74    H    LYS  90           H        LYS  90 113.039  -6.205  14.096
   75    HA   LYS  90           HA       LYS  90 115.592  -4.739  14.047
   76   1HB   LYS  90          2HB       LYS  90 115.035  -7.531  13.036
   77   2HB   LYS  90          1HB       LYS  90 116.512  -6.637  12.705
   78   1HG   LYS  90          2HG       LYS  90 115.767  -6.861  15.545
   79   2HG   LYS  90          1HG       LYS  90 116.222  -8.366  14.743
   80   1HD   LYS  90          2HD       LYS  90 118.237  -6.964  13.866
   81   2HD   LYS  90          1HD       LYS  90 117.847  -5.902  15.219
   82   1HE   LYS  90          2HE       LYS  90 117.974  -7.896  16.718
   83   2HE   LYS  90          1HE       LYS  90 118.555  -8.829  15.338
   84   1HZ   LYS  90          1HZ       LYS  90 120.235  -6.773  15.280
   85   2HZ   LYS  90          2HZ       LYS  90 120.544  -8.195  16.139
   86   3HZ   LYS  90          3HZ       LYS  90 119.932  -6.838  16.942
   87    H    GLY  91           H        GLY  91 115.751  -3.353  12.413
   88   1HA   GLY  91          2HA       GLY  91 113.731  -3.078  10.451
   89   2HA   GLY  91          1HA       GLY  91 115.275  -2.239  10.460
   90    H    LYS  92           H        LYS  92 115.285  -2.477   8.151
   91    HA   LYS  92           HA       LYS  92 116.046  -5.191   7.287
   92   1HB   LYS  92          2HB       LYS  92 114.436  -3.066   5.914
   93   2HB   LYS  92          1HB       LYS  92 115.331  -4.243   4.961
   94   1HG   LYS  92          2HG       LYS  92 114.105  -6.056   5.955
   95   2HG   LYS  92          1HG       LYS  92 113.293  -4.948   7.063
   96   1HD   LYS  92          2HD       LYS  92 112.498  -3.764   4.898
   97   2HD   LYS  92          1HD       LYS  92 112.922  -5.285   4.110
   98   1HE   LYS  92          2HE       LYS  92 110.906  -4.830   6.299
   99   2HE   LYS  92          1HE       LYS  92 110.610  -5.398   4.657
  100   1HZ   LYS  92          1HZ       LYS  92 110.583  -7.368   5.754
  101   2HZ   LYS  92          2HZ       LYS  92 111.639  -6.855   6.971
  102   3HZ   LYS  92          3HZ       LYS  92 112.247  -7.286   5.452
  103    H    THR  93           H        THR  93 118.122  -4.099   8.234
  104    HA   THR  93           HA       THR  93 119.505  -2.195   6.660
  105    HB   THR  93           HB       THR  93 120.588  -4.209   8.637
  106    HG1  THR  93           HG1      THR  93 118.975  -2.642   9.389
  107   1HG2  THR  93          1HG2      THR  93 121.872  -1.581   8.141
  108   2HG2  THR  93          2HG2      THR  93 122.173  -2.897   7.006
  109   3HG2  THR  93          3HG2      THR  93 122.570  -3.096   8.712
  110    H    GLU  94           H        GLU  94 119.148  -5.646   6.526
  111    HA   GLU  94           HA       GLU  94 121.420  -6.289   4.993
  112   1HB   GLU  94          2HB       GLU  94 119.951  -8.258   4.240
  113   2HB   GLU  94          1HB       GLU  94 120.313  -8.116   5.955
  114   1HG   GLU  94          2HG       GLU  94 118.152  -7.340   6.454
  115   2HG   GLU  94          1HG       GLU  94 117.790  -7.027   4.757
  116    H    GLU  95           H        GLU  95 118.208  -5.194   4.158
  117    HA   GLU  95           HA       GLU  95 118.887  -5.205   1.311
  118   1HB   GLU  95          2HB       GLU  95 116.266  -4.834   2.759
  119   2HB   GLU  95          1HB       GLU  95 116.447  -4.623   1.023
  120   1HG   GLU  95          2HG       GLU  95 117.550  -7.144   1.879
  121   2HG   GLU  95          1HG       GLU  95 115.870  -6.976   2.386
  122    H    GLU  96           H        GLU  96 118.418  -3.107   4.007
  123    HA   GLU  96           HA       GLU  96 117.924  -0.704   2.567
  124   1HB   GLU  96          2HB       GLU  96 118.583  -1.441   5.368
  125   2HB   GLU  96          1HB       GLU  96 118.918   0.212   4.883
  126   1HG   GLU  96          2HG       GLU  96 116.248  -1.009   4.340
  127   2HG   GLU  96          1HG       GLU  96 116.636  -0.376   5.939
  128    H    LEU  97           H        LEU  97 120.778  -2.498   3.362
  129    HA   LEU  97           HA       LEU  97 122.617  -0.325   3.004
  130   1HB   LEU  97          2HB       LEU  97 122.939  -3.306   3.216
  131   2HB   LEU  97          1HB       LEU  97 124.298  -2.250   2.887
  132    HG   LEU  97           HG       LEU  97 122.549  -1.908   5.313
  133   1HD1  LEU  97          1HD1      LEU  97 125.166  -3.393   5.206
  134   2HD1  LEU  97          2HD1      LEU  97 123.590  -4.184   5.216
  135   3HD1  LEU  97          3HD1      LEU  97 124.090  -3.197   6.589
  136   1HD2  LEU  97          1HD2      LEU  97 125.400  -1.064   4.835
  137   2HD2  LEU  97          2HD2      LEU  97 124.328  -0.576   6.150
  138   3HD2  LEU  97          3HD2      LEU  97 124.012  -0.027   4.504
  139    H    SER  98           H        SER  98 120.818  -2.204   0.856
  140    HA   SER  98           HA       SER  98 122.698  -2.459  -1.261
  141   1HB   SER  98          2HB       SER  98 120.866  -3.187  -2.596
  142   2HB   SER  98          1HB       SER  98 120.550  -3.788  -0.969
  143    HG   SER  98           HG       SER  98 119.003  -2.267  -0.696
  144    H    ASP  99           H        ASP  99 120.006  -0.189  -0.708
  145    HA   ASP  99           HA       ASP  99 120.330   1.358  -2.994
  146   1HB   ASP  99          2HB       ASP  99 118.617   1.397  -0.881
  147   2HB   ASP  99          1HB       ASP  99 119.567   2.844  -0.561
  148    H    LEU 100           H        LEU 100 121.939   1.600   0.138
  149    HA   LEU 100           HA       LEU 100 123.261   4.043  -0.329
  150   1HB   LEU 100          2HB       LEU 100 123.816   1.723   1.498
  151   2HB   LEU 100          1HB       LEU 100 124.882   3.114   1.436
  152    HG   LEU 100           HG       LEU 100 122.200   4.049   1.761
  153   1HD1  LEU 100          1HD1      LEU 100 122.918   2.358   4.097
  154   2HD1  LEU 100          2HD1      LEU 100 122.135   1.591   2.714
  155   3HD1  LEU 100          3HD1      LEU 100 121.341   2.925   3.550
  156   1HD2  LEU 100          1HD2      LEU 100 123.716   5.496   2.614
  157   2HD2  LEU 100          2HD2      LEU 100 124.815   4.216   3.128
  158   3HD2  LEU 100          3HD2      LEU 100 123.391   4.598   4.096
  159    H    PHE 101           H        PHE 101 123.859   0.854  -1.497
  160    HA   PHE 101           HA       PHE 101 126.620   0.983  -1.950
  161   1HB   PHE 101          2HB       PHE 101 125.231  -1.080  -2.141
  162   2HB   PHE 101          1HB       PHE 101 124.577  -0.456  -3.652
  163    HD1  PHE 101           HD1      PHE 101 127.403  -2.039  -2.033
  164    HD2  PHE 101           HD2      PHE 101 126.031  -0.218  -5.625
  165    HE1  PHE 101           HE1      PHE 101 129.301  -3.018  -3.249
  166    HE2  PHE 101           HE2      PHE 101 127.925  -1.199  -6.850
  167    HZ   PHE 101           HZ       PHE 101 129.564  -2.603  -5.662
  168    H    ARG 102           H        ARG 102 123.919   1.798  -4.130
  169    HA   ARG 102           HA       ARG 102 125.417   2.557  -6.340
  170   1HB   ARG 102          2HB       ARG 102 122.703   2.668  -5.542
  171   2HB   ARG 102          1HB       ARG 102 123.135   4.278  -6.100
  172   1HG   ARG 102          2HG       ARG 102 122.270   3.062  -7.952
  173   2HG   ARG 102          1HG       ARG 102 124.009   3.247  -8.192
  174   1HD   ARG 102          2HD       ARG 102 123.633   1.020  -8.738
  175   2HD   ARG 102          1HD       ARG 102 124.186   0.935  -7.065
  176    HE   ARG 102           HE       ARG 102 122.116   0.167  -6.451
  177   1HH1  ARG 102          1HH1      ARG 102 121.934   1.464  -9.686
  178   2HH1  ARG 102          2HH1      ARG 102 120.330   0.876  -9.964
  179   1HH2  ARG 102          1HH2      ARG 102 120.007  -0.607  -6.816
  180   2HH2  ARG 102          2HH2      ARG 102 119.234  -0.300  -8.336
  181    H    MET 103           H        MET 103 124.723   4.307  -3.395
  182    HA   MET 103           HA       MET 103 125.455   6.884  -4.298
  183   1HB   MET 103          2HB       MET 103 125.145   5.582  -1.626
  184   2HB   MET 103          1HB       MET 103 125.945   7.145  -1.718
  185   1HG   MET 103          2HG       MET 103 123.532   7.199  -3.260
  186   2HG   MET 103          1HG       MET 103 123.194   6.611  -1.633
  187   1HE   MET 103          1HE       MET 103 124.207  10.213  -3.565
  188   2HE   MET 103          2HE       MET 103 122.693  10.559  -2.730
  189   3HE   MET 103          3HE       MET 103 122.844   9.104  -3.714
  190    H    PHE 104           H        PHE 104 127.290   4.156  -3.124
  191    HA   PHE 104           HA       PHE 104 129.717   5.624  -2.708
  192   1HB   PHE 104          2HB       PHE 104 128.768   2.994  -2.174
  193   2HB   PHE 104          1HB       PHE 104 130.253   2.849  -3.108
  194    HD1  PHE 104           HD1      PHE 104 132.347   3.855  -2.251
  195    HD2  PHE 104           HD2      PHE 104 128.789   3.719   0.077
  196    HE1  PHE 104           HE1      PHE 104 133.667   4.279  -0.219
  197    HE2  PHE 104           HE2      PHE 104 130.102   4.143   2.114
  198    HZ   PHE 104           HZ       PHE 104 132.543   4.422   1.968
  199    H    ASP 105           H        ASP 105 128.198   4.078  -5.412
  200    HA   ASP 105           HA       ASP 105 130.644   3.996  -6.973
  201   1HB   ASP 105          2HB       ASP 105 128.432   2.443  -7.035
  202   2HB   ASP 105          1HB       ASP 105 128.033   3.588  -8.312
  203    H    LYS 106           H        LYS 106 131.209   5.380  -8.583
  204    HA   LYS 106           HA       LYS 106 129.574   7.807  -8.843
  205   1HB   LYS 106          2HB       LYS 106 132.494   7.263  -8.924
  206   2HB   LYS 106          1HB       LYS 106 131.890   8.542  -9.968
  207   1HG   LYS 106          2HG       LYS 106 130.904   8.647  -7.209
  208   2HG   LYS 106          1HG       LYS 106 132.644   8.878  -7.389
  209   1HD   LYS 106          2HD       LYS 106 132.339  10.732  -8.834
  210   2HD   LYS 106          1HD       LYS 106 130.620  10.386  -9.028
  211   1HE   LYS 106          2HE       LYS 106 130.310  10.855  -6.609
  212   2HE   LYS 106          1HE       LYS 106 132.006  11.327  -6.520
  213   1HZ   LYS 106          1HZ       LYS 106 131.550  13.063  -8.160
  214   2HZ   LYS 106          2HZ       LYS 106 130.601  13.257  -6.774
  215   3HZ   LYS 106          3HZ       LYS 106 129.916  12.626  -8.184
  216    H    ASN 107           H        ASN 107 131.449   5.470 -10.746
  217    HA   ASN 107           HA       ASN 107 130.379   6.544 -13.227
  218   1HB   ASN 107          2HB       ASN 107 131.835   4.892 -14.320
  219   2HB   ASN 107          1HB       ASN 107 132.730   5.874 -13.164
  220   1HD2  ASN 107          1HD2      ASN 107 133.025   3.079 -14.306
  221   2HD2  ASN 107          2HD2      ASN 107 133.285   2.089 -12.915
  222    H    ALA 108           H        ALA 108 129.007   4.744 -10.981
  223    HA   ALA 108           HA       ALA 108 127.530   2.997 -10.871
  224   1HB   ALA 108          1HB       ALA 108 125.728   3.221 -12.640
  225   2HB   ALA 108          2HB       ALA 108 126.683   4.557 -13.285
  226   3HB   ALA 108          3HB       ALA 108 126.051   4.637 -11.640
  227    H    ASP 109           H        ASP 109 128.612   1.111 -11.101
  228    HA   ASP 109           HA       ASP 109 128.355  -0.202 -13.702
  229   1HB   ASP 109          2HB       ASP 109 130.641  -1.198 -13.421
  230   2HB   ASP 109          1HB       ASP 109 130.646   0.536 -13.730
  231    H    GLY 110           H        GLY 110 129.059  -0.465 -10.262
  232   1HA   GLY 110          2HA       GLY 110 127.369  -2.112  -9.223
  233   2HA   GLY 110          1HA       GLY 110 128.140  -3.263 -10.301
  234    H    TYR 111           H        TYR 111 130.668  -1.474  -9.647
  235    HA   TYR 111           HA       TYR 111 131.232  -2.616  -7.003
  236   1HB   TYR 111          2HB       TYR 111 133.103  -2.801  -9.376
  237   2HB   TYR 111          1HB       TYR 111 133.428  -3.387  -7.748
  238    HD1  TYR 111           HD1      TYR 111 132.773  -5.548  -7.101
  239    HD2  TYR 111           HD2      TYR 111 131.202  -3.870 -10.681
  240    HE1  TYR 111           HE1      TYR 111 131.796  -7.728  -7.688
  241    HE2  TYR 111           HE2      TYR 111 130.221  -6.046 -11.278
  242    HH   TYR 111           HH       TYR 111 129.554  -8.336  -9.412
  243    H    ILE 112           H        ILE 112 132.942  -1.558  -5.851
  244    HA   ILE 112           HA       ILE 112 133.366   1.206  -6.769
  245    HB   ILE 112           HB       ILE 112 133.570   0.171  -3.941
  246   1HG1  ILE 112          2HG1      ILE 112 131.352   1.969  -4.702
  247   2HG1  ILE 112          1HG1      ILE 112 131.246   0.330  -5.336
  248   1HG2  ILE 112          1HG2      ILE 112 134.883   2.153  -4.282
  249   2HG2  ILE 112          2HG2      ILE 112 133.436   2.582  -3.373
  250   3HG2  ILE 112          3HG2      ILE 112 133.540   2.954  -5.094
  251   1HD1  ILE 112          1HD1      ILE 112 131.259  -0.600  -3.155
  252   2HD1  ILE 112          2HD1      ILE 112 130.083   0.715  -3.160
  253   3HD1  ILE 112          3HD1      ILE 112 131.671   0.954  -2.429
  254    H    ASP 113           H        ASP 113 135.333   1.675  -7.467
  255    HA   ASP 113           HA       ASP 113 137.601   0.065  -6.510
  256   1HB   ASP 113          2HB       ASP 113 136.878   0.396  -9.064
  257   2HB   ASP 113          1HB       ASP 113 137.884   1.831  -8.887
  258    H    LEU 114           H        LEU 114 139.750   1.431  -6.788
  259    HA   LEU 114           HA       LEU 114 139.783   3.331  -4.759
  260   1HB   LEU 114          2HB       LEU 114 141.656   2.136  -6.538
  261   2HB   LEU 114          1HB       LEU 114 141.935   3.867  -6.549
  262    HG   LEU 114           HG       LEU 114 141.746   3.418  -3.879
  263   1HD1  LEU 114          1HD1      LEU 114 141.630   0.906  -4.602
  264   2HD1  LEU 114          2HD1      LEU 114 142.602   1.395  -3.214
  265   3HD1  LEU 114          3HD1      LEU 114 143.377   1.087  -4.769
  266   1HD2  LEU 114          1HD2      LEU 114 143.565   4.646  -4.424
  267   2HD2  LEU 114          2HD2      LEU 114 143.957   3.648  -5.825
  268   3HD2  LEU 114          3HD2      LEU 114 144.386   3.101  -4.204
  269    H    GLU 115           H        GLU 115 139.380   3.734  -8.229
  270    HA   GLU 115           HA       GLU 115 139.753   6.507  -8.380
  271   1HB   GLU 115          2HB       GLU 115 138.412   4.450 -10.052
  272   2HB   GLU 115          1HB       GLU 115 137.968   6.127 -10.347
  273   1HG   GLU 115          2HG       GLU 115 140.316   6.685 -10.719
  274   2HG   GLU 115          1HG       GLU 115 140.762   5.004 -10.421
  275    H    GLU 116           H        GLU 116 136.793   4.610  -7.853
  276    HA   GLU 116           HA       GLU 116 134.987   6.739  -7.771
  277   1HB   GLU 116          2HB       GLU 116 135.003   3.970  -6.645
  278   2HB   GLU 116          1HB       GLU 116 133.737   5.082  -6.144
  279   1HG   GLU 116          2HG       GLU 116 132.876   3.832  -7.950
  280   2HG   GLU 116          1HG       GLU 116 133.227   5.444  -8.571
  281    H    LEU 117           H        LEU 117 136.765   5.176  -5.119
  282    HA   LEU 117           HA       LEU 117 135.729   6.797  -3.059
  283   1HB   LEU 117          2HB       LEU 117 138.468   5.553  -3.039
  284   2HB   LEU 117          1HB       LEU 117 137.423   5.889  -1.671
  285    HG   LEU 117           HG       LEU 117 137.019   3.754  -3.766
  286   1HD1  LEU 117          1HD1      LEU 117 137.244   2.244  -1.824
  287   2HD1  LEU 117          2HD1      LEU 117 137.648   3.635  -0.821
  288   3HD1  LEU 117          3HD1      LEU 117 138.708   3.169  -2.151
  289   1HD2  LEU 117          1HD2      LEU 117 134.862   4.625  -3.188
  290   2HD2  LEU 117          2HD2      LEU 117 135.261   4.604  -1.470
  291   3HD2  LEU 117          3HD2      LEU 117 135.080   3.088  -2.352
  292    H    LYS 118           H        LYS 118 138.573   7.116  -5.126
  293    HA   LYS 118           HA       LYS 118 139.787   9.280  -3.841
  294   1HB   LYS 118          2HB       LYS 118 140.175   7.800  -6.219
  295   2HB   LYS 118          1HB       LYS 118 140.125   9.494  -6.686
  296   1HG   LYS 118          2HG       LYS 118 141.828   9.919  -4.877
  297   2HG   LYS 118          1HG       LYS 118 141.991   8.166  -4.741
  298   1HD   LYS 118          2HD       LYS 118 142.776   7.978  -6.973
  299   2HD   LYS 118          1HD       LYS 118 142.325   9.643  -7.343
  300   1HE   LYS 118          2HE       LYS 118 144.010   9.972  -5.222
  301   2HE   LYS 118          1HE       LYS 118 144.723   8.581  -6.037
  302   1HZ   LYS 118          1HZ       LYS 118 145.256  11.092  -6.701
  303   2HZ   LYS 118          2HZ       LYS 118 143.953  10.807  -7.742
  304   3HZ   LYS 118          3HZ       LYS 118 145.322   9.815  -7.807
  305    H    ILE 119           H        ILE 119 137.014   9.136  -5.935
  306    HA   ILE 119           HA       ILE 119 136.982  12.013  -6.352
  307    HB   ILE 119           HB       ILE 119 134.895   9.990  -7.168
  308   1HG1  ILE 119          2HG1      ILE 119 136.890  11.142  -9.075
  309   2HG1  ILE 119          1HG1      ILE 119 137.378   9.794  -8.053
  310   1HG2  ILE 119          1HG2      ILE 119 134.399  11.777  -8.887
  311   2HG2  ILE 119          2HG2      ILE 119 135.420  12.851  -7.930
  312   3HG2  ILE 119          3HG2      ILE 119 133.961  12.156  -7.221
  313   1HD1  ILE 119          1HD1      ILE 119 134.987   9.763  -9.876
  314   2HD1  ILE 119          2HD1      ILE 119 135.654   8.407  -8.967
  315   3HD1  ILE 119          3HD1      ILE 119 136.576   9.120 -10.290
  316    H    MET 120           H        MET 120 135.078   9.544  -4.670
  317    HA   MET 120           HA       MET 120 133.078  11.264  -3.690
  318   1HB   MET 120          2HB       MET 120 132.912   8.786  -3.759
  319   2HB   MET 120          1HB       MET 120 134.082   8.697  -2.451
  320   1HG   MET 120          2HG       MET 120 132.338  10.290  -1.267
  321   2HG   MET 120          1HG       MET 120 131.234   9.517  -2.403
  322   1HE   MET 120          1HE       MET 120 133.633   7.728   0.980
  323   2HE   MET 120          2HE       MET 120 134.153   8.940  -0.192
  324   3HE   MET 120          3HE       MET 120 134.306   7.224  -0.570
  325    H    LEU 121           H        LEU 121 136.322  10.630  -2.616
  326    HA   LEU 121           HA       LEU 121 135.891  11.791   0.001
  327   1HB   LEU 121          2HB       LEU 121 138.178  10.531  -1.426
  328   2HB   LEU 121          1HB       LEU 121 138.542  11.629  -0.109
  329    HG   LEU 121           HG       LEU 121 136.890   9.110   0.068
  330   1HD1  LEU 121          1HD1      LEU 121 138.923   8.888   1.856
  331   2HD1  LEU 121          2HD1      LEU 121 139.707   9.765   0.542
  332   3HD1  LEU 121          3HD1      LEU 121 138.936   8.209   0.228
  333   1HD2  LEU 121          1HD2      LEU 121 137.334   9.841   2.622
  334   2HD2  LEU 121          2HD2      LEU 121 135.869  10.246   1.727
  335   3HD2  LEU 121          3HD2      LEU 121 137.173  11.427   1.866
  336    H    GLN 122           H        GLN 122 137.727  12.659  -2.928
  337    HA   GLN 122           HA       GLN 122 138.685  15.123  -2.025
  338   1HB   GLN 122          2HB       GLN 122 139.035  15.674  -4.367
  339   2HB   GLN 122          1HB       GLN 122 139.493  14.004  -4.062
  340   1HG   GLN 122          2HG       GLN 122 137.263  13.316  -4.932
  341   2HG   GLN 122          1HG       GLN 122 136.990  14.996  -5.394
  342   1HE2  GLN 122          1HE2      GLN 122 137.020  14.892  -7.553
  343   2HE2  GLN 122          2HE2      GLN 122 138.340  14.300  -8.499
  344    H    ALA 123           H        ALA 123 135.699  14.292  -3.712
  345    HA   ALA 123           HA       ALA 123 134.683  16.833  -4.160
  346   1HB   ALA 123          1HB       ALA 123 133.336  15.356  -5.194
  347   2HB   ALA 123          2HB       ALA 123 132.418  15.436  -3.690
  348   3HB   ALA 123          3HB       ALA 123 133.563  14.121  -3.956
  349    H    THR 124           H        THR 124 135.009  15.108  -1.171
  350    HA   THR 124           HA       THR 124 133.015  16.582   0.263
  351    HB   THR 124           HB       THR 124 133.734  15.424   2.184
  352    HG1  THR 124           HG1      THR 124 135.783  14.469   2.328
  353   1HG2  THR 124          1HG2      THR 124 133.043  13.965   0.092
  354   2HG2  THR 124          2HG2      THR 124 133.551  13.238   1.617
  355   3HG2  THR 124          3HG2      THR 124 134.693  13.370   0.279
  356    H    GLY 125           H        GLY 125 133.885  17.665   2.428
  357   1HA   GLY 125          2HA       GLY 125 135.577  19.861   1.511
  358   2HA   GLY 125          1HA       GLY 125 134.590  19.846   2.965
  359    H    GLU 126           H        GLU 126 136.481  17.040   2.513
  360    HA   GLU 126           HA       GLU 126 138.439  18.047   4.470
  361   1HB   GLU 126          2HB       GLU 126 137.316  15.265   4.113
  362   2HB   GLU 126          1HB       GLU 126 138.660  15.652   5.179
  363   1HG   GLU 126          2HG       GLU 126 136.729  17.448   5.945
  364   2HG   GLU 126          1HG       GLU 126 135.804  15.996   5.573
  365    H    THR 127           H        THR 127 140.557  16.880   4.415
  366    HA   THR 127           HA       THR 127 141.356  16.435   1.619
  367    HB   THR 127           HB       THR 127 143.688  16.937   2.540
  368    HG1  THR 127           HG1      THR 127 142.972  16.695   4.772
  369   1HG2  THR 127          1HG2      THR 127 143.317  19.393   2.666
  370   2HG2  THR 127          2HG2      THR 127 141.584  19.081   2.564
  371   3HG2  THR 127          3HG2      THR 127 142.643  18.622   1.231
  372    H    ILE 128           H        ILE 128 142.003  14.474   1.029
  373    HA   ILE 128           HA       ILE 128 142.936  12.610   3.109
  374    HB   ILE 128           HB       ILE 128 141.288  11.751   0.739
  375   1HG1  ILE 128          2HG1      ILE 128 139.536  11.389   2.662
  376   2HG1  ILE 128          1HG1      ILE 128 140.448  12.660   3.469
  377   1HG2  ILE 128          1HG2      ILE 128 142.911  10.265   2.262
  378   2HG2  ILE 128          2HG2      ILE 128 141.417   9.646   1.558
  379   3HG2  ILE 128          3HG2      ILE 128 141.444  10.183   3.238
  380   1HD1  ILE 128          1HD1      ILE 128 139.772  13.313   0.717
  381   2HD1  ILE 128          2HD1      ILE 128 139.550  14.247   2.197
  382   3HD1  ILE 128          3HD1      ILE 128 138.363  13.027   1.737
  383    H    THR 129           H        THR 129 144.754  11.508   2.652
  384    HA   THR 129           HA       THR 129 146.235  12.211   0.297
  385    HB   THR 129           HB       THR 129 147.850  10.432   1.321
  386    HG1  THR 129           HG1      THR 129 147.460  10.017   3.483
  387   1HG2  THR 129          1HG2      THR 129 147.623  13.127   1.702
  388   2HG2  THR 129          2HG2      THR 129 148.945  12.113   2.281
  389   3HG2  THR 129          3HG2      THR 129 147.598  12.501   3.351
  390    H    GLU 130           H        GLU 130 147.294  10.542  -1.068
  391    HA   GLU 130           HA       GLU 130 145.359   8.896  -2.292
  392   1HB   GLU 130          2HB       GLU 130 147.866   9.875  -2.965
  393   2HB   GLU 130          1HB       GLU 130 148.109   8.136  -2.883
  394   1HG   GLU 130          2HG       GLU 130 147.026   7.796  -4.790
  395   2HG   GLU 130          1HG       GLU 130 145.683   8.829  -4.305
  396    H    ASP 131           H        ASP 131 147.789   8.298   0.144
  397    HA   ASP 131           HA       ASP 131 147.865   5.490  -0.005
  398   1HB   ASP 131          2HB       ASP 131 149.357   7.183   1.328
  399   2HB   ASP 131          1HB       ASP 131 148.175   6.927   2.606
  400    H    ASP 132           H        ASP 132 145.797   7.698   1.828
  401    HA   ASP 132           HA       ASP 132 144.462   5.815   3.398
  402   1HB   ASP 132          2HB       ASP 132 144.362   8.510   3.192
  403   2HB   ASP 132          1HB       ASP 132 142.853   8.086   2.387
  404    H    ILE 133           H        ILE 133 143.826   6.928   0.108
  405    HA   ILE 133           HA       ILE 133 141.346   5.677  -0.270
  406    HB   ILE 133           HB       ILE 133 143.449   6.092  -2.397
  407   1HG1  ILE 133          2HG1      ILE 133 143.135   8.185  -1.209
  408   2HG1  ILE 133          1HG1      ILE 133 142.343   8.286  -2.777
  409   1HG2  ILE 133          1HG2      ILE 133 141.060   4.814  -2.600
  410   2HG2  ILE 133          2HG2      ILE 133 141.871   5.642  -3.930
  411   3HG2  ILE 133          3HG2      ILE 133 140.607   6.468  -3.019
  412   1HD1  ILE 133          1HD1      ILE 133 141.249   8.700  -0.190
  413   2HD1  ILE 133          2HD1      ILE 133 140.430   7.331  -0.940
  414   3HD1  ILE 133          3HD1      ILE 133 140.479   8.890  -1.765
  415    H    GLU 134           H        GLU 134 144.598   4.426  -0.333
  416    HA   GLU 134           HA       GLU 134 143.950   1.973  -1.658
  417   1HB   GLU 134          2HB       GLU 134 146.298   3.302  -0.874
  418   2HB   GLU 134          1HB       GLU 134 146.298   1.784   0.014
  419   1HG   GLU 134          2HG       GLU 134 146.325   0.506  -1.928
  420   2HG   GLU 134          1HG       GLU 134 145.771   1.846  -2.930
  421    H    GLU 135           H        GLU 135 144.479   2.915   1.723
  422    HA   GLU 135           HA       GLU 135 144.033   0.312   2.775
  423   1HB   GLU 135          2HB       GLU 135 144.093   3.061   3.998
  424   2HB   GLU 135          1HB       GLU 135 143.701   1.637   4.953
  425   1HG   GLU 135          2HG       GLU 135 145.956   0.767   3.840
  426   2HG   GLU 135          1HG       GLU 135 146.280   2.499   3.795
  427    H    LEU 136           H        LEU 136 141.960   2.955   1.892
  428    HA   LEU 136           HA       LEU 136 139.698   2.399   3.415
  429   1HB   LEU 136          2HB       LEU 136 140.366   4.153   1.372
  430   2HB   LEU 136          1HB       LEU 136 139.057   3.205   0.693
  431    HG   LEU 136           HG       LEU 136 137.906   3.777   3.013
  432   1HD1  LEU 136          1HD1      LEU 136 140.173   5.656   2.795
  433   2HD1  LEU 136          2HD1      LEU 136 139.328   5.052   4.221
  434   3HD1  LEU 136          3HD1      LEU 136 138.616   6.345   3.254
  435   1HD2  LEU 136          1HD2      LEU 136 137.279   6.059   1.755
  436   2HD2  LEU 136          2HD2      LEU 136 136.660   4.482   1.260
  437   3HD2  LEU 136          3HD2      LEU 136 138.041   5.192   0.422
  438    H    MET 137           H        MET 137 140.688   1.082   0.276
  439    HA   MET 137           HA       MET 137 138.362  -0.559  -0.003
  440   1HB   MET 137          2HB       MET 137 140.986  -0.957  -1.430
  441   2HB   MET 137          1HB       MET 137 139.376  -1.403  -1.977
  442   1HG   MET 137          2HG       MET 137 139.318   1.369  -1.537
  443   2HG   MET 137          1HG       MET 137 140.824   1.029  -2.384
  444   1HE   MET 137          1HE       MET 137 136.572   0.784  -3.474
  445   2HE   MET 137          2HE       MET 137 137.303   0.047  -2.050
  446   3HE   MET 137          3HE       MET 137 137.042  -0.915  -3.504
  447    H    LYS 138           H        LYS 138 141.501  -0.934   1.449
  448    HA   LYS 138           HA       LYS 138 141.533  -3.769   1.554
  449   1HB   LYS 138          2HB       LYS 138 143.186  -1.588   2.461
  450   2HB   LYS 138          1HB       LYS 138 143.014  -2.782   3.740
  451   1HG   LYS 138          2HG       LYS 138 144.240  -4.321   2.651
  452   2HG   LYS 138          1HG       LYS 138 143.596  -3.871   1.071
  453   1HD   LYS 138          2HD       LYS 138 145.664  -3.032   0.751
  454   2HD   LYS 138          1HD       LYS 138 145.035  -1.662   1.667
  455   1HE   LYS 138          2HE       LYS 138 147.129  -2.242   2.629
  456   2HE   LYS 138          1HE       LYS 138 145.878  -2.789   3.744
  457   1HZ   LYS 138          1HZ       LYS 138 147.898  -4.314   2.928
  458   2HZ   LYS 138          2HZ       LYS 138 146.738  -4.732   1.769
  459   3HZ   LYS 138          3HZ       LYS 138 146.401  -4.935   3.413
  460    H    ASP 139           H        ASP 139 140.097  -1.295   3.542
  461    HA   ASP 139           HA       ASP 139 139.602  -2.975   5.803
  462   1HB   ASP 139          2HB       ASP 139 139.616  -0.301   5.476
  463   2HB   ASP 139          1HB       ASP 139 137.884  -0.600   5.360
  464    H    GLY 140           H        GLY 140 138.186  -2.778   2.741
  465   1HA   GLY 140          2HA       GLY 140 135.739  -4.074   3.772
  466   2HA   GLY 140          1HA       GLY 140 135.725  -2.994   2.389
  467    H    ASP 141           H        ASP 141 138.385  -4.238   1.547
  468    HA   ASP 141           HA       ASP 141 137.214  -6.271  -0.115
  469   1HB   ASP 141          2HB       ASP 141 139.866  -4.918   0.062
  470   2HB   ASP 141          1HB       ASP 141 139.784  -6.473  -0.759
  471    H    LYS 142           H        LYS 142 136.613  -7.928   1.290
  472    HA   LYS 142           HA       LYS 142 138.463  -9.130   3.109
  473   1HB   LYS 142          2HB       LYS 142 135.899 -10.316   2.041
  474   2HB   LYS 142          1HB       LYS 142 136.739 -10.761   3.520
  475   1HG   LYS 142          2HG       LYS 142 135.455  -8.090   2.990
  476   2HG   LYS 142          1HG       LYS 142 134.750  -9.396   3.944
  477   1HD   LYS 142          2HD       LYS 142 137.461  -8.668   4.764
  478   2HD   LYS 142          1HD       LYS 142 136.295  -7.356   4.930
  479   1HE   LYS 142          2HE       LYS 142 135.139  -8.410   6.568
  480   2HE   LYS 142          1HE       LYS 142 135.420 -10.010   5.882
  481   1HZ   LYS 142          1HZ       LYS 142 136.545  -9.551   8.054
  482   2HZ   LYS 142          2HZ       LYS 142 137.536  -8.444   7.245
  483   3HZ   LYS 142          3HZ       LYS 142 137.573 -10.080   6.818
  484    H    ASN 143           H        ASN 143 137.484  -9.694  -0.200
  485    HA   ASN 143           HA       ASN 143 138.971 -12.191  -0.344
  486   1HB   ASN 143          2HB       ASN 143 138.184 -12.165  -2.745
  487   2HB   ASN 143          1HB       ASN 143 136.904 -12.209  -1.537
  488   1HD2  ASN 143          1HD2      ASN 143 135.349 -11.308  -2.817
  489   2HD2  ASN 143          2HD2      ASN 143 135.388  -9.665  -3.345
  490    H    ASN 144           H        ASN 144 139.784  -9.010  -0.441
  491    HA   ASN 144           HA       ASN 144 141.612  -7.863  -1.129
  492   1HB   ASN 144          2HB       ASN 144 142.492 -10.690  -1.230
  493   2HB   ASN 144          1HB       ASN 144 143.487  -9.532  -2.110
  494   1HD2  ASN 144          1HD2      ASN 144 145.204  -9.150  -0.909
  495   2HD2  ASN 144          2HD2      ASN 144 145.198  -8.754   0.772
  496    H    ASP 145           H        ASP 145 139.438  -8.856  -3.094
  497    HA   ASP 145           HA       ASP 145 140.632  -9.138  -5.627
  498   1HB   ASP 145          2HB       ASP 145 137.891  -8.219  -4.762
  499   2HB   ASP 145          1HB       ASP 145 138.344  -8.367  -6.458
  500    H    GLY 146           H        GLY 146 139.842  -6.347  -3.687
  501   1HA   GLY 146          2HA       GLY 146 141.053  -4.296  -3.999
  502   2HA   GLY 146          1HA       GLY 146 141.142  -4.657  -5.717
  503    H    ARG 147           H        ARG 147 138.066  -5.401  -4.734
  504    HA   ARG 147           HA       ARG 147 137.048  -2.675  -5.047
  505   1HB   ARG 147          2HB       ARG 147 135.992  -4.986  -6.681
  506   2HB   ARG 147          1HB       ARG 147 135.496  -3.303  -6.778
  507   1HG   ARG 147          2HG       ARG 147 138.207  -3.182  -7.241
  508   2HG   ARG 147          1HG       ARG 147 137.718  -4.670  -8.054
  509   1HD   ARG 147          2HD       ARG 147 135.734  -2.934  -8.783
  510   2HD   ARG 147          1HD       ARG 147 137.145  -1.879  -8.723
  511    HE   ARG 147           HE       ARG 147 137.595  -4.327 -10.158
  512   1HH1  ARG 147          1HH1      ARG 147 136.417  -1.050 -10.394
  513   2HH1  ARG 147          2HH1      ARG 147 136.698  -0.939 -12.098
  514   1HH2  ARG 147          1HH2      ARG 147 137.967  -4.182 -12.400
  515   2HH2  ARG 147          2HH2      ARG 147 137.578  -2.716 -13.238
  516    H    ILE 148           H        ILE 148 134.822  -2.428  -4.395
  517    HA   ILE 148           HA       ILE 148 134.027  -4.469  -2.429
  518    HB   ILE 148           HB       ILE 148 133.210  -1.563  -2.487
  519   1HG1  ILE 148          2HG1      ILE 148 135.223  -2.893  -0.664
  520   2HG1  ILE 148          1HG1      ILE 148 135.664  -1.949  -2.084
  521   1HG2  ILE 148          1HG2      ILE 148 133.016  -3.453  -0.165
  522   2HG2  ILE 148          2HG2      ILE 148 131.725  -3.316  -1.360
  523   3HG2  ILE 148          3HG2      ILE 148 132.199  -1.909  -0.406
  524   1HD1  ILE 148          1HD1      ILE 148 134.595   0.016  -1.103
  525   2HD1  ILE 148          2HD1      ILE 148 135.865  -0.632  -0.064
  526   3HD1  ILE 148          3HD1      ILE 148 134.170  -0.933   0.321
  527    H    ASP 149           H        ASP 149 132.398  -5.706  -3.023
  528    HA   ASP 149           HA       ASP 149 130.411  -4.658  -4.917
  529   1HB   ASP 149          2HB       ASP 149 129.791  -7.111  -5.161
  530   2HB   ASP 149          1HB       ASP 149 131.383  -6.655  -5.762
  531    H    TYR 150           H        TYR 150 128.206  -5.972  -4.555
  532    HA   TYR 150           HA       TYR 150 126.949  -4.856  -2.367
  533   1HB   TYR 150          2HB       TYR 150 125.745  -5.739  -4.316
  534   2HB   TYR 150          1HB       TYR 150 126.162  -7.381  -3.836
  535    HD1  TYR 150           HD1      TYR 150 124.553  -4.347  -2.350
  536    HD2  TYR 150           HD2      TYR 150 124.541  -8.585  -2.723
  537    HE1  TYR 150           HE1      TYR 150 122.514  -4.456  -0.981
  538    HE2  TYR 150           HE2      TYR 150 122.502  -8.707  -1.356
  539    HH   TYR 150           HH       TYR 150 120.541  -6.156  -0.746
  540    H    ASP 151           H        ASP 151 128.755  -7.825  -2.560
  541    HA   ASP 151           HA       ASP 151 127.771  -8.945  -0.122
  542   1HB   ASP 151          2HB       ASP 151 129.926  -9.583  -2.065
  543   2HB   ASP 151          1HB       ASP 151 130.117 -10.213  -0.432
  544    H    GLU 152           H        GLU 152 130.873  -7.425  -0.998
  545    HA   GLU 152           HA       GLU 152 131.943  -7.366   1.588
  546   1HB   GLU 152          2HB       GLU 152 132.506  -5.333  -0.570
  547   2HB   GLU 152          1HB       GLU 152 133.571  -5.834   0.735
  548   1HG   GLU 152          2HG       GLU 152 132.751  -8.067  -0.917
  549   2HG   GLU 152          1HG       GLU 152 133.555  -6.803  -1.848
  550    H    PHE 153           H        PHE 153 129.622  -5.304   0.024
  551    HA   PHE 153           HA       PHE 153 129.867  -3.040   1.693
  552   1HB   PHE 153          2HB       PHE 153 128.639  -3.215  -0.534
  553   2HB   PHE 153          1HB       PHE 153 127.318  -3.955   0.363
  554    HD1  PHE 153           HD1      PHE 153 128.654  -0.933  -0.826
  555    HD2  PHE 153           HD2      PHE 153 126.478  -2.591   2.434
  556    HE1  PHE 153           HE1      PHE 153 127.782   1.301  -0.277
  557    HE2  PHE 153           HE2      PHE 153 125.602  -0.359   2.988
  558    HZ   PHE 153           HZ       PHE 153 126.255   1.590   1.633
  559    H    LEU 154           H        LEU 154 128.220  -6.094   2.061
  560    HA   LEU 154           HA       LEU 154 126.576  -5.263   4.255
  561   1HB   LEU 154          2HB       LEU 154 127.143  -7.781   2.818
  562   2HB   LEU 154          1HB       LEU 154 126.643  -7.955   4.490
  563    HG   LEU 154           HG       LEU 154 124.763  -8.121   2.893
  564   1HD1  LEU 154          1HD1      LEU 154 123.484  -6.072   4.014
  565   2HD1  LEU 154          2HD1      LEU 154 124.910  -6.101   5.052
  566   3HD1  LEU 154          3HD1      LEU 154 123.896  -7.537   4.906
  567   1HD2  LEU 154          1HD2      LEU 154 125.257  -6.715   1.118
  568   2HD2  LEU 154          2HD2      LEU 154 125.704  -5.373   2.172
  569   3HD2  LEU 154          3HD2      LEU 154 124.008  -5.819   1.983
  570    H    GLU 155           H        GLU 155 129.656  -6.978   3.934
  571    HA   GLU 155           HA       GLU 155 129.952  -7.560   6.693
  572   1HB   GLU 155          2HB       GLU 155 132.212  -7.213   4.727
  573   2HB   GLU 155          1HB       GLU 155 132.178  -8.221   6.167
  574   1HG   GLU 155          2HG       GLU 155 130.062  -9.135   4.611
  575   2HG   GLU 155          1HG       GLU 155 131.371  -8.832   3.470
  576    H    PHE 156           H        PHE 156 131.227  -4.963   4.637
  577    HA   PHE 156           HA       PHE 156 132.873  -3.625   6.344
  578   1HB   PHE 156          2HB       PHE 156 131.813  -3.071   3.903
  579   2HB   PHE 156          1HB       PHE 156 131.018  -1.851   4.891
  580    HD1  PHE 156           HD1      PHE 156 133.700  -2.359   2.835
  581    HD2  PHE 156           HD2      PHE 156 132.784  -0.756   6.668
  582    HE1  PHE 156           HE1      PHE 156 135.723  -0.961   2.730
  583    HE2  PHE 156           HE2      PHE 156 134.805   0.646   6.569
  584    HZ   PHE 156           HZ       PHE 156 136.276   0.545   4.597
  585    H    MET 157           H        MET 157 129.400  -3.823   6.525
  586    HA   MET 157           HA       MET 157 129.140  -1.681   8.432
  587   1HB   MET 157          2HB       MET 157 127.349  -2.478   6.781
  588   2HB   MET 157          1HB       MET 157 127.088  -3.822   7.882
  589   1HG   MET 157          2HG       MET 157 125.481  -2.035   8.248
  590   2HG   MET 157          1HG       MET 157 126.503  -2.285   9.662
  591   1HE   MET 157          1HE       MET 157 126.705  -0.650   6.294
  592   2HE   MET 157          2HE       MET 157 128.340  -0.124   6.694
  593   3HE   MET 157          3HE       MET 157 127.035   1.056   6.592
  594    H    LYS 158           H        LYS 158 128.235  -5.116   8.733
  595    HA   LYS 158           HA       LYS 158 128.294  -5.133  11.541
  596   1HB   LYS 158          2HB       LYS 158 128.166  -7.199   9.408
  597   2HB   LYS 158          1HB       LYS 158 128.619  -7.737  11.020
  598   1HG   LYS 158          2HG       LYS 158 126.545  -7.483  11.824
  599   2HG   LYS 158          1HG       LYS 158 126.283  -5.974  10.948
  600   1HD   LYS 158          2HD       LYS 158 124.842  -7.220   9.741
  601   2HD   LYS 158          1HD       LYS 158 126.303  -7.741   8.900
  602   1HE   LYS 158          2HE       LYS 158 125.373  -9.183  11.350
  603   2HE   LYS 158          1HE       LYS 158 124.628  -9.518   9.788
  604   1HZ   LYS 158          1HZ       LYS 158 127.561  -9.591  10.119
  605   2HZ   LYS 158          2HZ       LYS 158 126.612 -10.328   8.929
  606   3HZ   LYS 158          3HZ       LYS 158 126.609 -10.935  10.508
  607    H    GLY 159           H        GLY 159 130.451  -3.922  11.556
  608   1HA   GLY 159          2HA       GLY 159 132.435  -4.505  12.893
  609   2HA   GLY 159          1HA       GLY 159 132.628  -5.902  11.841
  610    H    VAL 160           H        VAL 160 132.992  -2.441  12.124
  611    HA   VAL 160           HA       VAL 160 134.213  -2.251   9.485
  612    HB   VAL 160           HB       VAL 160 134.027   0.003  11.467
  613   1HG1  VAL 160          1HG1      VAL 160 133.615   0.408   8.581
  614   2HG1  VAL 160          2HG1      VAL 160 135.229  -0.119   9.056
  615   3HG1  VAL 160          3HG1      VAL 160 134.545   1.355   9.740
  616   1HG2  VAL 160          1HG2      VAL 160 131.840  -1.358  10.065
  617   2HG2  VAL 160          2HG2      VAL 160 131.879   0.391   9.839
  618   3HG2  VAL 160          3HG2      VAL 160 131.799  -0.286  11.465
  619    H    GLU 161           H        GLU 161 135.086  -1.802  12.894
  620    HA   GLU 161           HA       GLU 161 137.801  -1.132  12.373
  621   1HB   GLU 161          2HB       GLU 161 138.090  -1.672  14.832
  622   2HB   GLU 161          1HB       GLU 161 136.911  -0.425  14.452
  623   1HG   GLU 161          2HG       GLU 161 135.795  -3.123  14.591
  624   2HG   GLU 161          1HG       GLU 161 136.486  -2.541  16.105
  Start of MODEL    9
    1   1H    MET  81          1HT       MET  81  90.989 -13.321   7.647
    2   2H    MET  81          2HT       MET  81  91.331 -12.183   6.407
    3   3H    MET  81          3HT       MET  81  89.797 -12.953   6.470
    4    HA   MET  81           HA       MET  81  89.424 -10.868   7.298
    5   1HB   MET  81          2HB       MET  81  88.966 -13.095   8.752
    6   2HB   MET  81          1HB       MET  81  89.940 -12.191   9.903
    7   1HG   MET  81          2HG       MET  81  88.315 -10.250   9.393
    8   2HG   MET  81          1HG       MET  81  87.270 -11.515   8.751
    9   1HE   MET  81          1HE       MET  81  85.594 -10.463  11.850
   10   2HE   MET  81          2HE       MET  81  85.145 -11.987  11.085
   11   3HE   MET  81          3HE       MET  81  85.636 -10.615  10.093
   12    H    VAL  82           H        VAL  82  92.264 -12.271   8.910
   13    HA   VAL  82           HA       VAL  82  93.094  -9.619   9.806
   14    HB   VAL  82           HB       VAL  82  93.243 -11.482  11.404
   15   1HG1  VAL  82          1HG1      VAL  82  94.236 -13.450  10.992
   16   2HG1  VAL  82          2HG1      VAL  82  95.596 -12.703  10.155
   17   3HG1  VAL  82          3HG1      VAL  82  94.082 -12.988   9.297
   18   1HG2  VAL  82          1HG2      VAL  82  94.769  -9.565  11.586
   19   2HG2  VAL  82          2HG2      VAL  82  95.951 -10.424  10.600
   20   3HG2  VAL  82          3HG2      VAL  82  95.501 -11.052  12.186
   21    H    ARG  83           H        ARG  83  94.836  -8.531   9.033
   22    HA   ARG  83           HA       ARG  83  96.681  -9.821   7.200
   23   1HB   ARG  83          2HB       ARG  83  94.477  -8.252   6.264
   24   2HB   ARG  83          1HB       ARG  83  95.969  -7.391   5.916
   25   1HG   ARG  83          2HG       ARG  83  96.368  -8.717   4.193
   26   2HG   ARG  83          1HG       ARG  83  96.319 -10.137   5.238
   27   1HD   ARG  83          2HD       ARG  83  94.527 -10.741   4.044
   28   2HD   ARG  83          1HD       ARG  83  93.664  -9.509   4.965
   29    HE   ARG  83           HE       ARG  83  94.695  -8.113   2.895
   30   1HH1  ARG  83          1HH1      ARG  83  92.799 -11.037   3.083
   31   2HH1  ARG  83          2HH1      ARG  83  92.022 -10.780   1.557
   32   1HH2  ARG  83          1HH2      ARG  83  93.675  -7.773   0.887
   33   2HH2  ARG  83          2HH2      ARG  83  92.520  -8.928   0.310
   34    H    CYS  84           H        CYS  84  98.636  -9.214   7.817
   35    HA   CYS  84           HA       CYS  84  99.360  -6.479   8.154
   36   1HB   CYS  84          2HB       CYS  84  98.729  -8.106  10.544
   37   2HB   CYS  84          1HB       CYS  84 100.232  -7.191  10.618
   38    HG   CYS  84           HG       CYS  84  97.985  -5.895  11.486
   39    H    MET  85           H        MET  85 100.214  -9.842   8.875
   40    HA   MET  85           HA       MET  85 102.995  -9.520   8.945
   41   1HB   MET  85          2HB       MET  85 101.120 -11.781   8.596
   42   2HB   MET  85          1HB       MET  85 102.757 -12.045   8.010
   43   1HG   MET  85          2HG       MET  85 103.319 -11.019  10.412
   44   2HG   MET  85          1HG       MET  85 101.749 -11.740  10.765
   45   1HE   MET  85          1HE       MET  85 105.757 -13.202  10.319
   46   2HE   MET  85          2HE       MET  85 105.081 -13.487  11.923
   47   3HE   MET  85          3HE       MET  85 104.973 -11.886  11.192
   48    H    LYS  86           H        LYS  86 100.767  -9.810   6.273
   49    HA   LYS  86           HA       LYS  86 103.009  -9.888   4.379
   50   1HB   LYS  86          2HB       LYS  86 100.060 -10.414   3.981
   51   2HB   LYS  86          1HB       LYS  86 101.248 -10.415   2.685
   52   1HG   LYS  86          2HG       LYS  86 102.421 -12.269   3.749
   53   2HG   LYS  86          1HG       LYS  86 101.245 -12.261   5.065
   54   1HD   LYS  86          2HD       LYS  86  99.462 -12.670   3.348
   55   2HD   LYS  86          1HD       LYS  86 100.749 -12.899   2.161
   56   1HE   LYS  86          2HE       LYS  86 101.585 -14.800   3.303
   57   2HE   LYS  86          1HE       LYS  86 100.588 -14.474   4.719
   58   1HZ   LYS  86          1HZ       LYS  86  98.636 -14.793   3.130
   59   2HZ   LYS  86          2HZ       LYS  86  99.483 -16.175   3.615
   60   3HZ   LYS  86          3HZ       LYS  86  99.755 -15.512   2.082
   61    H    ASP  87           H        ASP  87 102.887  -7.503   5.553
   62    HA   ASP  87           HA       ASP  87 101.165  -5.671   4.155
   63   1HB   ASP  87          2HB       ASP  87 102.315  -5.525   6.559
   64   2HB   ASP  87          1HB       ASP  87 103.562  -4.697   5.630
   65    H    ASP  88           H        ASP  88 102.219  -3.679   3.121
   66    HA   ASP  88           HA       ASP  88 104.242  -4.634   1.215
   67   1HB   ASP  88          2HB       ASP  88 103.434  -2.817  -0.259
   68   2HB   ASP  88          1HB       ASP  88 102.153  -3.945   0.177
   69    H    SER  89           H        SER  89 104.743  -3.528   3.936
   70    HA   SER  89           HA       SER  89 106.482  -1.294   3.123
   71   1HB   SER  89          2HB       SER  89 106.148  -0.292   5.345
   72   2HB   SER  89          1HB       SER  89 104.617  -0.451   4.484
   73    HG   SER  89           HG       SER  89 105.616  -2.079   6.576
   74    H    LYS  90           H        LYS  90 108.543  -1.229   4.018
   75    HA   LYS  90           HA       LYS  90 109.319  -3.570   5.630
   76   1HB   LYS  90          2HB       LYS  90 111.097  -2.287   3.561
   77   2HB   LYS  90          1HB       LYS  90 111.333  -3.818   4.392
   78   1HG   LYS  90          2HG       LYS  90 109.149  -4.533   3.223
   79   2HG   LYS  90          1HG       LYS  90 109.450  -3.152   2.166
   80   1HD   LYS  90          2HD       LYS  90 111.766  -4.909   2.624
   81   2HD   LYS  90          1HD       LYS  90 110.425  -5.648   1.745
   82   1HE   LYS  90          2HE       LYS  90 110.497  -3.955   0.067
   83   2HE   LYS  90          1HE       LYS  90 111.630  -2.987   1.008
   84   1HZ   LYS  90          1HZ       LYS  90 113.318  -4.635   0.686
   85   2HZ   LYS  90          2HZ       LYS  90 112.682  -4.227  -0.826
   86   3HZ   LYS  90          3HZ       LYS  90 112.235  -5.680  -0.087
   87    H    GLY  91           H        GLY  91 111.486  -3.217   6.725
   88   1HA   GLY  91          2HA       GLY  91 111.456  -0.531   7.914
   89   2HA   GLY  91          1HA       GLY  91 112.163  -1.967   8.640
   90    H    LYS  92           H        LYS  92 113.848  -0.119   8.900
   91    HA   LYS  92           HA       LYS  92 115.509   0.188   6.523
   92   1HB   LYS  92          2HB       LYS  92 115.749   1.390   9.285
   93   2HB   LYS  92          1HB       LYS  92 116.835   1.734   7.945
   94   1HG   LYS  92          2HG       LYS  92 115.444   3.504   7.729
   95   2HG   LYS  92          1HG       LYS  92 114.550   2.343   6.746
   96   1HD   LYS  92          2HD       LYS  92 112.807   2.848   8.062
   97   2HD   LYS  92          1HD       LYS  92 113.599   1.825   9.261
   98   1HE   LYS  92          2HE       LYS  92 114.592   3.694  10.330
   99   2HE   LYS  92          1HE       LYS  92 114.160   4.769   9.002
  100   1HZ   LYS  92          1HZ       LYS  92 112.662   5.145  10.796
  101   2HZ   LYS  92          2HZ       LYS  92 112.310   3.497  10.942
  102   3HZ   LYS  92          3HZ       LYS  92 111.800   4.352   9.575
  103    H    THR  93           H        THR  93 116.211  -1.992   6.363
  104    HA   THR  93           HA       THR  93 118.122  -2.811   8.448
  105    HB   THR  93           HB       THR  93 116.222  -4.346   8.174
  106    HG1  THR  93           HG1      THR  93 117.710  -5.714   8.688
  107   1HG2  THR  93          1HG2      THR  93 116.477  -3.861   5.453
  108   2HG2  THR  93          2HG2      THR  93 115.409  -5.026   6.236
  109   3HG2  THR  93          3HG2      THR  93 117.003  -5.530   5.673
  110    H    GLU  94           H        GLU  94 119.321  -4.869   6.846
  111    HA   GLU  94           HA       GLU  94 121.323  -3.344   5.533
  112   1HB   GLU  94          2HB       GLU  94 120.806  -6.201   6.078
  113   2HB   GLU  94          1HB       GLU  94 121.807  -5.866   4.673
  114   1HG   GLU  94          2HG       GLU  94 123.431  -4.756   5.975
  115   2HG   GLU  94          1HG       GLU  94 122.368  -4.697   7.379
  116    H    GLU  95           H        GLU  95 118.280  -4.277   4.506
  117    HA   GLU  95           HA       GLU  95 118.860  -4.853   1.764
  118   1HB   GLU  95          2HB       GLU  95 116.762  -5.501   3.104
  119   2HB   GLU  95          1HB       GLU  95 116.216  -3.857   2.803
  120   1HG   GLU  95          2HG       GLU  95 115.304  -4.679   0.951
  121   2HG   GLU  95          1HG       GLU  95 116.944  -4.691   0.304
  122    H    GLU  96           H        GLU  96 118.249  -1.983   3.639
  123    HA   GLU  96           HA       GLU  96 117.737  -0.264   1.409
  124   1HB   GLU  96          2HB       GLU  96 118.709   0.638   4.112
  125   2HB   GLU  96          1HB       GLU  96 117.695   1.510   2.971
  126   1HG   GLU  96          2HG       GLU  96 116.471  -0.974   3.795
  127   2HG   GLU  96          1HG       GLU  96 116.862   0.056   5.170
  128    H    LEU  97           H        LEU  97 120.562  -1.453   3.010
  129    HA   LEU  97           HA       LEU  97 122.421   0.532   2.407
  130   1HB   LEU  97          2HB       LEU  97 122.686  -2.448   2.706
  131   2HB   LEU  97          1HB       LEU  97 124.073  -1.423   2.396
  132    HG   LEU  97           HG       LEU  97 122.266  -0.885   4.730
  133   1HD1  LEU  97          1HD1      LEU  97 124.741  -2.455   5.149
  134   2HD1  LEU  97          2HD1      LEU  97 123.333  -3.311   4.519
  135   3HD1  LEU  97          3HD1      LEU  97 123.228  -2.454   6.055
  136   1HD2  LEU  97          1HD2      LEU  97 124.537  -0.075   5.612
  137   2HD2  LEU  97          2HD2      LEU  97 123.732   0.895   4.379
  138   3HD2  LEU  97          3HD2      LEU  97 125.066  -0.169   3.933
  139    H    SER  98           H        SER  98 120.803  -1.666   0.307
  140    HA   SER  98           HA       SER  98 122.676  -1.902  -1.761
  141   1HB   SER  98          2HB       SER  98 120.749  -2.437  -3.195
  142   2HB   SER  98          1HB       SER  98 120.637  -3.270  -1.645
  143    HG   SER  98           HG       SER  98 118.735  -2.384  -1.567
  144    H    ASP  99           H        ASP  99 120.227   0.560  -1.099
  145    HA   ASP  99           HA       ASP  99 120.561   2.030  -3.481
  146   1HB   ASP  99          2HB       ASP  99 118.808   2.158  -1.429
  147   2HB   ASP  99          1HB       ASP  99 119.844   3.524  -1.024
  148    H    LEU 100           H        LEU 100 122.175   2.159  -0.353
  149    HA   LEU 100           HA       LEU 100 123.664   4.527  -0.910
  150   1HB   LEU 100          2HB       LEU 100 123.406   2.619   1.259
  151   2HB   LEU 100          1HB       LEU 100 125.078   3.077   1.007
  152    HG   LEU 100           HG       LEU 100 122.828   5.043   1.433
  153   1HD1  LEU 100          1HD1      LEU 100 124.619   3.611   3.321
  154   2HD1  LEU 100          2HD1      LEU 100 122.944   4.127   3.518
  155   3HD1  LEU 100          3HD1      LEU 100 124.251   5.305   3.643
  156   1HD2  LEU 100          1HD2      LEU 100 124.724   5.927   0.167
  157   2HD2  LEU 100          2HD2      LEU 100 125.823   5.398   1.441
  158   3HD2  LEU 100          3HD2      LEU 100 124.627   6.651   1.771
  159    H    PHE 101           H        PHE 101 124.129   1.132  -1.526
  160    HA   PHE 101           HA       PHE 101 126.899   1.093  -1.932
  161   1HB   PHE 101          2HB       PHE 101 125.446  -0.928  -1.782
  162   2HB   PHE 101          1HB       PHE 101 124.826  -0.560  -3.389
  163    HD1  PHE 101           HD1      PHE 101 125.564  -2.342  -4.684
  164    HD2  PHE 101           HD2      PHE 101 128.316  -0.323  -2.144
  165    HE1  PHE 101           HE1      PHE 101 127.417  -3.613  -5.688
  166    HE2  PHE 101           HE2      PHE 101 130.174  -1.590  -3.144
  167    HZ   PHE 101           HZ       PHE 101 129.725  -3.235  -4.918
  168    H    ARG 102           H        ARG 102 124.266   1.580  -4.287
  169    HA   ARG 102           HA       ARG 102 125.905   1.958  -6.528
  170   1HB   ARG 102          2HB       ARG 102 123.141   3.017  -5.920
  171   2HB   ARG 102          1HB       ARG 102 123.913   3.134  -7.495
  172   1HG   ARG 102          2HG       ARG 102 123.804   0.839  -7.858
  173   2HG   ARG 102          1HG       ARG 102 123.562   0.486  -6.146
  174   1HD   ARG 102          2HD       ARG 102 121.526   0.252  -7.620
  175   2HD   ARG 102          1HD       ARG 102 121.337   1.275  -6.197
  176    HE   ARG 102           HE       ARG 102 122.078   2.720  -8.568
  177   1HH1  ARG 102          1HH1      ARG 102 119.414   1.420  -6.728
  178   2HH1  ARG 102          2HH1      ARG 102 118.256   2.526  -7.385
  179   1HH2  ARG 102          1HH2      ARG 102 120.557   4.177  -9.434
  180   2HH2  ARG 102          2HH2      ARG 102 118.904   4.091  -8.922
  181    H    MET 103           H        MET 103 124.819   4.161  -4.024
  182    HA   MET 103           HA       MET 103 125.458   6.600  -5.214
  183   1HB   MET 103          2HB       MET 103 125.183   5.627  -2.417
  184   2HB   MET 103          1HB       MET 103 125.988   7.171  -2.658
  185   1HG   MET 103          2HG       MET 103 123.548   6.991  -4.196
  186   2HG   MET 103          1HG       MET 103 123.261   6.715  -2.480
  187   1HE   MET 103          1HE       MET 103 122.029  10.156  -3.335
  188   2HE   MET 103          2HE       MET 103 122.099   8.668  -4.279
  189   3HE   MET 103          3HE       MET 103 123.062  10.065  -4.762
  190    H    PHE 104           H        PHE 104 127.490   4.190  -3.704
  191    HA   PHE 104           HA       PHE 104 129.816   5.887  -3.612
  192   1HB   PHE 104          2HB       PHE 104 129.170   3.085  -2.879
  193   2HB   PHE 104          1HB       PHE 104 130.847   3.423  -3.290
  194    HD1  PHE 104           HD1      PHE 104 128.076   4.571  -1.101
  195    HD2  PHE 104           HD2      PHE 104 132.281   4.334  -1.711
  196    HE1  PHE 104           HE1      PHE 104 128.451   5.450   1.167
  197    HE2  PHE 104           HE2      PHE 104 132.663   5.212   0.555
  198    HZ   PHE 104           HZ       PHE 104 130.748   5.771   1.997
  199    H    ASP 105           H        ASP 105 128.292   3.924  -5.972
  200    HA   ASP 105           HA       ASP 105 130.709   3.497  -7.518
  201   1HB   ASP 105          2HB       ASP 105 127.840   2.681  -7.791
  202   2HB   ASP 105          1HB       ASP 105 128.881   2.646  -9.210
  203    H    LYS 106           H        LYS 106 131.140   4.418  -9.531
  204    HA   LYS 106           HA       LYS 106 129.679   6.919 -10.057
  205   1HB   LYS 106          2HB       LYS 106 132.421   6.453  -9.678
  206   2HB   LYS 106          1HB       LYS 106 132.234   6.748 -11.401
  207   1HG   LYS 106          2HG       LYS 106 131.026   8.578  -9.358
  208   2HG   LYS 106          1HG       LYS 106 132.703   8.745  -9.882
  209   1HD   LYS 106          2HD       LYS 106 131.939   8.956 -12.208
  210   2HD   LYS 106          1HD       LYS 106 130.265   8.829 -11.659
  211   1HE   LYS 106          2HE       LYS 106 130.788  10.837 -10.171
  212   2HE   LYS 106          1HE       LYS 106 132.242  11.032 -11.148
  213   1HZ   LYS 106          1HZ       LYS 106 130.221  12.345 -11.847
  214   2HZ   LYS 106          2HZ       LYS 106 129.546  10.881 -12.357
  215   3HZ   LYS 106          3HZ       LYS 106 130.979  11.440 -13.061
  216    H    ASN 107           H        ASN 107 131.201   4.121 -11.608
  217    HA   ASN 107           HA       ASN 107 130.092   4.868 -14.189
  218   1HB   ASN 107          2HB       ASN 107 131.266   2.779 -14.965
  219   2HB   ASN 107          1HB       ASN 107 132.318   4.006 -14.266
  220   1HD2  ASN 107          1HD2      ASN 107 132.211   0.915 -14.503
  221   2HD2  ASN 107          2HD2      ASN 107 132.693   0.398 -12.928
  222    H    ALA 108           H        ALA 108 128.682   3.613 -11.606
  223    HA   ALA 108           HA       ALA 108 127.003   2.127 -11.163
  224   1HB   ALA 108          1HB       ALA 108 125.193   2.155 -12.879
  225   2HB   ALA 108          2HB       ALA 108 126.279   3.064 -13.931
  226   3HB   ALA 108          3HB       ALA 108 125.760   3.751 -12.393
  227    H    ASP 109           H        ASP 109 128.782   0.427 -11.307
  228    HA   ASP 109           HA       ASP 109 128.081  -1.528 -13.401
  229   1HB   ASP 109          2HB       ASP 109 130.374  -2.397 -13.244
  230   2HB   ASP 109          1HB       ASP 109 130.367  -0.695 -13.699
  231    H    GLY 110           H        GLY 110 128.716  -0.955 -10.016
  232   1HA   GLY 110          2HA       GLY 110 127.381  -2.333  -8.467
  233   2HA   GLY 110          1HA       GLY 110 127.831  -3.718  -9.451
  234    H    TYR 111           H        TYR 111 130.555  -2.009  -9.472
  235    HA   TYR 111           HA       TYR 111 131.524  -3.047  -6.895
  236   1HB   TYR 111          2HB       TYR 111 133.057  -3.162  -9.501
  237   2HB   TYR 111          1HB       TYR 111 133.573  -3.803  -7.946
  238    HD1  TYR 111           HD1      TYR 111 132.451  -5.803  -7.001
  239    HD2  TYR 111           HD2      TYR 111 131.573  -4.385 -10.915
  240    HE1  TYR 111           HE1      TYR 111 131.421  -7.968  -7.547
  241    HE2  TYR 111           HE2      TYR 111 130.539  -6.546 -11.472
  242    HH   TYR 111           HH       TYR 111 129.544  -8.716  -9.329
  243    H    ILE 112           H        ILE 112 133.036  -1.796  -5.835
  244    HA   ILE 112           HA       ILE 112 133.483   0.873  -6.993
  245    HB   ILE 112           HB       ILE 112 133.638   0.108  -4.079
  246   1HG1  ILE 112          2HG1      ILE 112 131.393   1.627  -5.399
  247   2HG1  ILE 112          1HG1      ILE 112 131.346  -0.123  -5.205
  248   1HG2  ILE 112          1HG2      ILE 112 133.271   2.863  -5.198
  249   2HG2  ILE 112          2HG2      ILE 112 134.878   2.156  -5.023
  250   3HG2  ILE 112          3HG2      ILE 112 133.851   2.377  -3.604
  251   1HD1  ILE 112          1HD1      ILE 112 131.788   1.710  -2.878
  252   2HD1  ILE 112          2HD1      ILE 112 131.261   0.028  -2.877
  253   3HD1  ILE 112          3HD1      ILE 112 130.174   1.292  -3.451
  254    H    ASP 113           H        ASP 113 135.488   1.585  -7.358
  255    HA   ASP 113           HA       ASP 113 137.729  -0.069  -6.393
  256   1HB   ASP 113          2HB       ASP 113 137.078   0.320  -8.990
  257   2HB   ASP 113          1HB       ASP 113 138.161   1.687  -8.738
  258    H    LEU 114           H        LEU 114 139.853   1.490  -6.875
  259    HA   LEU 114           HA       LEU 114 139.926   3.254  -4.729
  260   1HB   LEU 114          2HB       LEU 114 141.764   2.206  -6.463
  261   2HB   LEU 114          1HB       LEU 114 141.773   3.899  -6.919
  262    HG   LEU 114           HG       LEU 114 141.965   4.150  -4.239
  263   1HD1  LEU 114          1HD1      LEU 114 143.854   1.918  -4.588
  264   2HD1  LEU 114          2HD1      LEU 114 142.155   1.474  -4.426
  265   3HD1  LEU 114          3HD1      LEU 114 142.942   2.427  -3.167
  266   1HD2  LEU 114          1HD2      LEU 114 143.440   5.283  -5.697
  267   2HD2  LEU 114          2HD2      LEU 114 144.128   3.773  -6.294
  268   3HD2  LEU 114          3HD2      LEU 114 144.456   4.298  -4.643
  269    H    GLU 115           H        GLU 115 139.227   3.858  -8.131
  270    HA   GLU 115           HA       GLU 115 139.293   6.670  -8.035
  271   1HB   GLU 115          2HB       GLU 115 137.630   4.897  -9.831
  272   2HB   GLU 115          1HB       GLU 115 138.005   6.590 -10.115
  273   1HG   GLU 115          2HG       GLU 115 140.452   5.878 -10.079
  274   2HG   GLU 115          1HG       GLU 115 139.846   4.228 -10.211
  275    H    GLU 116           H        GLU 116 136.498   4.457  -7.909
  276    HA   GLU 116           HA       GLU 116 134.546   6.393  -7.438
  277   1HB   GLU 116          2HB       GLU 116 134.684   3.477  -6.684
  278   2HB   GLU 116          1HB       GLU 116 133.256   4.463  -6.400
  279   1HG   GLU 116          2HG       GLU 116 132.638   3.702  -8.411
  280   2HG   GLU 116          1HG       GLU 116 133.688   4.986  -9.005
  281    H    LEU 117           H        LEU 117 136.660   4.679  -5.211
  282    HA   LEU 117           HA       LEU 117 135.390   5.715  -2.855
  283   1HB   LEU 117          2HB       LEU 117 136.643   3.554  -2.955
  284   2HB   LEU 117          1HB       LEU 117 138.126   4.475  -3.118
  285    HG   LEU 117           HG       LEU 117 137.649   5.529  -0.903
  286   1HD1  LEU 117          1HD1      LEU 117 136.014   4.142   0.515
  287   2HD1  LEU 117          2HD1      LEU 117 135.332   3.632  -1.030
  288   3HD1  LEU 117          3HD1      LEU 117 135.350   5.342  -0.593
  289   1HD2  LEU 117          1HD2      LEU 117 138.956   3.288  -1.423
  290   2HD2  LEU 117          2HD2      LEU 117 137.664   2.592  -0.444
  291   3HD2  LEU 117          3HD2      LEU 117 138.700   3.851   0.230
  292    H    LYS 118           H        LYS 118 137.556   7.005  -5.115
  293    HA   LYS 118           HA       LYS 118 138.953   8.737  -3.277
  294   1HB   LYS 118          2HB       LYS 118 139.048   8.160  -6.174
  295   2HB   LYS 118          1HB       LYS 118 139.487   9.797  -5.709
  296   1HG   LYS 118          2HG       LYS 118 140.953   8.447  -3.932
  297   2HG   LYS 118          1HG       LYS 118 140.886   7.244  -5.222
  298   1HD   LYS 118          2HD       LYS 118 141.520   9.267  -6.747
  299   2HD   LYS 118          1HD       LYS 118 142.085   9.981  -5.236
  300   1HE   LYS 118          2HE       LYS 118 144.001   8.904  -5.656
  301   2HE   LYS 118          1HE       LYS 118 143.142   7.463  -5.113
  302   1HZ   LYS 118          1HZ       LYS 118 143.868   8.285  -7.819
  303   2HZ   LYS 118          2HZ       LYS 118 142.404   7.460  -7.631
  304   3HZ   LYS 118          3HZ       LYS 118 143.851   6.742  -7.125
  305    H    ILE 119           H        ILE 119 136.167   8.910  -5.381
  306    HA   ILE 119           HA       ILE 119 135.928  11.762  -5.283
  307    HB   ILE 119           HB       ILE 119 133.597  11.325  -6.153
  308   1HG1  ILE 119          2HG1      ILE 119 134.565   8.479  -6.430
  309   2HG1  ILE 119          1HG1      ILE 119 133.493   9.001  -5.137
  310   1HG2  ILE 119          1HG2      ILE 119 135.397   9.861  -7.972
  311   2HG2  ILE 119          2HG2      ILE 119 135.955  11.446  -7.435
  312   3HG2  ILE 119          3HG2      ILE 119 134.403  11.289  -8.260
  313   1HD1  ILE 119          1HD1      ILE 119 132.911   8.399  -7.915
  314   2HD1  ILE 119          2HD1      ILE 119 132.240   9.944  -7.387
  315   3HD1  ILE 119          3HD1      ILE 119 131.838   8.464  -6.517
  316    H    MET 120           H        MET 120 134.528   9.066  -3.495
  317    HA   MET 120           HA       MET 120 132.572  10.489  -2.080
  318   1HB   MET 120          2HB       MET 120 133.132   7.905  -2.251
  319   2HB   MET 120          1HB       MET 120 134.007   8.230  -0.760
  320   1HG   MET 120          2HG       MET 120 131.160   9.080  -1.081
  321   2HG   MET 120          1HG       MET 120 131.570   7.427  -0.630
  322   1HE   MET 120          1HE       MET 120 134.225   8.354   1.950
  323   2HE   MET 120          2HE       MET 120 133.559   7.114   0.888
  324   3HE   MET 120          3HE       MET 120 132.958   7.278   2.537
  325    H    LEU 121           H        LEU 121 135.886   9.617  -1.101
  326    HA   LEU 121           HA       LEU 121 135.785  11.039   1.348
  327   1HB   LEU 121          2HB       LEU 121 137.842   9.649  -0.250
  328   2HB   LEU 121          1HB       LEU 121 138.440  10.906   0.818
  329    HG   LEU 121           HG       LEU 121 136.563   8.946   2.009
  330   1HD1  LEU 121          1HD1      LEU 121 137.889   7.121   1.944
  331   2HD1  LEU 121          2HD1      LEU 121 139.378   8.066   1.923
  332   3HD1  LEU 121          3HD1      LEU 121 138.447   7.853   0.440
  333   1HD2  LEU 121          1HD2      LEU 121 139.040  10.422   2.861
  334   2HD2  LEU 121          2HD2      LEU 121 138.311   9.148   3.840
  335   3HD2  LEU 121          3HD2      LEU 121 137.392  10.605   3.459
  336    H    GLN 122           H        GLN 122 137.042  11.854  -1.862
  337    HA   GLN 122           HA       GLN 122 138.162  14.341  -1.164
  338   1HB   GLN 122          2HB       GLN 122 137.206  13.143  -3.746
  339   2HB   GLN 122          1HB       GLN 122 137.745  14.815  -3.686
  340   1HG   GLN 122          2HG       GLN 122 139.598  12.962  -2.416
  341   2HG   GLN 122          1HG       GLN 122 139.330  12.629  -4.127
  342   1HE2  GLN 122          1HE2      GLN 122 140.105  15.240  -1.875
  343   2HE2  GLN 122          2HE2      GLN 122 141.115  16.122  -2.966
  344    H    ALA 123           H        ALA 123 134.900  13.340  -1.796
  345    HA   ALA 123           HA       ALA 123 133.776  15.854  -2.409
  346   1HB   ALA 123          1HB       ALA 123 131.651  14.836  -2.015
  347   2HB   ALA 123          2HB       ALA 123 132.384  13.552  -1.053
  348   3HB   ALA 123          3HB       ALA 123 132.689  13.638  -2.787
  349    H    THR 124           H        THR 124 134.807  14.437   0.580
  350    HA   THR 124           HA       THR 124 133.200  15.811   2.402
  351    HB   THR 124           HB       THR 124 134.855  15.295   4.051
  352    HG1  THR 124           HG1      THR 124 136.668  14.828   1.923
  353   1HG2  THR 124          1HG2      THR 124 134.152  13.304   2.087
  354   2HG2  THR 124          2HG2      THR 124 134.270  13.172   3.842
  355   3HG2  THR 124          3HG2      THR 124 135.707  12.956   2.844
  356    H    GLY 125           H        GLY 125 134.688  17.320   4.068
  357   1HA   GLY 125          2HA       GLY 125 135.341  19.655   2.387
  358   2HA   GLY 125          1HA       GLY 125 134.705  19.745   4.023
  359    H    GLU 126           H        GLU 126 137.061  17.327   3.639
  360    HA   GLU 126           HA       GLU 126 139.129  19.126   4.720
  361   1HB   GLU 126          2HB       GLU 126 139.965  17.087   5.957
  362   2HB   GLU 126          1HB       GLU 126 138.433  17.741   6.521
  363   1HG   GLU 126          2HG       GLU 126 137.218  16.014   5.365
  364   2HG   GLU 126          1HG       GLU 126 138.711  15.397   4.658
  365    H    THR 127           H        THR 127 141.339  17.711   4.664
  366    HA   THR 127           HA       THR 127 141.732  17.168   1.820
  367    HB   THR 127           HB       THR 127 144.204  17.174   2.577
  368    HG1  THR 127           HG1      THR 127 144.178  17.131   4.718
  369   1HG2  THR 127          1HG2      THR 127 144.229  19.202   1.712
  370   2HG2  THR 127          2HG2      THR 127 143.511  19.865   3.179
  371   3HG2  THR 127          3HG2      THR 127 142.475  19.280   1.878
  372    H    ILE 128           H        ILE 128 142.087  15.189   1.038
  373    HA   ILE 128           HA       ILE 128 142.879  13.051   2.895
  374    HB   ILE 128           HB       ILE 128 140.812  12.650   0.739
  375   1HG1  ILE 128          2HG1      ILE 128 139.958  14.205   2.463
  376   2HG1  ILE 128          1HG1      ILE 128 139.116  12.659   2.491
  377   1HG2  ILE 128          1HG2      ILE 128 142.291  10.758   1.716
  378   2HG2  ILE 128          2HG2      ILE 128 140.554  10.503   1.555
  379   3HG2  ILE 128          3HG2      ILE 128 141.244  10.907   3.127
  380   1HD1  ILE 128          1HD1      ILE 128 140.588  13.982   4.571
  381   2HD1  ILE 128          2HD1      ILE 128 141.231  12.366   4.276
  382   3HD1  ILE 128          3HD1      ILE 128 139.523  12.579   4.662
  383    H    THR 129           H        THR 129 144.664  12.081   2.199
  384    HA   THR 129           HA       THR 129 145.600  12.488  -0.498
  385    HB   THR 129           HB       THR 129 147.191  12.573   1.347
  386    HG1  THR 129           HG1      THR 129 148.052  11.858  -0.578
  387   1HG2  THR 129          1HG2      THR 129 146.679   9.641   1.773
  388   2HG2  THR 129          2HG2      THR 129 146.101  10.924   2.836
  389   3HG2  THR 129          3HG2      THR 129 147.833  10.662   2.630
  390    H    GLU 130           H        GLU 130 146.602  10.512  -1.630
  391    HA   GLU 130           HA       GLU 130 144.498   8.754  -2.314
  392   1HB   GLU 130          2HB       GLU 130 146.154   7.648  -3.751
  393   2HB   GLU 130          1HB       GLU 130 146.205   9.397  -3.927
  394   1HG   GLU 130          2HG       GLU 130 148.277   9.569  -3.038
  395   2HG   GLU 130          1HG       GLU 130 148.046   8.201  -1.950
  396    H    ASP 131           H        ASP 131 146.916   8.606   0.122
  397    HA   ASP 131           HA       ASP 131 147.052   5.771   0.370
  398   1HB   ASP 131          2HB       ASP 131 147.977   8.109   1.965
  399   2HB   ASP 131          1HB       ASP 131 147.843   6.560   2.795
  400    H    ASP 132           H        ASP 132 145.540   8.219   2.491
  401    HA   ASP 132           HA       ASP 132 144.189   6.498   4.172
  402   1HB   ASP 132          2HB       ASP 132 143.821   9.326   3.341
  403   2HB   ASP 132          1HB       ASP 132 142.470   8.553   4.164
  404    H    ILE 133           H        ILE 133 143.382   7.451   0.917
  405    HA   ILE 133           HA       ILE 133 140.695   6.379   1.077
  406    HB   ILE 133           HB       ILE 133 142.169   7.253  -1.403
  407   1HG1  ILE 133          2HG1      ILE 133 140.303   8.951   0.256
  408   2HG1  ILE 133          1HG1      ILE 133 142.053   8.997   0.451
  409   1HG2  ILE 133          1HG2      ILE 133 139.547   6.189  -0.885
  410   2HG2  ILE 133          2HG2      ILE 133 140.330   6.546  -2.425
  411   3HG2  ILE 133          3HG2      ILE 133 139.433   7.807  -1.579
  412   1HD1  ILE 133          1HD1      ILE 133 142.368   9.879  -1.704
  413   2HD1  ILE 133          2HD1      ILE 133 141.017  10.777  -1.011
  414   3HD1  ILE 133          3HD1      ILE 133 140.716   9.499  -2.188
  415    H    GLU 134           H        GLU 134 143.785   5.113   0.546
  416    HA   GLU 134           HA       GLU 134 142.904   2.984  -1.222
  417   1HB   GLU 134          2HB       GLU 134 145.525   3.890  -0.122
  418   2HB   GLU 134          1HB       GLU 134 145.375   2.218  -0.642
  419   1HG   GLU 134          2HG       GLU 134 144.895   2.847  -2.863
  420   2HG   GLU 134          1HG       GLU 134 144.631   4.530  -2.405
  421    H    GLU 135           H        GLU 135 143.840   3.435   2.147
  422    HA   GLU 135           HA       GLU 135 143.930   0.733   2.896
  423   1HB   GLU 135          2HB       GLU 135 143.751   1.512   5.177
  424   2HB   GLU 135          1HB       GLU 135 144.799   2.597   4.275
  425   1HG   GLU 135          2HG       GLU 135 142.597   3.962   3.938
  426   2HG   GLU 135          1HG       GLU 135 142.069   3.066   5.362
  427    H    LEU 136           H        LEU 136 141.251   2.987   2.612
  428    HA   LEU 136           HA       LEU 136 139.296   1.523   3.973
  429   1HB   LEU 136          2HB       LEU 136 139.401   3.811   2.235
  430   2HB   LEU 136          1HB       LEU 136 138.036   2.801   1.796
  431    HG   LEU 136           HG       LEU 136 137.755   2.900   4.504
  432   1HD1  LEU 136          1HD1      LEU 136 139.704   4.729   4.166
  433   2HD1  LEU 136          2HD1      LEU 136 138.496   4.802   5.450
  434   3HD1  LEU 136          3HD1      LEU 136 138.277   5.747   3.976
  435   1HD2  LEU 136          1HD2      LEU 136 135.932   4.412   4.096
  436   2HD2  LEU 136          2HD2      LEU 136 136.047   3.283   2.745
  437   3HD2  LEU 136          3HD2      LEU 136 136.650   4.932   2.571
  438    H    MET 137           H        MET 137 140.596   1.185   0.746
  439    HA   MET 137           HA       MET 137 138.577  -0.478  -0.319
  440   1HB   MET 137          2HB       MET 137 141.425   0.102  -1.020
  441   2HB   MET 137          1HB       MET 137 140.612  -1.247  -1.802
  442   1HG   MET 137          2HG       MET 137 139.090   1.255  -1.793
  443   2HG   MET 137          1HG       MET 137 140.601   1.311  -2.698
  444   1HE   MET 137          1HE       MET 137 136.867  -1.163  -3.611
  445   2HE   MET 137          2HE       MET 137 136.842   0.525  -3.103
  446   3HE   MET 137          3HE       MET 137 137.437  -0.718  -2.003
  447    H    LYS 138           H        LYS 138 141.565  -1.169   1.437
  448    HA   LYS 138           HA       LYS 138 141.359  -4.002   1.179
  449   1HB   LYS 138          2HB       LYS 138 143.412  -2.464   1.775
  450   2HB   LYS 138          1HB       LYS 138 142.859  -2.716   3.425
  451   1HG   LYS 138          2HG       LYS 138 143.041  -5.138   3.107
  452   2HG   LYS 138          1HG       LYS 138 143.626  -4.868   1.463
  453   1HD   LYS 138          2HD       LYS 138 145.605  -3.812   2.250
  454   2HD   LYS 138          1HD       LYS 138 144.978  -3.721   3.897
  455   1HE   LYS 138          2HE       LYS 138 146.675  -5.520   3.523
  456   2HE   LYS 138          1HE       LYS 138 145.134  -6.085   4.168
  457   1HZ   LYS 138          1HZ       LYS 138 144.669  -7.225   2.297
  458   2HZ   LYS 138          2HZ       LYS 138 146.348  -7.207   2.094
  459   3HZ   LYS 138          3HZ       LYS 138 145.387  -6.085   1.272
  460    H    ASP 139           H        ASP 139 140.154  -1.644   3.449
  461    HA   ASP 139           HA       ASP 139 139.525  -3.441   5.548
  462   1HB   ASP 139          2HB       ASP 139 138.864  -0.629   4.866
  463   2HB   ASP 139          1HB       ASP 139 137.776  -1.449   5.981
  464    H    GLY 140           H        GLY 140 138.076  -2.878   2.503
  465   1HA   GLY 140          2HA       GLY 140 135.670  -4.343   3.395
  466   2HA   GLY 140          1HA       GLY 140 135.610  -3.082   2.175
  467    H    ASP 141           H        ASP 141 138.302  -4.214   1.176
  468    HA   ASP 141           HA       ASP 141 137.108  -6.005  -0.745
  469   1HB   ASP 141          2HB       ASP 141 138.766  -4.298  -1.426
  470   2HB   ASP 141          1HB       ASP 141 139.987  -5.117  -0.458
  471    H    LYS 142           H        LYS 142 136.606  -7.909   0.267
  472    HA   LYS 142           HA       LYS 142 138.538  -9.282   1.914
  473   1HB   LYS 142          2HB       LYS 142 135.861 -10.222   0.871
  474   2HB   LYS 142          1HB       LYS 142 136.820 -11.019   2.111
  475   1HG   LYS 142          2HG       LYS 142 135.631  -8.260   2.330
  476   2HG   LYS 142          1HG       LYS 142 134.970  -9.726   3.055
  477   1HD   LYS 142          2HD       LYS 142 137.733  -8.665   3.629
  478   2HD   LYS 142          1HD       LYS 142 136.317  -8.299   4.614
  479   1HE   LYS 142          2HE       LYS 142 136.038 -10.874   4.723
  480   2HE   LYS 142          1HE       LYS 142 137.730 -10.910   4.224
  481   1HZ   LYS 142          1HZ       LYS 142 136.940 -10.780   6.762
  482   2HZ   LYS 142          2HZ       LYS 142 137.103  -9.131   6.430
  483   3HZ   LYS 142          3HZ       LYS 142 138.422 -10.168   6.217
  484    H    ASN 143           H        ASN 143 137.456  -9.384  -1.401
  485    HA   ASN 143           HA       ASN 143 138.750 -11.916  -1.938
  486   1HB   ASN 143          2HB       ASN 143 137.434  -9.926  -3.796
  487   2HB   ASN 143          1HB       ASN 143 138.036 -11.509  -4.276
  488   1HD2  ASN 143          1HD2      ASN 143 137.108 -13.369  -3.073
  489   2HD2  ASN 143          2HD2      ASN 143 135.429 -13.304  -2.671
  490    H    ASN 144           H        ASN 144 139.835  -8.805  -1.553
  491    HA   ASN 144           HA       ASN 144 141.678  -7.638  -2.189
  492   1HB   ASN 144          2HB       ASN 144 142.530 -10.476  -1.957
  493   2HB   ASN 144          1HB       ASN 144 143.670  -9.358  -2.700
  494   1HD2  ASN 144          1HD2      ASN 144 143.097 -10.799   0.063
  495   2HD2  ASN 144          2HD2      ASN 144 143.581  -9.584   1.192
  496    H    ASP 145           H        ASP 145 139.812  -8.418  -4.341
  497    HA   ASP 145           HA       ASP 145 141.464  -8.931  -6.652
  498   1HB   ASP 145          2HB       ASP 145 139.376  -8.722  -7.924
  499   2HB   ASP 145          1HB       ASP 145 139.174  -9.809  -6.554
  500    H    GLY 146           H        GLY 146 140.027  -6.184  -5.053
  501   1HA   GLY 146          2HA       GLY 146 141.366  -4.092  -5.453
  502   2HA   GLY 146          1HA       GLY 146 141.123  -4.427  -7.161
  503    H    ARG 147           H        ARG 147 138.318  -5.400  -5.921
  504    HA   ARG 147           HA       ARG 147 137.112  -2.748  -5.673
  505   1HB   ARG 147          2HB       ARG 147 136.086  -4.851  -7.588
  506   2HB   ARG 147          1HB       ARG 147 135.374  -3.270  -7.296
  507   1HG   ARG 147          2HG       ARG 147 137.587  -2.303  -8.095
  508   2HG   ARG 147          1HG       ARG 147 137.951  -3.928  -8.680
  509   1HD   ARG 147          2HD       ARG 147 135.301  -2.905  -9.428
  510   2HD   ARG 147          1HD       ARG 147 136.659  -2.016 -10.116
  511    HE   ARG 147           HE       ARG 147 136.920  -4.853 -10.407
  512   1HH1  ARG 147          1HH1      ARG 147 135.483  -1.985 -11.779
  513   2HH1  ARG 147          2HH1      ARG 147 135.373  -2.649 -13.373
  514   1HH2  ARG 147          1HH2      ARG 147 136.777  -5.731 -12.504
  515   2HH2  ARG 147          2HH2      ARG 147 136.107  -4.778 -13.785
  516    H    ILE 148           H        ILE 148 135.066  -2.736  -4.642
  517    HA   ILE 148           HA       ILE 148 134.552  -5.171  -3.072
  518    HB   ILE 148           HB       ILE 148 133.730  -2.344  -2.400
  519   1HG1  ILE 148          2HG1      ILE 148 135.952  -3.953  -1.137
  520   2HG1  ILE 148          1HG1      ILE 148 136.228  -2.786  -2.426
  521   1HG2  ILE 148          1HG2      ILE 148 132.402  -4.316  -1.484
  522   2HG2  ILE 148          2HG2      ILE 148 133.031  -3.157  -0.313
  523   3HG2  ILE 148          3HG2      ILE 148 133.845  -4.704  -0.547
  524   1HD1  ILE 148          1HD1      ILE 148 135.189  -1.052  -0.960
  525   2HD1  ILE 148          2HD1      ILE 148 136.706  -1.721  -0.360
  526   3HD1  ILE 148          3HD1      ILE 148 135.175  -2.248   0.336
  527    H    ASP 149           H        ASP 149 132.623  -6.149  -3.140
  528    HA   ASP 149           HA       ASP 149 130.587  -4.988  -4.907
  529   1HB   ASP 149          2HB       ASP 149 129.674  -7.359  -4.919
  530   2HB   ASP 149          1HB       ASP 149 131.235  -7.129  -5.699
  531    H    TYR 150           H        TYR 150 128.287  -5.904  -4.273
  532    HA   TYR 150           HA       TYR 150 127.541  -4.607  -1.900
  533   1HB   TYR 150          2HB       TYR 150 126.021  -4.998  -3.821
  534   2HB   TYR 150          1HB       TYR 150 125.988  -6.712  -3.421
  535    HD1  TYR 150           HD1      TYR 150 125.353  -3.400  -1.805
  536    HD2  TYR 150           HD2      TYR 150 124.232  -7.492  -2.137
  537    HE1  TYR 150           HE1      TYR 150 123.462  -3.000  -0.286
  538    HE2  TYR 150           HE2      TYR 150 122.338  -7.103  -0.619
  539    HH   TYR 150           HH       TYR 150 121.994  -4.199   1.184
  540    H    ASP 151           H        ASP 151 128.715  -7.793  -2.444
  541    HA   ASP 151           HA       ASP 151 127.605  -8.932  -0.048
  542   1HB   ASP 151          2HB       ASP 151 128.776  -9.957  -2.352
  543   2HB   ASP 151          1HB       ASP 151 129.967 -10.285  -1.095
  544    H    GLU 152           H        GLU 152 130.872  -7.965  -1.077
  545    HA   GLU 152           HA       GLU 152 132.059  -8.348   1.461
  546   1HB   GLU 152          2HB       GLU 152 133.035  -6.511  -0.727
  547   2HB   GLU 152          1HB       GLU 152 133.994  -7.262   0.541
  548   1HG   GLU 152          2HG       GLU 152 133.500  -9.470  -0.431
  549   2HG   GLU 152          1HG       GLU 152 132.619  -8.673  -1.733
  550    H    PHE 153           H        PHE 153 130.595  -5.547  -0.117
  551    HA   PHE 153           HA       PHE 153 131.421  -3.691   1.889
  552   1HB   PHE 153          2HB       PHE 153 130.290  -3.488  -0.635
  553   2HB   PHE 153          1HB       PHE 153 129.018  -2.912   0.438
  554    HD1  PHE 153           HD1      PHE 153 130.179  -1.408   2.462
  555    HD2  PHE 153           HD2      PHE 153 131.518  -1.796  -1.557
  556    HE1  PHE 153           HE1      PHE 153 131.309   0.769   2.635
  557    HE2  PHE 153           HE2      PHE 153 132.652   0.382  -1.393
  558    HZ   PHE 153           HZ       PHE 153 132.548   1.668   0.705
  559    H    LEU 154           H        LEU 154 128.740  -5.871   1.542
  560    HA   LEU 154           HA       LEU 154 126.894  -4.678   3.270
  561   1HB   LEU 154          2HB       LEU 154 127.225  -7.195   1.957
  562   2HB   LEU 154          1HB       LEU 154 126.770  -7.495   3.622
  563    HG   LEU 154           HG       LEU 154 124.752  -6.194   3.370
  564   1HD1  LEU 154          1HD1      LEU 154 125.020  -5.782   0.475
  565   2HD1  LEU 154          2HD1      LEU 154 126.069  -4.777   1.472
  566   3HD1  LEU 154          3HD1      LEU 154 124.322  -4.740   1.714
  567   1HD2  LEU 154          1HD2      LEU 154 125.359  -8.378   1.464
  568   2HD2  LEU 154          2HD2      LEU 154 123.855  -7.488   1.224
  569   3HD2  LEU 154          3HD2      LEU 154 124.164  -8.300   2.757
  570    H    GLU 155           H        GLU 155 129.706  -6.683   3.917
  571    HA   GLU 155           HA       GLU 155 129.162  -6.951   6.722
  572   1HB   GLU 155          2HB       GLU 155 131.583  -7.537   5.023
  573   2HB   GLU 155          1HB       GLU 155 131.575  -7.772   6.766
  574   1HG   GLU 155          2HG       GLU 155 129.580  -9.273   6.437
  575   2HG   GLU 155          1HG       GLU 155 129.907  -9.183   4.706
  576    H    PHE 156           H        PHE 156 130.843  -4.686   4.691
  577    HA   PHE 156           HA       PHE 156 132.563  -3.479   6.508
  578   1HB   PHE 156          2HB       PHE 156 131.893  -3.038   3.899
  579   2HB   PHE 156          1HB       PHE 156 131.183  -1.626   4.676
  580    HD1  PHE 156           HD1      PHE 156 133.772  -2.281   2.789
  581    HD2  PHE 156           HD2      PHE 156 133.090  -1.047   6.804
  582    HE1  PHE 156           HE1      PHE 156 135.977  -1.192   2.828
  583    HE2  PHE 156           HE2      PHE 156 135.295   0.043   6.849
  584    HZ   PHE 156           HZ       PHE 156 136.742  -0.028   4.858
  585    H    MET 157           H        MET 157 129.100  -3.158   6.136
  586    HA   MET 157           HA       MET 157 129.026  -1.008   8.117
  587   1HB   MET 157          2HB       MET 157 127.314  -1.867   5.938
  588   2HB   MET 157          1HB       MET 157 126.400  -1.671   7.428
  589   1HG   MET 157          2HG       MET 157 126.434   0.361   6.056
  590   2HG   MET 157          1HG       MET 157 127.151   0.603   7.648
  591   1HE   MET 157          1HE       MET 157 127.646   1.301   3.900
  592   2HE   MET 157          2HE       MET 157 127.956  -0.432   4.015
  593   3HE   MET 157          3HE       MET 157 129.264   0.672   3.588
  594    H    LYS 158           H        LYS 158 129.658  -3.936   8.635
  595    HA   LYS 158           HA       LYS 158 127.452  -4.909  10.188
  596   1HB   LYS 158          2HB       LYS 158 129.254  -6.284   8.972
  597   2HB   LYS 158          1HB       LYS 158 130.268  -5.943  10.368
  598   1HG   LYS 158          2HG       LYS 158 129.274  -8.074  10.696
  599   2HG   LYS 158          1HG       LYS 158 128.489  -6.947  11.805
  600   1HD   LYS 158          2HD       LYS 158 126.988  -6.851   9.439
  601   2HD   LYS 158          1HD       LYS 158 127.336  -8.559   9.714
  602   1HE   LYS 158          2HE       LYS 158 126.653  -7.774  12.212
  603   2HE   LYS 158          1HE       LYS 158 125.650  -6.694  11.245
  604   1HZ   LYS 158          1HZ       LYS 158 125.677  -9.513  10.493
  605   2HZ   LYS 158          2HZ       LYS 158 124.406  -8.399  10.464
  606   3HZ   LYS 158          3HZ       LYS 158 124.871  -9.112  11.925
  607    H    GLY 159           H        GLY 159 128.947  -2.283  10.918
  608   1HA   GLY 159          2HA       GLY 159 128.545  -1.528  13.233
  609   2HA   GLY 159          1HA       GLY 159 129.327  -3.006  13.757
  610    H    VAL 160           H        VAL 160 131.103  -2.080  11.170
  611    HA   VAL 160           HA       VAL 160 133.411  -1.483  12.489
  612    HB   VAL 160           HB       VAL 160 134.260  -0.470  10.461
  613   1HG1  VAL 160          1HG1      VAL 160 133.759  -2.957  10.615
  614   2HG1  VAL 160          2HG1      VAL 160 133.983  -2.290   8.997
  615   3HG1  VAL 160          3HG1      VAL 160 132.358  -2.628   9.595
  616   1HG2  VAL 160          1HG2      VAL 160 131.361  -0.285   9.660
  617   2HG2  VAL 160          2HG2      VAL 160 132.700  -0.107   8.526
  618   3HG2  VAL 160          3HG2      VAL 160 132.514   1.034   9.858
  619    H    GLU 161           H        GLU 161 130.956   0.840  11.414
  620    HA   GLU 161           HA       GLU 161 132.408   3.062  12.580
  621   1HB   GLU 161          2HB       GLU 161 129.810   2.819  11.080
  622   2HB   GLU 161          1HB       GLU 161 130.282   4.320  11.863
  623   1HG   GLU 161          2HG       GLU 161 132.185   2.997   9.996
  624   2HG   GLU 161          1HG       GLU 161 130.816   3.895   9.344
  Start of MODEL   10
    1   1H    MET  81          1HT       MET  81  89.018  -3.392   4.117
    2   2H    MET  81          2HT       MET  81  90.686  -3.133   3.810
    3   3H    MET  81          3HT       MET  81  89.670  -1.810   4.216
    4    HA   MET  81           HA       MET  81  90.813  -2.249   6.129
    5   1HB   MET  81          2HB       MET  81  88.121  -2.407   6.004
    6   2HB   MET  81          1HB       MET  81  88.472  -3.968   6.733
    7   1HG   MET  81          2HG       MET  81  89.928  -2.591   8.373
    8   2HG   MET  81          1HG       MET  81  88.970  -1.227   7.802
    9   1HE   MET  81          1HE       MET  81  88.926  -2.504  11.077
   10   2HE   MET  81          2HE       MET  81  87.336  -1.752  11.211
   11   3HE   MET  81          3HE       MET  81  88.618  -0.951  10.301
   12    H    VAL  82           H        VAL  82  92.365  -3.490   6.947
   13    HA   VAL  82           HA       VAL  82  92.267  -6.386   6.421
   14    HB   VAL  82           HB       VAL  82  94.181  -5.238   5.385
   15   1HG1  VAL  82          1HG1      VAL  82  95.590  -4.757   7.907
   16   2HG1  VAL  82          2HG1      VAL  82  94.226  -3.680   7.619
   17   3HG1  VAL  82          3HG1      VAL  82  95.528  -3.787   6.436
   18   1HG2  VAL  82          1HG2      VAL  82  95.003  -7.017   7.679
   19   2HG2  VAL  82          2HG2      VAL  82  95.920  -6.719   6.202
   20   3HG2  VAL  82          3HG2      VAL  82  94.380  -7.574   6.125
   21    H    ARG  83           H        ARG  83  92.980  -7.829   8.067
   22    HA   ARG  83           HA       ARG  83  93.585  -6.929  10.704
   23   1HB   ARG  83          2HB       ARG  83  90.976  -6.678  10.272
   24   2HB   ARG  83          1HB       ARG  83  90.991  -8.397  10.636
   25   1HG   ARG  83          2HG       ARG  83  91.945  -7.986  12.801
   26   2HG   ARG  83          1HG       ARG  83  92.136  -6.271  12.434
   27   1HD   ARG  83          2HD       ARG  83  89.412  -7.353  12.131
   28   2HD   ARG  83          1HD       ARG  83  90.036  -7.305  13.779
   29    HE   ARG  83           HE       ARG  83  89.285  -5.066  12.142
   30   1HH1  ARG  83          1HH1      ARG  83  91.234  -6.111  14.844
   31   2HH1  ARG  83          2HH1      ARG  83  91.314  -4.533  15.555
   32   1HH2  ARG  83          1HH2      ARG  83  89.392  -2.992  13.076
   33   2HH2  ARG  83          2HH2      ARG  83  90.268  -2.762  14.553
   34    H    CYS  84           H        CYS  84  94.701  -8.728   8.791
   35    HA   CYS  84           HA       CYS  84  94.910 -11.079  10.479
   36   1HB   CYS  84          2HB       CYS  84  93.056 -11.432   8.718
   37   2HB   CYS  84          1HB       CYS  84  94.371 -11.505   7.548
   38    HG   CYS  84           HG       CYS  84  93.474 -13.843   8.906
   39    H    MET  85           H        MET  85  96.912 -11.961  10.445
   40    HA   MET  85           HA       MET  85  99.138 -12.174  10.032
   41   1HB   MET  85          2HB       MET  85  97.935 -11.882   7.336
   42   2HB   MET  85          1HB       MET  85  99.676 -11.665   7.447
   43   1HG   MET  85          2HG       MET  85  99.941 -13.857   8.390
   44   2HG   MET  85          1HG       MET  85  98.193 -14.076   8.463
   45   1HE   MET  85          1HE       MET  85 100.287 -16.290   5.847
   46   2HE   MET  85          2HE       MET  85  98.700 -16.656   6.524
   47   3HE   MET  85          3HE       MET  85  99.983 -16.043   7.568
   48    H    LYS  86           H        LYS  86 101.061 -10.919   8.832
   49    HA   LYS  86           HA       LYS  86 100.617  -8.034   9.207
   50   1HB   LYS  86          2HB       LYS  86 101.931  -9.490  11.049
   51   2HB   LYS  86          1HB       LYS  86 103.267  -9.131   9.963
   52   1HG   LYS  86          2HG       LYS  86 103.293  -6.937  10.495
   53   2HG   LYS  86          1HG       LYS  86 101.544  -6.856  10.716
   54   1HD   LYS  86          2HD       LYS  86 102.998  -8.507  12.675
   55   2HD   LYS  86          1HD       LYS  86 103.335  -6.776  12.741
   56   1HE   LYS  86          2HE       LYS  86 100.652  -6.725  12.536
   57   2HE   LYS  86          1HE       LYS  86 100.863  -8.258  13.378
   58   1HZ   LYS  86          1HZ       LYS  86 102.129  -7.118  15.081
   59   2HZ   LYS  86          2HZ       LYS  86 100.602  -6.410  14.919
   60   3HZ   LYS  86          3HZ       LYS  86 101.961  -5.645  14.265
   61    H    ASP  87           H        ASP  87 102.577  -6.767   8.339
   62    HA   ASP  87           HA       ASP  87 103.614  -8.045   5.901
   63   1HB   ASP  87          2HB       ASP  87 101.621  -6.187   5.832
   64   2HB   ASP  87          1HB       ASP  87 103.044  -5.157   5.698
   65    H    ASP  88           H        ASP  88 105.084  -5.931   4.922
   66    HA   ASP  88           HA       ASP  88 107.078  -5.539   7.055
   67   1HB   ASP  88          2HB       ASP  88 107.518  -5.692   4.065
   68   2HB   ASP  88          1HB       ASP  88 108.774  -5.463   5.278
   69    H    SER  89           H        SER  89 106.571  -3.548   7.835
   70    HA   SER  89           HA       SER  89 106.477  -1.336   5.891
   71   1HB   SER  89          2HB       SER  89 105.199  -1.512   8.629
   72   2HB   SER  89          1HB       SER  89 105.167  -0.090   7.587
   73    HG   SER  89           HG       SER  89 103.563  -0.959   6.568
   74    H    LYS  90           H        LYS  90 108.320  -2.737   8.344
   75    HA   LYS  90           HA       LYS  90 109.366  -0.791   9.894
   76   1HB   LYS  90          2HB       LYS  90 110.939  -2.938   8.464
   77   2HB   LYS  90          1HB       LYS  90 111.502  -2.032   9.861
   78   1HG   LYS  90          2HG       LYS  90 109.723  -2.966  11.218
   79   2HG   LYS  90          1HG       LYS  90 109.090  -3.833   9.818
   80   1HD   LYS  90          2HD       LYS  90 111.941  -4.261  10.509
   81   2HD   LYS  90          1HD       LYS  90 110.735  -4.965  11.586
   82   1HE   LYS  90          2HE       LYS  90 111.175  -6.643  10.012
   83   2HE   LYS  90          1HE       LYS  90 109.658  -5.920   9.481
   84   1HZ   LYS  90          1HZ       LYS  90 112.076  -4.753   8.373
   85   2HZ   LYS  90          2HZ       LYS  90 110.599  -5.095   7.626
   86   3HZ   LYS  90          3HZ       LYS  90 111.728  -6.330   7.870
   87    H    GLY  91           H        GLY  91 111.556   0.280   9.742
   88   1HA   GLY  91          2HA       GLY  91 111.535   2.019   7.452
   89   2HA   GLY  91          1HA       GLY  91 112.622   2.116   8.827
   90    H    LYS  92           H        LYS  92 114.647   2.034   8.151
   91    HA   LYS  92           HA       LYS  92 115.342   0.570   5.744
   92   1HB   LYS  92          2HB       LYS  92 117.625   1.563   6.182
   93   2HB   LYS  92          1HB       LYS  92 116.330   2.719   5.899
   94   1HG   LYS  92          2HG       LYS  92 116.622   2.099   8.710
   95   2HG   LYS  92          1HG       LYS  92 118.119   2.716   8.007
   96   1HD   LYS  92          2HD       LYS  92 116.491   4.495   6.946
   97   2HD   LYS  92          1HD       LYS  92 115.467   4.043   8.309
   98   1HE   LYS  92          2HE       LYS  92 117.588   4.417   9.731
   99   2HE   LYS  92          1HE       LYS  92 118.189   5.295   8.326
  100   1HZ   LYS  92          1HZ       LYS  92 116.533   6.893   8.521
  101   2HZ   LYS  92          2HZ       LYS  92 116.976   6.603  10.128
  102   3HZ   LYS  92          3HZ       LYS  92 115.557   5.924   9.507
  103    H    THR  93           H        THR  93 115.936  -1.470   5.789
  104    HA   THR  93           HA       THR  93 117.182  -2.545   8.235
  105    HB   THR  93           HB       THR  93 116.024  -4.410   6.240
  106    HG1  THR  93           HG1      THR  93 113.918  -4.023   7.078
  107   1HG2  THR  93          1HG2      THR  93 115.085  -4.641   8.956
  108   2HG2  THR  93          2HG2      THR  93 116.846  -4.598   8.876
  109   3HG2  THR  93          3HG2      THR  93 115.951  -5.806   7.955
  110    H    GLU  94           H        GLU  94 117.841  -5.048   6.730
  111    HA   GLU  94           HA       GLU  94 120.471  -4.347   5.942
  112   1HB   GLU  94          2HB       GLU  94 119.046  -6.709   6.528
  113   2HB   GLU  94          1HB       GLU  94 119.684  -6.909   4.902
  114   1HG   GLU  94          2HG       GLU  94 121.866  -5.944   6.139
  115   2HG   GLU  94          1HG       GLU  94 121.084  -6.770   7.487
  116    H    GLU  95           H        GLU  95 117.620  -3.938   4.310
  117    HA   GLU  95           HA       GLU  95 118.638  -4.544   1.657
  118   1HB   GLU  95          2HB       GLU  95 116.265  -4.979   2.235
  119   2HB   GLU  95          1HB       GLU  95 116.026  -3.255   2.474
  120   1HG   GLU  95          2HG       GLU  95 115.370  -3.233   0.350
  121   2HG   GLU  95          1HG       GLU  95 117.086  -3.341  -0.041
  122    H    GLU  96           H        GLU  96 118.331  -1.841   3.793
  123    HA   GLU  96           HA       GLU  96 118.466   0.217   1.834
  124   1HB   GLU  96          2HB       GLU  96 118.853   1.717   3.677
  125   2HB   GLU  96          1HB       GLU  96 117.630   0.547   4.154
  126   1HG   GLU  96          2HG       GLU  96 118.824   0.009   5.930
  127   2HG   GLU  96          1HG       GLU  96 120.157  -0.495   4.894
  128    H    LEU  97           H        LEU  97 120.834  -1.750   3.459
  129    HA   LEU  97           HA       LEU  97 123.124  -0.219   3.194
  130   1HB   LEU  97          2HB       LEU  97 122.487  -3.020   3.594
  131   2HB   LEU  97          1HB       LEU  97 123.944  -2.826   2.637
  132    HG   LEU  97           HG       LEU  97 123.677  -1.257   5.162
  133   1HD1  LEU  97          1HD1      LEU  97 123.868  -4.196   4.960
  134   2HD1  LEU  97          2HD1      LEU  97 123.245  -3.180   6.262
  135   3HD1  LEU  97          3HD1      LEU  97 124.985  -3.407   6.074
  136   1HD2  LEU  97          1HD2      LEU  97 125.857  -2.324   3.427
  137   2HD2  LEU  97          2HD2      LEU  97 126.182  -1.992   5.128
  138   3HD2  LEU  97          3HD2      LEU  97 125.623  -0.698   4.068
  139    H    SER  98           H        SER  98 121.272  -1.822   0.744
  140    HA   SER  98           HA       SER  98 123.330  -1.873  -1.241
  141   1HB   SER  98          2HB       SER  98 121.542  -2.457  -2.797
  142   2HB   SER  98          1HB       SER  98 121.370  -3.390  -1.310
  143    HG   SER  98           HG       SER  98 119.427  -2.606  -1.271
  144    H    ASP  99           H        ASP  99 120.781   0.361  -0.319
  145    HA   ASP  99           HA       ASP  99 120.837   2.066  -2.530
  146   1HB   ASP  99          2HB       ASP  99 119.470   1.988  -0.143
  147   2HB   ASP  99          1HB       ASP  99 120.464   3.431   0.041
  148    H    LEU 100           H        LEU 100 122.694   2.205   0.496
  149    HA   LEU 100           HA       LEU 100 124.141   4.540  -0.152
  150   1HB   LEU 100          2HB       LEU 100 124.871   2.276   1.707
  151   2HB   LEU 100          1HB       LEU 100 125.671   3.837   1.656
  152    HG   LEU 100           HG       LEU 100 122.728   3.765   2.146
  153   1HD1  LEU 100          1HD1      LEU 100 122.832   2.994   4.264
  154   2HD1  LEU 100          2HD1      LEU 100 124.460   3.620   4.529
  155   3HD1  LEU 100          3HD1      LEU 100 124.228   2.115   3.641
  156   1HD2  LEU 100          1HD2      LEU 100 124.483   5.784   1.927
  157   2HD2  LEU 100          2HD2      LEU 100 124.595   5.476   3.660
  158   3HD2  LEU 100          3HD2      LEU 100 123.036   5.859   2.932
  159    H    PHE 101           H        PHE 101 124.493   1.240  -1.112
  160    HA   PHE 101           HA       PHE 101 127.237   1.213  -1.724
  161   1HB   PHE 101          2HB       PHE 101 125.758  -0.804  -1.604
  162   2HB   PHE 101          1HB       PHE 101 125.053  -0.323  -3.145
  163    HD1  PHE 101           HD1      PHE 101 126.374  -0.419  -5.199
  164    HD2  PHE 101           HD2      PHE 101 127.940  -1.775  -1.482
  165    HE1  PHE 101           HE1      PHE 101 128.166  -1.609  -6.392
  166    HE2  PHE 101           HE2      PHE 101 129.736  -2.966  -2.669
  167    HZ   PHE 101           HZ       PHE 101 129.851  -2.884  -5.127
  168    H    ARG 102           H        ARG 102 124.428   1.789  -3.859
  169    HA   ARG 102           HA       ARG 102 125.826   2.321  -6.192
  170   1HB   ARG 102          2HB       ARG 102 123.215   2.215  -5.564
  171   2HB   ARG 102          1HB       ARG 102 123.407   3.960  -5.664
  172   1HG   ARG 102          2HG       ARG 102 123.789   3.932  -7.908
  173   2HG   ARG 102          1HG       ARG 102 124.492   2.313  -7.882
  174   1HD   ARG 102          2HD       ARG 102 122.545   1.529  -8.611
  175   2HD   ARG 102          1HD       ARG 102 121.839   1.988  -7.060
  176    HE   ARG 102           HE       ARG 102 121.492   3.314  -9.589
  177   1HH1  ARG 102          1HH1      ARG 102 121.379   3.687  -6.120
  178   2HH1  ARG 102          2HH1      ARG 102 120.287   5.029  -6.175
  179   1HH2  ARG 102          1HH2      ARG 102 120.053   5.077  -9.662
  180   2HH2  ARG 102          2HH2      ARG 102 119.531   5.817  -8.186
  181    H    MET 103           H        MET 103 124.882   4.542  -3.596
  182    HA   MET 103           HA       MET 103 125.671   6.944  -4.731
  183   1HB   MET 103          2HB       MET 103 125.467   5.940  -1.926
  184   2HB   MET 103          1HB       MET 103 126.258   7.487  -2.207
  185   1HG   MET 103          2HG       MET 103 124.128   8.047  -3.569
  186   2HG   MET 103          1HG       MET 103 123.414   6.706  -2.672
  187   1HE   MET 103          1HE       MET 103 121.993   8.986  -2.619
  188   2HE   MET 103          2HE       MET 103 122.077  10.094  -1.250
  189   3HE   MET 103          3HE       MET 103 121.534   8.434  -1.009
  190    H    PHE 104           H        PHE 104 127.606   4.357  -3.454
  191    HA   PHE 104           HA       PHE 104 130.023   5.957  -3.375
  192   1HB   PHE 104          2HB       PHE 104 129.249   3.211  -2.556
  193   2HB   PHE 104          1HB       PHE 104 130.932   3.454  -3.012
  194    HD1  PHE 104           HD1      PHE 104 131.991   3.211  -0.939
  195    HD2  PHE 104           HD2      PHE 104 128.724   5.908  -1.336
  196    HE1  PHE 104           HE1      PHE 104 132.470   4.116   1.299
  197    HE2  PHE 104           HE2      PHE 104 129.197   6.819   0.901
  198    HZ   PHE 104           HZ       PHE 104 131.073   5.922   2.221
  199    H    ASP 105           H        ASP 105 128.310   4.186  -5.707
  200    HA   ASP 105           HA       ASP 105 130.704   3.632  -7.295
  201   1HB   ASP 105          2HB       ASP 105 128.491   2.116  -6.923
  202   2HB   ASP 105          1HB       ASP 105 128.034   2.976  -8.391
  203    H    LYS 106           H        LYS 106 131.080   4.549  -9.294
  204    HA   LYS 106           HA       LYS 106 129.394   6.874  -9.955
  205   1HB   LYS 106          2HB       LYS 106 132.359   6.464 -10.051
  206   2HB   LYS 106          1HB       LYS 106 131.606   7.617 -11.143
  207   1HG   LYS 106          2HG       LYS 106 130.828   7.852  -8.315
  208   2HG   LYS 106          1HG       LYS 106 132.510   8.232  -8.687
  209   1HD   LYS 106          2HD       LYS 106 131.971  10.107  -9.822
  210   2HD   LYS 106          1HD       LYS 106 130.524   9.385 -10.526
  211   1HE   LYS 106          2HE       LYS 106 129.987  11.236  -9.003
  212   2HE   LYS 106          1HE       LYS 106 129.318   9.702  -8.447
  213   1HZ   LYS 106          1HZ       LYS 106 130.983   9.519  -6.804
  214   2HZ   LYS 106          2HZ       LYS 106 130.407  11.106  -6.703
  215   3HZ   LYS 106          3HZ       LYS 106 131.889  10.791  -7.455
  216    H    ASN 107           H        ASN 107 131.306   4.215 -11.286
  217    HA   ASN 107           HA       ASN 107 130.498   4.784 -13.993
  218   1HB   ASN 107          2HB       ASN 107 131.799   2.241 -13.032
  219   2HB   ASN 107          1HB       ASN 107 131.868   2.961 -14.638
  220   1HD2  ASN 107          1HD2      ASN 107 132.493   5.542 -14.119
  221   2HD2  ASN 107          2HD2      ASN 107 134.049   5.643 -13.372
  222    H    ALA 108           H        ALA 108 128.801   3.540 -11.486
  223    HA   ALA 108           HA       ALA 108 127.028   2.120 -11.246
  224   1HB   ALA 108          1HB       ALA 108 125.635   2.117 -13.531
  225   2HB   ALA 108          2HB       ALA 108 126.696   3.490 -13.845
  226   3HB   ALA 108          3HB       ALA 108 125.656   3.486 -12.421
  227    H    ASP 109           H        ASP 109 128.924   0.456 -11.321
  228    HA   ASP 109           HA       ASP 109 128.269  -1.536 -13.393
  229   1HB   ASP 109          2HB       ASP 109 130.640  -2.358 -13.085
  230   2HB   ASP 109          1HB       ASP 109 130.479  -0.788 -13.867
  231    H    GLY 110           H        GLY 110 128.223  -0.845 -10.102
  232   1HA   GLY 110          2HA       GLY 110 127.232  -2.285  -8.511
  233   2HA   GLY 110          1HA       GLY 110 127.688  -3.660  -9.508
  234    H    TYR 111           H        TYR 111 130.421  -2.057  -9.611
  235    HA   TYR 111           HA       TYR 111 131.407  -3.030  -7.012
  236   1HB   TYR 111          2HB       TYR 111 132.863  -3.240  -9.657
  237   2HB   TYR 111          1HB       TYR 111 133.448  -3.807  -8.096
  238    HD1  TYR 111           HD1      TYR 111 133.012  -5.995  -7.414
  239    HD2  TYR 111           HD2      TYR 111 130.689  -4.300 -10.550
  240    HE1  TYR 111           HE1      TYR 111 131.969  -8.184  -7.816
  241    HE2  TYR 111           HE2      TYR 111 129.639  -6.486 -10.961
  242    HH   TYR 111           HH       TYR 111 130.252  -8.925 -10.567
  243    H    ILE 112           H        ILE 112 132.973  -1.797  -6.007
  244    HA   ILE 112           HA       ILE 112 133.443   0.849  -7.210
  245    HB   ILE 112           HB       ILE 112 133.671   0.118  -4.292
  246   1HG1  ILE 112          2HG1      ILE 112 131.404   1.636  -5.578
  247   2HG1  ILE 112          1HG1      ILE 112 131.342  -0.105  -5.320
  248   1HG2  ILE 112          1HG2      ILE 112 134.876   2.044  -4.445
  249   2HG2  ILE 112          2HG2      ILE 112 133.263   2.738  -4.278
  250   3HG2  ILE 112          3HG2      ILE 112 134.006   2.606  -5.873
  251   1HD1  ILE 112          1HD1      ILE 112 131.988   1.653  -3.013
  252   2HD1  ILE 112          2HD1      ILE 112 131.153   0.100  -3.055
  253   3HD1  ILE 112          3HD1      ILE 112 130.321   1.563  -3.583
  254    H    ASP 113           H        ASP 113 135.460   1.542  -7.597
  255    HA   ASP 113           HA       ASP 113 137.669  -0.245  -6.834
  256   1HB   ASP 113          2HB       ASP 113 136.949   0.734  -9.331
  257   2HB   ASP 113          1HB       ASP 113 138.304   1.755  -8.860
  258    H    LEU 114           H        LEU 114 139.820   0.915  -6.611
  259    HA   LEU 114           HA       LEU 114 139.714   2.691  -4.458
  260   1HB   LEU 114          2HB       LEU 114 142.172   3.137  -5.138
  261   2HB   LEU 114          1HB       LEU 114 141.706   1.538  -4.592
  262    HG   LEU 114           HG       LEU 114 141.490   1.855  -7.489
  263   1HD1  LEU 114          1HD1      LEU 114 143.567   3.264  -6.574
  264   2HD1  LEU 114          2HD1      LEU 114 143.619   2.343  -8.079
  265   3HD1  LEU 114          3HD1      LEU 114 144.304   1.662  -6.603
  266   1HD2  LEU 114          1HD2      LEU 114 141.367  -0.328  -6.820
  267   2HD2  LEU 114          2HD2      LEU 114 142.523  -0.108  -5.507
  268   3HD2  LEU 114          3HD2      LEU 114 143.091  -0.211  -7.174
  269    H    GLU 115           H        GLU 115 140.233   3.307  -7.909
  270    HA   GLU 115           HA       GLU 115 140.660   6.101  -7.616
  271   1HB   GLU 115          2HB       GLU 115 140.553   4.177  -9.766
  272   2HB   GLU 115          1HB       GLU 115 139.673   5.635 -10.206
  273   1HG   GLU 115          2HG       GLU 115 141.621   6.518 -10.775
  274   2HG   GLU 115          1HG       GLU 115 142.010   6.576  -9.056
  275    H    GLU 116           H        GLU 116 137.835   4.135  -7.673
  276    HA   GLU 116           HA       GLU 116 136.053   6.289  -8.432
  277   1HB   GLU 116          2HB       GLU 116 135.872   3.607  -8.704
  278   2HB   GLU 116          1HB       GLU 116 134.959   3.820  -7.217
  279   1HG   GLU 116          2HG       GLU 116 133.418   5.290  -8.292
  280   2HG   GLU 116          1HG       GLU 116 134.401   5.332  -9.755
  281    H    LEU 117           H        LEU 117 136.379   4.208  -5.563
  282    HA   LEU 117           HA       LEU 117 134.653   5.477  -3.856
  283   1HB   LEU 117          2HB       LEU 117 135.993   3.367  -3.457
  284   2HB   LEU 117          1HB       LEU 117 137.329   4.401  -2.990
  285    HG   LEU 117           HG       LEU 117 135.893   5.355  -1.186
  286   1HD1  LEU 117          1HD1      LEU 117 133.959   3.586  -0.670
  287   2HD1  LEU 117          2HD1      LEU 117 133.948   3.513  -2.433
  288   3HD1  LEU 117          3HD1      LEU 117 133.692   5.053  -1.613
  289   1HD2  LEU 117          1HD2      LEU 117 137.306   3.832  -0.267
  290   2HD2  LEU 117          2HD2      LEU 117 136.775   2.530  -1.332
  291   3HD2  LEU 117          3HD2      LEU 117 135.782   3.002   0.047
  292    H    LYS 118           H        LYS 118 137.814   6.538  -4.865
  293    HA   LYS 118           HA       LYS 118 138.110   8.519  -2.812
  294   1HB   LYS 118          2HB       LYS 118 140.065   9.240  -4.033
  295   2HB   LYS 118          1HB       LYS 118 140.041   7.484  -3.958
  296   1HG   LYS 118          2HG       LYS 118 140.193   7.373  -6.160
  297   2HG   LYS 118          1HG       LYS 118 138.691   8.284  -6.326
  298   1HD   LYS 118          2HD       LYS 118 140.120  10.369  -5.959
  299   2HD   LYS 118          1HD       LYS 118 141.513   9.320  -6.236
  300   1HE   LYS 118          2HE       LYS 118 140.405   8.643  -8.406
  301   2HE   LYS 118          1HE       LYS 118 139.267   9.961  -8.134
  302   1HZ   LYS 118          1HZ       LYS 118 141.166  10.554  -9.577
  303   2HZ   LYS 118          2HZ       LYS 118 142.211  10.309  -8.270
  304   3HZ   LYS 118          3HZ       LYS 118 141.047  11.532  -8.201
  305    H    ILE 119           H        ILE 119 136.453   8.379  -5.817
  306    HA   ILE 119           HA       ILE 119 136.509  11.122  -6.505
  307    HB   ILE 119           HB       ILE 119 134.314   9.157  -7.154
  308   1HG1  ILE 119          2HG1      ILE 119 136.914   9.697  -8.610
  309   2HG1  ILE 119          1HG1      ILE 119 136.482   8.209  -7.775
  310   1HG2  ILE 119          1HG2      ILE 119 135.260  11.604  -8.639
  311   2HG2  ILE 119          2HG2      ILE 119 133.835  11.537  -7.603
  312   3HG2  ILE 119          3HG2      ILE 119 133.903  10.564  -9.072
  313   1HD1  ILE 119          1HD1      ILE 119 135.026   9.317 -10.161
  314   2HD1  ILE 119          2HD1      ILE 119 134.743   7.764  -9.373
  315   3HD1  ILE 119          3HD1      ILE 119 136.261   8.060 -10.222
  316    H    MET 120           H        MET 120 133.887   9.201  -5.032
  317    HA   MET 120           HA       MET 120 132.174  11.306  -4.452
  318   1HB   MET 120          2HB       MET 120 131.284   9.772  -2.639
  319   2HB   MET 120          1HB       MET 120 131.324   9.107  -4.266
  320   1HG   MET 120          2HG       MET 120 132.694   7.465  -3.668
  321   2HG   MET 120          1HG       MET 120 133.766   8.565  -2.806
  322   1HE   MET 120          1HE       MET 120 133.921   6.593  -0.168
  323   2HE   MET 120          2HE       MET 120 133.471   8.149   0.532
  324   3HE   MET 120          3HE       MET 120 134.427   8.091  -0.949
  325    H    LEU 121           H        LEU 121 135.021  10.214  -2.755
  326    HA   LEU 121           HA       LEU 121 134.544  11.522  -0.297
  327   1HB   LEU 121          2HB       LEU 121 136.853  10.273  -1.653
  328   2HB   LEU 121          1HB       LEU 121 137.246  11.470  -0.431
  329    HG   LEU 121           HG       LEU 121 135.279   9.379   0.324
  330   1HD1  LEU 121          1HD1      LEU 121 136.819   7.957  -0.771
  331   2HD1  LEU 121          2HD1      LEU 121 137.208   7.878   0.947
  332   3HD1  LEU 121          3HD1      LEU 121 138.203   8.848  -0.141
  333   1HD2  LEU 121          1HD2      LEU 121 137.625  10.647   1.735
  334   2HD2  LEU 121          2HD2      LEU 121 136.434   9.568   2.461
  335   3HD2  LEU 121          3HD2      LEU 121 135.942  11.155   1.872
  336    H    GLN 122           H        GLN 122 135.858  12.594  -3.353
  337    HA   GLN 122           HA       GLN 122 136.967  15.034  -2.380
  338   1HB   GLN 122          2HB       GLN 122 136.221  14.076  -5.140
  339   2HB   GLN 122          1HB       GLN 122 136.909  15.666  -4.846
  340   1HG   GLN 122          2HG       GLN 122 138.288  13.202  -3.865
  341   2HG   GLN 122          1HG       GLN 122 138.461  13.732  -5.538
  342   1HE2  GLN 122          1HE2      GLN 122 140.013  13.750  -2.758
  343   2HE2  GLN 122          2HE2      GLN 122 140.844  15.261  -2.843
  344    H    ALA 123           H        ALA 123 133.812  14.031  -3.462
  345    HA   ALA 123           HA       ALA 123 132.759  16.641  -3.901
  346   1HB   ALA 123          1HB       ALA 123 130.852  15.595  -4.515
  347   2HB   ALA 123          2HB       ALA 123 130.905  14.465  -3.162
  348   3HB   ALA 123          3HB       ALA 123 131.917  14.191  -4.580
  349    H    THR 124           H        THR 124 133.470  14.874  -1.072
  350    HA   THR 124           HA       THR 124 131.438  15.828   0.643
  351    HB   THR 124           HB       THR 124 132.857  15.091   2.460
  352    HG1  THR 124           HG1      THR 124 134.921  15.276   2.287
  353   1HG2  THR 124          1HG2      THR 124 133.519  13.128   0.314
  354   2HG2  THR 124          2HG2      THR 124 131.848  13.370   0.824
  355   3HG2  THR 124          3HG2      THR 124 133.060  12.846   1.994
  356    H    GLY 125           H        GLY 125 131.995  17.238   2.598
  357   1HA   GLY 125          2HA       GLY 125 133.030  19.758   1.560
  358   2HA   GLY 125          1HA       GLY 125 132.125  19.539   3.049
  359    H    GLU 126           H        GLU 126 134.342  17.168   3.186
  360    HA   GLU 126           HA       GLU 126 136.206  18.853   4.709
  361   1HB   GLU 126          2HB       GLU 126 135.941  15.855   4.901
  362   2HB   GLU 126          1HB       GLU 126 136.714  16.948   6.042
  363   1HG   GLU 126          2HG       GLU 126 134.126  17.880   5.924
  364   2HG   GLU 126          1HG       GLU 126 133.938  16.130   5.829
  365    H    THR 127           H        THR 127 138.443  17.517   4.886
  366    HA   THR 127           HA       THR 127 139.275  16.967   2.111
  367    HB   THR 127           HB       THR 127 141.445  17.957   2.635
  368    HG1  THR 127           HG1      THR 127 140.304  18.471   5.179
  369   1HG2  THR 127          1HG2      THR 127 140.062  19.602   1.752
  370   2HG2  THR 127          2HG2      THR 127 140.694  20.325   3.231
  371   3HG2  THR 127          3HG2      THR 127 139.057  19.669   3.200
  372    H    ILE 128           H        ILE 128 139.864  14.932   1.825
  373    HA   ILE 128           HA       ILE 128 141.052  13.473   4.096
  374    HB   ILE 128           HB       ILE 128 139.643  12.175   1.773
  375   1HG1  ILE 128          2HG1      ILE 128 138.003  13.593   2.859
  376   2HG1  ILE 128          1HG1      ILE 128 137.692  11.916   3.297
  377   1HG2  ILE 128          1HG2      ILE 128 140.819  11.275   4.345
  378   2HG2  ILE 128          2HG2      ILE 128 140.830  10.502   2.761
  379   3HG2  ILE 128          3HG2      ILE 128 139.378  10.447   3.760
  380   1HD1  ILE 128          1HD1      ILE 128 138.465  12.222   5.473
  381   2HD1  ILE 128          2HD1      ILE 128 137.539  13.684   5.126
  382   3HD1  ILE 128          3HD1      ILE 128 139.302  13.720   5.062
  383    H    THR 129           H        THR 129 142.853  12.191   3.737
  384    HA   THR 129           HA       THR 129 144.460  12.949   1.455
  385    HB   THR 129           HB       THR 129 145.363  10.889   3.414
  386    HG1  THR 129           HG1      THR 129 144.997  13.634   4.005
  387   1HG2  THR 129          1HG2      THR 129 146.592  12.962   1.728
  388   2HG2  THR 129          2HG2      THR 129 147.188  11.369   2.196
  389   3HG2  THR 129          3HG2      THR 129 147.313  12.723   3.319
  390    H    GLU 130           H        GLU 130 145.844  11.085   0.484
  391    HA   GLU 130           HA       GLU 130 143.978   9.263  -0.748
  392   1HB   GLU 130          2HB       GLU 130 146.759  10.148  -1.240
  393   2HB   GLU 130          1HB       GLU 130 146.364   8.519  -1.770
  394   1HG   GLU 130          2HG       GLU 130 144.476  10.673  -2.506
  395   2HG   GLU 130          1HG       GLU 130 146.042  10.653  -3.315
  396    H    ASP 131           H        ASP 131 146.549   9.117   1.616
  397    HA   ASP 131           HA       ASP 131 146.903   6.312   1.623
  398   1HB   ASP 131          2HB       ASP 131 147.331   8.167   3.968
  399   2HB   ASP 131          1HB       ASP 131 148.120   6.622   3.664
  400    H    ASP 132           H        ASP 132 144.970   8.453   3.710
  401    HA   ASP 132           HA       ASP 132 143.908   6.581   5.433
  402   1HB   ASP 132          2HB       ASP 132 142.779   9.140   4.320
  403   2HB   ASP 132          1HB       ASP 132 141.881   8.171   5.485
  404    H    ILE 133           H        ILE 133 142.877   7.398   2.162
  405    HA   ILE 133           HA       ILE 133 140.551   5.706   2.270
  406    HB   ILE 133           HB       ILE 133 141.862   6.865  -0.188
  407   1HG1  ILE 133          2HG1      ILE 133 141.409   8.688   1.327
  408   2HG1  ILE 133          1HG1      ILE 133 140.185   8.701   0.061
  409   1HG2  ILE 133          1HG2      ILE 133 140.331   5.387  -1.019
  410   2HG2  ILE 133          2HG2      ILE 133 139.300   6.805  -0.818
  411   3HG2  ILE 133          3HG2      ILE 133 139.276   5.518   0.388
  412   1HD1  ILE 133          1HD1      ILE 133 138.873   7.250   1.846
  413   2HD1  ILE 133          2HD1      ILE 133 138.853   9.013   1.864
  414   3HD1  ILE 133          3HD1      ILE 133 139.927   8.134   2.951
  415    H    GLU 134           H        GLU 134 143.815   5.485   0.920
  416    HA   GLU 134           HA       GLU 134 143.568   3.172  -0.576
  417   1HB   GLU 134          2HB       GLU 134 145.796   4.542   0.817
  418   2HB   GLU 134          1HB       GLU 134 146.071   2.867   0.362
  419   1HG   GLU 134          2HG       GLU 134 145.398   3.478  -1.966
  420   2HG   GLU 134          1HG       GLU 134 145.377   5.164  -1.450
  421    H    GLU 135           H        GLU 135 143.544   3.550   2.863
  422    HA   GLU 135           HA       GLU 135 144.001   0.708   3.324
  423   1HB   GLU 135          2HB       GLU 135 143.918   1.288   5.705
  424   2HB   GLU 135          1HB       GLU 135 145.072   2.292   4.840
  425   1HG   GLU 135          2HG       GLU 135 143.760   4.184   5.013
  426   2HG   GLU 135          1HG       GLU 135 142.282   3.259   5.280
  427    H    LEU 136           H        LEU 136 141.514   2.024   2.049
  428    HA   LEU 136           HA       LEU 136 139.484   1.005   3.903
  429   1HB   LEU 136          2HB       LEU 136 139.556   3.320   2.447
  430   2HB   LEU 136          1HB       LEU 136 138.582   2.285   1.420
  431    HG   LEU 136           HG       LEU 136 137.353   1.841   3.768
  432   1HD1  LEU 136          1HD1      LEU 136 137.773   4.747   4.062
  433   2HD1  LEU 136          2HD1      LEU 136 139.089   3.703   4.597
  434   3HD1  LEU 136          3HD1      LEU 136 137.476   3.511   5.284
  435   1HD2  LEU 136          1HD2      LEU 136 135.835   3.803   3.056
  436   2HD2  LEU 136          2HD2      LEU 136 136.052   2.451   1.945
  437   3HD2  LEU 136          3HD2      LEU 136 136.938   3.953   1.688
  438    H    MET 137           H        MET 137 140.905   0.492   0.762
  439    HA   MET 137           HA       MET 137 138.907  -1.375  -0.123
  440   1HB   MET 137          2HB       MET 137 141.058   0.034  -1.301
  441   2HB   MET 137          1HB       MET 137 141.397  -1.677  -1.524
  442   1HG   MET 137          2HG       MET 137 140.202  -1.037  -3.424
  443   2HG   MET 137          1HG       MET 137 139.030  -1.878  -2.411
  444   1HE   MET 137          1HE       MET 137 137.176  -0.099  -4.409
  445   2HE   MET 137          2HE       MET 137 136.226   0.258  -2.966
  446   3HE   MET 137          3HE       MET 137 137.046  -1.294  -3.121
  447    H    LYS 138           H        LYS 138 142.184  -1.589   1.202
  448    HA   LYS 138           HA       LYS 138 142.526  -4.353   0.971
  449   1HB   LYS 138          2HB       LYS 138 144.167  -2.438   1.717
  450   2HB   LYS 138          1HB       LYS 138 143.629  -2.881   3.330
  451   1HG   LYS 138          2HG       LYS 138 144.686  -4.921   1.404
  452   2HG   LYS 138          1HG       LYS 138 145.750  -3.975   2.446
  453   1HD   LYS 138          2HD       LYS 138 145.330  -5.335   4.155
  454   2HD   LYS 138          1HD       LYS 138 143.601  -5.015   4.016
  455   1HE   LYS 138          2HE       LYS 138 143.780  -6.719   2.022
  456   2HE   LYS 138          1HE       LYS 138 145.221  -7.248   2.889
  457   1HZ   LYS 138          1HZ       LYS 138 143.581  -7.252   4.901
  458   2HZ   LYS 138          2HZ       LYS 138 143.630  -8.563   3.834
  459   3HZ   LYS 138          3HZ       LYS 138 142.405  -7.407   3.693
  460    H    ASP 139           H        ASP 139 141.043  -2.421   3.534
  461    HA   ASP 139           HA       ASP 139 140.434  -4.808   5.080
  462   1HB   ASP 139          2HB       ASP 139 141.001  -2.233   5.816
  463   2HB   ASP 139          1HB       ASP 139 139.246  -2.262   5.947
  464    H    GLY 140           H        GLY 140 139.131  -3.703   2.387
  465   1HA   GLY 140          2HA       GLY 140 136.382  -4.327   3.263
  466   2HA   GLY 140          1HA       GLY 140 136.716  -3.065   2.088
  467    H    ASP 141           H        ASP 141 138.913  -5.450   1.495
  468    HA   ASP 141           HA       ASP 141 137.134  -6.753  -0.458
  469   1HB   ASP 141          2HB       ASP 141 139.724  -5.437  -0.779
  470   2HB   ASP 141          1HB       ASP 141 139.701  -7.066  -1.449
  471    H    LYS 142           H        LYS 142 136.687  -8.713   0.322
  472    HA   LYS 142           HA       LYS 142 138.520 -10.180   1.970
  473   1HB   LYS 142          2HB       LYS 142 136.028 -11.251   0.647
  474   2HB   LYS 142          1HB       LYS 142 136.823 -11.859   2.092
  475   1HG   LYS 142          2HG       LYS 142 135.289  -9.290   1.790
  476   2HG   LYS 142          1HG       LYS 142 134.860 -10.697   2.764
  477   1HD   LYS 142          2HD       LYS 142 137.390  -9.997   3.665
  478   2HD   LYS 142          1HD       LYS 142 136.582  -8.449   3.405
  479   1HE   LYS 142          2HE       LYS 142 134.714  -9.186   4.793
  480   2HE   LYS 142          1HE       LYS 142 135.501 -10.746   5.037
  481   1HZ   LYS 142          1HZ       LYS 142 137.028  -9.858   6.451
  482   2HZ   LYS 142          2HZ       LYS 142 135.734  -8.816   6.773
  483   3HZ   LYS 142          3HZ       LYS 142 136.983  -8.321   5.745
  484    H    ASN 143           H        ASN 143 137.459 -10.323  -1.388
  485    HA   ASN 143           HA       ASN 143 139.099 -12.653  -1.927
  486   1HB   ASN 143          2HB       ASN 143 138.276 -12.307  -4.290
  487   2HB   ASN 143          1HB       ASN 143 137.016 -12.594  -3.093
  488   1HD2  ASN 143          1HD2      ASN 143 135.960 -11.589  -5.144
  489   2HD2  ASN 143          2HD2      ASN 143 135.700  -9.884  -5.058
  490    H    ASN 144           H        ASN 144 139.727  -9.441  -1.571
  491    HA   ASN 144           HA       ASN 144 141.293  -7.970  -2.339
  492   1HB   ASN 144          2HB       ASN 144 143.558  -8.863  -2.339
  493   2HB   ASN 144          1HB       ASN 144 142.631  -9.568  -1.018
  494   1HD2  ASN 144          1HD2      ASN 144 142.867 -11.659  -0.766
  495   2HD2  ASN 144          2HD2      ASN 144 143.300 -12.795  -1.993
  496    H    ASP 145           H        ASP 145 139.585  -8.865  -4.427
  497    HA   ASP 145           HA       ASP 145 141.190  -9.475  -6.732
  498   1HB   ASP 145          2HB       ASP 145 139.094  -9.224  -7.988
  499   2HB   ASP 145          1HB       ASP 145 138.870 -10.257  -6.580
  500    H    GLY 146           H        GLY 146 139.726  -6.611  -5.311
  501   1HA   GLY 146          2HA       GLY 146 141.223  -4.596  -5.795
  502   2HA   GLY 146          1HA       GLY 146 140.902  -4.984  -7.477
  503    H    ARG 147           H        ARG 147 138.096  -5.770  -6.102
  504    HA   ARG 147           HA       ARG 147 137.036  -3.050  -5.913
  505   1HB   ARG 147          2HB       ARG 147 135.651  -5.104  -7.626
  506   2HB   ARG 147          1HB       ARG 147 135.339  -3.377  -7.527
  507   1HG   ARG 147          2HG       ARG 147 137.791  -3.184  -8.416
  508   2HG   ARG 147          1HG       ARG 147 137.500  -4.834  -8.968
  509   1HD   ARG 147          2HD       ARG 147 135.211  -3.477  -9.720
  510   2HD   ARG 147          1HD       ARG 147 136.501  -2.313 -10.016
  511    HE   ARG 147           HE       ARG 147 137.054  -4.939 -11.044
  512   1HH1  ARG 147          1HH1      ARG 147 135.539  -1.867 -11.707
  513   2HH1  ARG 147          2HH1      ARG 147 135.635  -2.050 -13.426
  514   1HH2  ARG 147          1HH2      ARG 147 137.181  -5.181 -13.305
  515   2HH2  ARG 147          2HH2      ARG 147 136.566  -3.931 -14.334
  516    H    ILE 148           H        ILE 148 135.030  -2.896  -4.816
  517    HA   ILE 148           HA       ILE 148 134.445  -5.250  -3.148
  518    HB   ILE 148           HB       ILE 148 133.784  -2.364  -2.549
  519   1HG1  ILE 148          2HG1      ILE 148 135.916  -3.979  -1.172
  520   2HG1  ILE 148          1HG1      ILE 148 136.278  -3.075  -2.638
  521   1HG2  ILE 148          1HG2      ILE 148 132.328  -4.069  -1.498
  522   2HG2  ILE 148          2HG2      ILE 148 133.261  -3.133  -0.330
  523   3HG2  ILE 148          3HG2      ILE 148 133.755  -4.775  -0.742
  524   1HD1  ILE 148          1HD1      ILE 148 135.216  -1.928  -0.067
  525   2HD1  ILE 148          2HD1      ILE 148 135.564  -1.016  -1.536
  526   3HD1  ILE 148          3HD1      ILE 148 136.872  -1.811  -0.662
  527    H    ASP 149           H        ASP 149 132.479  -6.138  -3.148
  528    HA   ASP 149           HA       ASP 149 130.436  -4.914  -4.868
  529   1HB   ASP 149          2HB       ASP 149 129.460  -7.162  -5.028
  530   2HB   ASP 149          1HB       ASP 149 131.148  -7.164  -5.530
  531    H    TYR 150           H        TYR 150 128.140  -5.952  -4.087
  532    HA   TYR 150           HA       TYR 150 127.459  -4.497  -1.779
  533   1HB   TYR 150          2HB       TYR 150 125.837  -4.997  -3.544
  534   2HB   TYR 150          1HB       TYR 150 125.936  -6.712  -3.169
  535    HD1  TYR 150           HD1      TYR 150 125.460  -3.619  -1.107
  536    HD2  TYR 150           HD2      TYR 150 124.001  -7.470  -2.182
  537    HE1  TYR 150           HE1      TYR 150 123.613  -3.364   0.499
  538    HE2  TYR 150           HE2      TYR 150 122.152  -7.223  -0.578
  539    HH   TYR 150           HH       TYR 150 120.963  -4.803   0.501
  540    H    ASP 151           H        ASP 151 128.016  -7.951  -2.285
  541    HA   ASP 151           HA       ASP 151 127.279  -8.869   0.244
  542   1HB   ASP 151          2HB       ASP 151 129.500  -9.958  -1.503
  543   2HB   ASP 151          1HB       ASP 151 128.655 -10.828  -0.226
  544    H    GLU 152           H        GLU 152 130.510  -7.963  -0.938
  545    HA   GLU 152           HA       GLU 152 131.827  -8.273   1.525
  546   1HB   GLU 152          2HB       GLU 152 132.582  -6.444  -0.759
  547   2HB   GLU 152          1HB       GLU 152 133.652  -7.014   0.514
  548   1HG   GLU 152          2HG       GLU 152 133.145  -9.356  -0.309
  549   2HG   GLU 152          1HG       GLU 152 132.414  -8.590  -1.719
  550    H    PHE 153           H        PHE 153 130.577  -5.334  -0.064
  551    HA   PHE 153           HA       PHE 153 131.326  -3.548   1.968
  552   1HB   PHE 153          2HB       PHE 153 129.954  -3.392  -0.491
  553   2HB   PHE 153          1HB       PHE 153 128.890  -2.675   0.712
  554    HD1  PHE 153           HD1      PHE 153 130.286  -1.123   2.454
  555    HD2  PHE 153           HD2      PHE 153 131.324  -1.933  -1.593
  556    HE1  PHE 153           HE1      PHE 153 131.599   0.957   2.380
  557    HE2  PHE 153           HE2      PHE 153 132.641   0.145  -1.673
  558    HZ   PHE 153           HZ       PHE 153 132.778   1.592   0.314
  559    H    LEU 154           H        LEU 154 128.675  -5.770   1.754
  560    HA   LEU 154           HA       LEU 154 126.886  -4.596   3.553
  561   1HB   LEU 154          2HB       LEU 154 127.021  -6.964   2.110
  562   2HB   LEU 154          1HB       LEU 154 127.026  -7.501   3.777
  563    HG   LEU 154           HG       LEU 154 124.898  -6.569   4.203
  564   1HD1  LEU 154          1HD1      LEU 154 124.960  -4.422   3.283
  565   2HD1  LEU 154          2HD1      LEU 154 123.719  -5.258   2.352
  566   3HD1  LEU 154          3HD1      LEU 154 125.328  -5.026   1.667
  567   1HD2  LEU 154          1HD2      LEU 154 125.116  -7.940   1.553
  568   2HD2  LEU 154          2HD2      LEU 154 123.545  -7.420   2.167
  569   3HD2  LEU 154          3HD2      LEU 154 124.520  -8.564   3.091
  570    H    GLU 155           H        GLU 155 129.791  -6.480   4.084
  571    HA   GLU 155           HA       GLU 155 129.334  -6.513   6.967
  572   1HB   GLU 155          2HB       GLU 155 131.345  -7.831   5.160
  573   2HB   GLU 155          1HB       GLU 155 131.594  -7.768   6.899
  574   1HG   GLU 155          2HG       GLU 155 128.941  -8.708   6.162
  575   2HG   GLU 155          1HG       GLU 155 130.239  -9.718   5.528
  576    H    PHE 156           H        PHE 156 131.387  -5.030   4.543
  577    HA   PHE 156           HA       PHE 156 133.381  -3.949   6.140
  578   1HB   PHE 156          2HB       PHE 156 133.155  -3.896   3.587
  579   2HB   PHE 156          1HB       PHE 156 132.162  -2.463   3.820
  580    HD1  PHE 156           HD1      PHE 156 135.237  -3.520   5.622
  581    HD2  PHE 156           HD2      PHE 156 133.429  -0.718   2.978
  582    HE1  PHE 156           HE1      PHE 156 137.267  -2.133   5.711
  583    HE2  PHE 156           HE2      PHE 156 135.457   0.673   3.061
  584    HZ   PHE 156           HZ       PHE 156 137.379  -0.034   4.428
  585    H    MET 157           H        MET 157 130.049  -3.118   5.934
  586    HA   MET 157           HA       MET 157 130.275  -0.464   6.977
  587   1HB   MET 157          2HB       MET 157 128.131  -2.264   6.151
  588   2HB   MET 157          1HB       MET 157 127.712  -1.350   7.594
  589   1HG   MET 157          2HG       MET 157 128.605  -0.212   4.957
  590   2HG   MET 157          1HG       MET 157 126.968  -0.192   5.612
  591   1HE   MET 157          1HE       MET 157 129.401   3.296   5.693
  592   2HE   MET 157          2HE       MET 157 128.793   2.168   4.481
  593   3HE   MET 157          3HE       MET 157 130.289   1.812   5.346
  594    H    LYS 158           H        LYS 158 128.663  -3.270   8.447
  595    HA   LYS 158           HA       LYS 158 128.887  -2.283  11.079
  596   1HB   LYS 158          2HB       LYS 158 128.335  -4.689  11.711
  597   2HB   LYS 158          1HB       LYS 158 127.172  -3.852  10.694
  598   1HG   LYS 158          2HG       LYS 158 129.043  -5.157   9.004
  599   2HG   LYS 158          1HG       LYS 158 128.489  -6.311  10.218
  600   1HD   LYS 158          2HD       LYS 158 126.517  -4.584   8.774
  601   2HD   LYS 158          1HD       LYS 158 127.156  -6.036   8.000
  602   1HE   LYS 158          2HE       LYS 158 126.202  -7.448   9.579
  603   2HE   LYS 158          1HE       LYS 158 126.045  -6.164  10.775
  604   1HZ   LYS 158          1HZ       LYS 158 123.955  -6.972   9.560
  605   2HZ   LYS 158          2HZ       LYS 158 124.520  -6.060   8.254
  606   3HZ   LYS 158          3HZ       LYS 158 124.184  -5.304   9.729
  607    H    GLY 159           H        GLY 159 131.189  -1.693  11.015
  608   1HA   GLY 159          2HA       GLY 159 133.011  -2.405  12.508
  609   2HA   GLY 159          1HA       GLY 159 132.886  -3.994  11.767
  610    H    VAL 160           H        VAL 160 133.867  -0.658  11.252
  611    HA   VAL 160           HA       VAL 160 135.352  -1.491   8.854
  612    HB   VAL 160           HB       VAL 160 134.869   1.351   9.735
  613   1HG1  VAL 160          1HG1      VAL 160 135.740   1.996   7.734
  614   2HG1  VAL 160          2HG1      VAL 160 135.219   0.528   6.907
  615   3HG1  VAL 160          3HG1      VAL 160 136.638   0.495   7.954
  616   1HG2  VAL 160          1HG2      VAL 160 132.895  -0.461   8.890
  617   2HG2  VAL 160          2HG2      VAL 160 133.239   0.573   7.502
  618   3HG2  VAL 160          3HG2      VAL 160 132.758   1.290   9.039
  619    H    GLU 161           H        GLU 161 136.438  -2.309  11.240
  620    HA   GLU 161           HA       GLU 161 138.434  -0.394  12.091
  621   1HB   GLU 161          2HB       GLU 161 139.141  -2.115  13.658
  622   2HB   GLU 161          1HB       GLU 161 137.394  -1.922  13.718
  623   1HG   GLU 161          2HG       GLU 161 137.749  -3.899  11.833
  624   2HG   GLU 161          1HG       GLU 161 138.993  -4.245  13.035
  Start of MODEL   11
    1   1H    MET  81          1HT       MET  81  94.409 -12.992  12.785
    2   2H    MET  81          2HT       MET  81  94.400 -14.703  12.658
    3   3H    MET  81          3HT       MET  81  92.929 -13.826  12.558
    4    HA   MET  81           HA       MET  81  95.139 -13.444  10.668
    5   1HB   MET  81          2HB       MET  81  93.284 -15.679  10.980
    6   2HB   MET  81          1HB       MET  81  93.169 -14.928   9.394
    7   1HG   MET  81          2HG       MET  81  95.762 -15.830  10.615
    8   2HG   MET  81          1HG       MET  81  94.767 -16.846   9.574
    9   1HE   MET  81          1HE       MET  81  98.071 -15.866   8.396
   10   2HE   MET  81          2HE       MET  81  97.205 -16.457   6.979
   11   3HE   MET  81          3HE       MET  81  96.923 -17.195   8.555
   12    H    VAL  82           H        VAL  82  94.765 -11.615   9.612
   13    HA   VAL  82           HA       VAL  82  93.717  -9.870   8.595
   14    HB   VAL  82           HB       VAL  82  91.248 -11.602   8.499
   15   1HG1  VAL  82          1HG1      VAL  82  90.527  -9.595   7.712
   16   2HG1  VAL  82          2HG1      VAL  82  91.207 -10.241   6.218
   17   3HG1  VAL  82          3HG1      VAL  82  92.134  -9.095   7.186
   18   1HG2  VAL  82          1HG2      VAL  82  92.831 -13.007   7.539
   19   2HG2  VAL  82          2HG2      VAL  82  93.740 -11.667   6.838
   20   3HG2  VAL  82          3HG2      VAL  82  92.185 -12.133   6.150
   21    H    ARG  83           H        ARG  83  93.699 -10.054  11.462
   22    HA   ARG  83           HA       ARG  83  91.102  -9.072  12.308
   23   1HB   ARG  83          2HB       ARG  83  92.825 -10.586  13.624
   24   2HB   ARG  83          1HB       ARG  83  93.495  -9.030  14.090
   25   1HG   ARG  83          2HG       ARG  83  91.182  -8.395  14.864
   26   2HG   ARG  83          1HG       ARG  83  90.735 -10.088  14.630
   27   1HD   ARG  83          2HD       ARG  83  93.100 -10.179  16.092
   28   2HD   ARG  83          1HD       ARG  83  92.197  -8.838  16.795
   29    HE   ARG  83           HE       ARG  83  90.534 -11.108  16.453
   30   1HH1  ARG  83          1HH1      ARG  83  93.069  -9.831  18.482
   31   2HH1  ARG  83          2HH1      ARG  83  92.586 -10.740  19.874
   32   1HH2  ARG  83          1HH2      ARG  83  89.897 -12.306  18.283
   33   2HH2  ARG  83          2HH2      ARG  83  90.784 -12.147  19.761
   34    H    CYS  84           H        CYS  84  94.418  -7.842  12.777
   35    HA   CYS  84           HA       CYS  84  93.336  -5.115  12.511
   36   1HB   CYS  84          2HB       CYS  84  95.364  -6.322  14.291
   37   2HB   CYS  84          1HB       CYS  84  95.769  -4.734  13.651
   38    HG   CYS  84           HG       CYS  84  94.323  -3.795  15.371
   39    H    MET  85           H        MET  85  96.192  -7.104  11.781
   40    HA   MET  85           HA       MET  85  96.631  -5.433   9.399
   41   1HB   MET  85          2HB       MET  85  98.549  -6.191  11.546
   42   2HB   MET  85          1HB       MET  85  99.149  -6.169   9.893
   43   1HG   MET  85          2HG       MET  85  98.770  -3.887   9.655
   44   2HG   MET  85          1HG       MET  85  97.663  -3.833  11.026
   45   1HE   MET  85          1HE       MET  85 100.966  -3.456   9.608
   46   2HE   MET  85          2HE       MET  85 102.031  -2.989  10.933
   47   3HE   MET  85          3HE       MET  85 100.703  -1.932  10.455
   48    H    LYS  86           H        LYS  86  97.683  -6.501   7.628
   49    HA   LYS  86           HA       LYS  86  97.035  -9.350   7.544
   50   1HB   LYS  86          2HB       LYS  86  97.709  -7.373   5.360
   51   2HB   LYS  86          1HB       LYS  86  97.397  -9.081   5.078
   52   1HG   LYS  86          2HG       LYS  86  95.149  -8.889   5.600
   53   2HG   LYS  86          1HG       LYS  86  95.383  -7.388   6.497
   54   1HD   LYS  86          2HD       LYS  86  96.183  -6.515   4.135
   55   2HD   LYS  86          1HD       LYS  86  95.165  -7.839   3.563
   56   1HE   LYS  86          2HE       LYS  86  93.258  -6.937   4.733
   57   2HE   LYS  86          1HE       LYS  86  94.258  -5.682   5.467
   58   1HZ   LYS  86          1HZ       LYS  86  94.646  -4.743   3.289
   59   2HZ   LYS  86          2HZ       LYS  86  92.982  -4.856   3.574
   60   3HZ   LYS  86          3HZ       LYS  86  93.742  -5.972   2.556
   61    H    ASP  87           H        ASP  87  99.621  -7.453   5.998
   62    HA   ASP  87           HA       ASP  87 101.519  -9.552   6.826
   63   1HB   ASP  87          2HB       ASP  87 102.842  -8.869   4.798
   64   2HB   ASP  87          1HB       ASP  87 101.288  -9.618   4.443
   65    H    ASP  88           H        ASP  88 103.595  -8.929   7.491
   66    HA   ASP  88           HA       ASP  88 103.724  -6.184   8.506
   67   1HB   ASP  88          2HB       ASP  88 104.160  -8.495   9.821
   68   2HB   ASP  88          1HB       ASP  88 105.800  -8.162   9.269
   69    H    SER  89           H        SER  89 104.840  -4.745   7.387
   70    HA   SER  89           HA       SER  89 106.590  -5.461   5.260
   71   1HB   SER  89          2HB       SER  89 107.139  -2.873   5.515
   72   2HB   SER  89          1HB       SER  89 105.607  -3.421   4.834
   73    HG   SER  89           HG       SER  89 106.141  -2.442   7.427
   74    H    LYS  90           H        LYS  90 108.770  -4.000   5.261
   75    HA   LYS  90           HA       LYS  90 110.228  -4.690   7.727
   76   1HB   LYS  90          2HB       LYS  90 111.432  -4.821   4.966
   77   2HB   LYS  90          1HB       LYS  90 112.104  -5.438   6.468
   78   1HG   LYS  90          2HG       LYS  90 109.953  -6.928   6.468
   79   2HG   LYS  90          1HG       LYS  90 109.963  -6.575   4.741
   80   1HD   LYS  90          2HD       LYS  90 111.333  -8.350   4.604
   81   2HD   LYS  90          1HD       LYS  90 112.570  -7.229   5.176
   82   1HE   LYS  90          2HE       LYS  90 110.877  -9.002   6.934
   83   2HE   LYS  90          1HE       LYS  90 112.537  -9.343   6.445
   84   1HZ   LYS  90          1HZ       LYS  90 111.685  -6.962   8.003
   85   2HZ   LYS  90          2HZ       LYS  90 113.273  -7.382   7.601
   86   3HZ   LYS  90          3HZ       LYS  90 112.387  -8.351   8.666
   87    H    GLY  91           H        GLY  91 111.002  -2.932   8.681
   88   1HA   GLY  91          2HA       GLY  91 111.010  -0.373   7.508
   89   2HA   GLY  91          1HA       GLY  91 111.807  -0.810   9.012
   90    H    LYS  92           H        LYS  92 113.766   0.109   8.838
   91    HA   LYS  92           HA       LYS  92 115.236  -0.036   6.336
   92   1HB   LYS  92          2HB       LYS  92 116.172   1.158   8.943
   93   2HB   LYS  92          1HB       LYS  92 116.794   1.481   7.330
   94   1HG   LYS  92          2HG       LYS  92 115.489   3.286   7.390
   95   2HG   LYS  92          1HG       LYS  92 114.163   2.166   7.073
   96   1HD   LYS  92          2HD       LYS  92 113.365   3.265   8.926
   97   2HD   LYS  92          1HD       LYS  92 114.183   1.898   9.683
   98   1HE   LYS  92          2HE       LYS  92 116.102   3.244  10.181
   99   2HE   LYS  92          1HE       LYS  92 115.456   4.594   9.249
  100   1HZ   LYS  92          1HZ       LYS  92 114.798   5.258  11.285
  101   2HZ   LYS  92          2HZ       LYS  92 114.775   3.693  11.929
  102   3HZ   LYS  92          3HZ       LYS  92 113.485   4.234  10.979
  103    H    THR  93           H        THR  93 115.909  -2.114   6.043
  104    HA   THR  93           HA       THR  93 117.591  -3.284   8.161
  105    HB   THR  93           HB       THR  93 115.583  -4.601   7.619
  106    HG1  THR  93           HG1      THR  93 116.657  -6.536   7.348
  107   1HG2  THR  93          1HG2      THR  93 116.117  -3.931   4.970
  108   2HG2  THR  93          2HG2      THR  93 114.862  -5.014   5.574
  109   3HG2  THR  93          3HG2      THR  93 116.432  -5.661   5.093
  110    H    GLU  94           H        GLU  94 118.727  -5.294   6.467
  111    HA   GLU  94           HA       GLU  94 120.932  -3.843   5.414
  112   1HB   GLU  94          2HB       GLU  94 120.183  -6.654   5.792
  113   2HB   GLU  94          1HB       GLU  94 121.200  -6.372   4.385
  114   1HG   GLU  94          2HG       GLU  94 122.913  -6.512   5.789
  115   2HG   GLU  94          1HG       GLU  94 122.449  -4.900   6.328
  116    H    GLU  95           H        GLU  95 117.914  -4.397   4.128
  117    HA   GLU  95           HA       GLU  95 118.659  -4.824   1.386
  118   1HB   GLU  95          2HB       GLU  95 116.252  -4.867   2.908
  119   2HB   GLU  95          1HB       GLU  95 116.030  -3.720   1.594
  120   1HG   GLU  95          2HG       GLU  95 115.573  -5.427   0.269
  121   2HG   GLU  95          1HG       GLU  95 117.253  -5.936   0.427
  122    H    GLU  96           H        GLU  96 118.158  -2.089   3.462
  123    HA   GLU  96           HA       GLU  96 117.828  -0.158   1.374
  124   1HB   GLU  96          2HB       GLU  96 118.747   0.374   4.197
  125   2HB   GLU  96          1HB       GLU  96 117.955   1.493   3.099
  126   1HG   GLU  96          2HG       GLU  96 116.609  -1.010   4.046
  127   2HG   GLU  96          1HG       GLU  96 116.566   0.486   4.978
  128    H    LEU  97           H        LEU  97 120.520  -1.689   2.912
  129    HA   LEU  97           HA       LEU  97 122.538   0.185   2.543
  130   1HB   LEU  97          2HB       LEU  97 122.504  -2.810   2.603
  131   2HB   LEU  97          1HB       LEU  97 123.994  -1.953   2.256
  132    HG   LEU  97           HG       LEU  97 122.409  -1.305   4.719
  133   1HD1  LEU  97          1HD1      LEU  97 124.647  -3.208   4.971
  134   2HD1  LEU  97          2HD1      LEU  97 123.147  -3.849   4.300
  135   3HD1  LEU  97          3HD1      LEU  97 123.147  -3.084   5.890
  136   1HD2  LEU  97          1HD2      LEU  97 125.360  -1.311   4.631
  137   2HD2  LEU  97          2HD2      LEU  97 124.245  -0.162   5.375
  138   3HD2  LEU  97          3HD2      LEU  97 124.551  -0.097   3.639
  139    H    SER  98           H        SER  98 120.815  -1.672   0.201
  140    HA   SER  98           HA       SER  98 122.761  -1.670  -1.859
  141   1HB   SER  98          2HB       SER  98 120.814  -3.182  -1.874
  142   2HB   SER  98          1HB       SER  98 119.742  -1.796  -2.076
  143    HG   SER  98           HG       SER  98 121.617  -2.865  -3.892
  144    H    ASP  99           H        ASP  99 120.050   0.487  -1.092
  145    HA   ASP  99           HA       ASP  99 120.298   2.204  -3.287
  146   1HB   ASP  99          2HB       ASP  99 118.448   2.062  -1.466
  147   2HB   ASP  99          1HB       ASP  99 119.462   3.193  -0.575
  148    H    LEU 100           H        LEU 100 121.813   2.306  -0.090
  149    HA   LEU 100           HA       LEU 100 123.203   4.753  -0.566
  150   1HB   LEU 100          2HB       LEU 100 123.320   2.618   1.527
  151   2HB   LEU 100          1HB       LEU 100 124.598   3.817   1.446
  152    HG   LEU 100           HG       LEU 100 121.823   4.856   1.471
  153   1HD1  LEU 100          1HD1      LEU 100 122.941   4.203   4.128
  154   2HD1  LEU 100          2HD1      LEU 100 122.232   2.872   3.213
  155   3HD1  LEU 100          3HD1      LEU 100 121.265   4.298   3.591
  156   1HD2  LEU 100          1HD2      LEU 100 123.335   6.570   1.508
  157   2HD2  LEU 100          2HD2      LEU 100 124.528   5.647   2.421
  158   3HD2  LEU 100          3HD2      LEU 100 123.117   6.318   3.240
  159    H    PHE 101           H        PHE 101 123.849   1.395  -1.188
  160    HA   PHE 101           HA       PHE 101 126.644   1.498  -1.447
  161   1HB   PHE 101          2HB       PHE 101 125.367  -0.609  -1.326
  162   2HB   PHE 101          1HB       PHE 101 124.685  -0.281  -2.915
  163    HD1  PHE 101           HD1      PHE 101 125.513  -1.922  -4.314
  164    HD2  PHE 101           HD2      PHE 101 128.173   0.094  -1.673
  165    HE1  PHE 101           HE1      PHE 101 127.421  -3.066  -5.365
  166    HE2  PHE 101           HE2      PHE 101 130.084  -1.047  -2.720
  167    HZ   PHE 101           HZ       PHE 101 129.710  -2.630  -4.570
  168    H    ARG 102           H        ARG 102 124.046   2.111  -3.773
  169    HA   ARG 102           HA       ARG 102 125.613   2.368  -6.072
  170   1HB   ARG 102          2HB       ARG 102 122.958   3.507  -5.249
  171   2HB   ARG 102          1HB       ARG 102 123.687   3.954  -6.785
  172   1HG   ARG 102          2HG       ARG 102 123.603   1.729  -7.580
  173   2HG   ARG 102          1HG       ARG 102 123.210   1.099  -5.979
  174   1HD   ARG 102          2HD       ARG 102 121.180   2.845  -6.336
  175   2HD   ARG 102          1HD       ARG 102 121.479   2.359  -8.005
  176    HE   ARG 102           HE       ARG 102 120.353   0.753  -5.901
  177   1HH1  ARG 102          1HH1      ARG 102 122.038   0.699  -8.958
  178   2HH1  ARG 102          2HH1      ARG 102 121.494  -0.889  -9.372
  179   1HH2  ARG 102          1HH2      ARG 102 119.637  -1.339  -6.445
  180   2HH2  ARG 102          2HH2      ARG 102 120.131  -2.048  -7.947
  181    H    MET 103           H        MET 103 124.730   4.730  -3.597
  182    HA   MET 103           HA       MET 103 125.646   7.059  -4.766
  183   1HB   MET 103          2HB       MET 103 125.584   6.149  -1.900
  184   2HB   MET 103          1HB       MET 103 126.188   7.742  -2.339
  185   1HG   MET 103          2HG       MET 103 123.433   6.675  -2.915
  186   2HG   MET 103          1HG       MET 103 123.859   7.830  -1.652
  187   1HE   MET 103          1HE       MET 103 122.905  10.928  -3.241
  188   2HE   MET 103          2HE       MET 103 124.346  10.596  -2.279
  189   3HE   MET 103          3HE       MET 103 122.827   9.784  -1.900
  190    H    PHE 104           H        PHE 104 127.461   4.421  -3.398
  191    HA   PHE 104           HA       PHE 104 129.949   5.849  -3.269
  192   1HB   PHE 104          2HB       PHE 104 128.988   3.145  -2.640
  193   2HB   PHE 104          1HB       PHE 104 130.637   3.195  -3.252
  194    HD1  PHE 104           HD1      PHE 104 128.403   4.602  -0.652
  195    HD2  PHE 104           HD2      PHE 104 132.407   3.834  -1.873
  196    HE1  PHE 104           HE1      PHE 104 129.205   5.265   1.576
  197    HE2  PHE 104           HE2      PHE 104 133.217   4.495   0.354
  198    HZ   PHE 104           HZ       PHE 104 131.614   5.213   2.082
  199    H    ASP 105           H        ASP 105 128.186   4.209  -5.720
  200    HA   ASP 105           HA       ASP 105 130.544   3.822  -7.394
  201   1HB   ASP 105          2HB       ASP 105 127.658   3.009  -7.616
  202   2HB   ASP 105          1HB       ASP 105 128.714   2.963  -9.025
  203    H    LYS 106           H        LYS 106 130.885   4.885  -9.338
  204    HA   LYS 106           HA       LYS 106 129.463   7.433  -9.593
  205   1HB   LYS 106          2HB       LYS 106 132.071   6.523 -10.823
  206   2HB   LYS 106          1HB       LYS 106 131.366   8.125 -10.999
  207   1HG   LYS 106          2HG       LYS 106 131.856   7.099  -8.255
  208   2HG   LYS 106          1HG       LYS 106 133.238   7.628  -9.220
  209   1HD   LYS 106          2HD       LYS 106 132.667   9.596  -8.183
  210   2HD   LYS 106          1HD       LYS 106 131.712   9.722  -9.663
  211   1HE   LYS 106          2HE       LYS 106 130.072   8.330  -7.916
  212   2HE   LYS 106          1HE       LYS 106 130.845   9.545  -6.899
  213   1HZ   LYS 106          1HZ       LYS 106 128.664  10.010  -8.336
  214   2HZ   LYS 106          2HZ       LYS 106 129.837  10.478  -9.460
  215   3HZ   LYS 106          3HZ       LYS 106 129.783  11.217  -7.940
  216    H    ASN 107           H        ASN 107 130.241   4.504 -11.368
  217    HA   ASN 107           HA       ASN 107 128.552   5.463 -13.586
  218   1HB   ASN 107          2HB       ASN 107 129.767   3.783 -14.986
  219   2HB   ASN 107          1HB       ASN 107 130.793   5.074 -14.368
  220   1HD2  ASN 107          1HD2      ASN 107 132.142   3.026 -15.185
  221   2HD2  ASN 107          2HD2      ASN 107 132.698   2.025 -13.890
  222    H    ALA 108           H        ALA 108 127.986   3.893 -10.971
  223    HA   ALA 108           HA       ALA 108 126.757   2.090 -10.277
  224   1HB   ALA 108          1HB       ALA 108 124.667   1.772 -11.597
  225   2HB   ALA 108          2HB       ALA 108 125.322   2.878 -12.805
  226   3HB   ALA 108          3HB       ALA 108 125.003   3.450 -11.168
  227    H    ASP 109           H        ASP 109 128.675   0.693 -10.739
  228    HA   ASP 109           HA       ASP 109 128.093  -1.216 -12.908
  229   1HB   ASP 109          2HB       ASP 109 130.484  -1.775 -12.904
  230   2HB   ASP 109          1HB       ASP 109 130.231  -0.059 -13.213
  231    H    GLY 110           H        GLY 110 128.238  -0.809  -9.536
  232   1HA   GLY 110          2HA       GLY 110 127.384  -2.463  -8.055
  233   2HA   GLY 110          1HA       GLY 110 127.897  -3.703  -9.190
  234    H    TYR 111           H        TYR 111 130.515  -2.012  -9.332
  235    HA   TYR 111           HA       TYR 111 131.673  -2.942  -6.794
  236   1HB   TYR 111          2HB       TYR 111 133.026  -3.210  -9.484
  237   2HB   TYR 111          1HB       TYR 111 133.615  -3.807  -7.936
  238    HD1  TYR 111           HD1      TYR 111 133.047  -5.958  -7.193
  239    HD2  TYR 111           HD2      TYR 111 130.887  -4.227 -10.424
  240    HE1  TYR 111           HE1      TYR 111 131.936  -8.115  -7.597
  241    HE2  TYR 111           HE2      TYR 111 129.770  -6.378 -10.837
  242    HH   TYR 111           HH       TYR 111 129.225  -8.498  -9.284
  243    H    ILE 112           H        ILE 112 133.177  -1.614  -5.878
  244    HA   ILE 112           HA       ILE 112 133.648   0.943  -7.257
  245    HB   ILE 112           HB       ILE 112 133.851   0.400  -4.295
  246   1HG1  ILE 112          2HG1      ILE 112 131.669   2.101  -5.322
  247   2HG1  ILE 112          1HG1      ILE 112 131.521   0.389  -5.708
  248   1HG2  ILE 112          1HG2      ILE 112 133.750   3.001  -5.817
  249   2HG2  ILE 112          2HG2      ILE 112 135.205   2.277  -5.133
  250   3HG2  ILE 112          3HG2      ILE 112 133.903   2.812  -4.070
  251   1HD1  ILE 112          1HD1      ILE 112 131.772   1.609  -2.971
  252   2HD1  ILE 112          2HD1      ILE 112 131.764  -0.124  -3.303
  253   3HD1  ILE 112          3HD1      ILE 112 130.344   0.853  -3.676
  254    H    ASP 113           H        ASP 113 135.667   1.599  -7.695
  255    HA   ASP 113           HA       ASP 113 137.873  -0.131  -6.802
  256   1HB   ASP 113          2HB       ASP 113 137.207   0.472  -9.350
  257   2HB   ASP 113          1HB       ASP 113 138.323   1.793  -9.012
  258    H    LEU 114           H        LEU 114 140.054   1.304  -7.070
  259    HA   LEU 114           HA       LEU 114 140.028   3.052  -4.861
  260   1HB   LEU 114          2HB       LEU 114 142.104   2.655  -7.014
  261   2HB   LEU 114          1HB       LEU 114 142.360   3.587  -5.551
  262    HG   LEU 114           HG       LEU 114 141.478   1.144  -4.592
  263   1HD1  LEU 114          1HD1      LEU 114 143.454   0.612  -6.802
  264   2HD1  LEU 114          2HD1      LEU 114 141.733   0.246  -6.902
  265   3HD1  LEU 114          3HD1      LEU 114 142.738  -0.561  -5.697
  266   1HD2  LEU 114          1HD2      LEU 114 143.184   2.208  -3.447
  267   2HD2  LEU 114          2HD2      LEU 114 144.157   2.440  -4.898
  268   3HD2  LEU 114          3HD2      LEU 114 144.018   0.837  -4.175
  269    H    GLU 115           H        GLU 115 139.721   3.586  -8.303
  270    HA   GLU 115           HA       GLU 115 140.230   6.379  -8.264
  271   1HB   GLU 115          2HB       GLU 115 139.983   4.549 -10.235
  272   2HB   GLU 115          1HB       GLU 115 138.400   5.308 -10.327
  273   1HG   GLU 115          2HG       GLU 115 139.269   7.357 -10.934
  274   2HG   GLU 115          1HG       GLU 115 140.859   6.997 -10.263
  275    H    GLU 116           H        GLU 116 137.148   4.616  -8.659
  276    HA   GLU 116           HA       GLU 116 135.470   6.825  -8.415
  277   1HB   GLU 116          2HB       GLU 116 135.144   3.887  -8.086
  278   2HB   GLU 116          1HB       GLU 116 133.868   4.916  -7.451
  279   1HG   GLU 116          2HG       GLU 116 133.052   5.302  -9.475
  280   2HG   GLU 116          1HG       GLU 116 134.642   5.711 -10.119
  281    H    LEU 117           H        LEU 117 136.558   4.550  -5.913
  282    HA   LEU 117           HA       LEU 117 135.174   5.597  -3.748
  283   1HB   LEU 117          2HB       LEU 117 136.625   3.495  -3.881
  284   2HB   LEU 117          1HB       LEU 117 137.987   4.549  -3.554
  285    HG   LEU 117           HG       LEU 117 136.746   5.268  -1.448
  286   1HD1  LEU 117          1HD1      LEU 117 135.054   3.800  -0.587
  287   2HD1  LEU 117          2HD1      LEU 117 135.187   2.750  -1.997
  288   3HD1  LEU 117          3HD1      LEU 117 134.546   4.384  -2.172
  289   1HD2  LEU 117          1HD2      LEU 117 138.692   3.745  -1.491
  290   2HD2  LEU 117          2HD2      LEU 117 137.588   2.380  -1.641
  291   3HD2  LEU 117          3HD2      LEU 117 137.562   3.380  -0.188
  292    H    LYS 118           H        LYS 118 137.993   6.812  -5.384
  293    HA   LYS 118           HA       LYS 118 138.758   8.639  -3.310
  294   1HB   LYS 118          2HB       LYS 118 140.398   7.782  -4.918
  295   2HB   LYS 118          1HB       LYS 118 139.526   8.557  -6.233
  296   1HG   LYS 118          2HG       LYS 118 139.947  10.749  -5.049
  297   2HG   LYS 118          1HG       LYS 118 141.061   9.861  -4.007
  298   1HD   LYS 118          2HD       LYS 118 141.328   9.624  -6.971
  299   2HD   LYS 118          1HD       LYS 118 141.928  11.075  -6.164
  300   1HE   LYS 118          2HE       LYS 118 143.806   9.787  -6.058
  301   2HE   LYS 118          1HE       LYS 118 143.029   9.285  -4.557
  302   1HZ   LYS 118          1HZ       LYS 118 141.961   7.556  -6.271
  303   2HZ   LYS 118          2HZ       LYS 118 143.381   7.248  -5.408
  304   3HZ   LYS 118          3HZ       LYS 118 143.466   7.793  -7.007
  305    H    ILE 119           H        ILE 119 136.665   8.727  -6.100
  306    HA   ILE 119           HA       ILE 119 136.415  11.555  -6.261
  307    HB   ILE 119           HB       ILE 119 134.422   9.488  -7.194
  308   1HG1  ILE 119          2HG1      ILE 119 136.681  10.724  -8.778
  309   2HG1  ILE 119          1HG1      ILE 119 136.770   9.130  -8.036
  310   1HG2  ILE 119          1HG2      ILE 119 134.246  11.474  -8.976
  311   2HG2  ILE 119          2HG2      ILE 119 134.727  12.407  -7.557
  312   3HG2  ILE 119          3HG2      ILE 119 133.270  11.415  -7.507
  313   1HD1  ILE 119          1HD1      ILE 119 134.392   9.221  -9.553
  314   2HD1  ILE 119          2HD1      ILE 119 135.844   8.263  -9.842
  315   3HD1  ILE 119          3HD1      ILE 119 135.693   9.869 -10.553
  316    H    MET 120           H        MET 120 134.264   9.042  -4.930
  317    HA   MET 120           HA       MET 120 132.292  10.725  -3.925
  318   1HB   MET 120          2HB       MET 120 132.188   8.219  -4.099
  319   2HB   MET 120          1HB       MET 120 133.193   8.136  -2.658
  320   1HG   MET 120          2HG       MET 120 131.236   9.761  -1.778
  321   2HG   MET 120          1HG       MET 120 130.343   8.790  -2.947
  322   1HE   MET 120          1HE       MET 120 132.365   7.792   0.885
  323   2HE   MET 120          2HE       MET 120 133.060   8.676  -0.473
  324   3HE   MET 120          3HE       MET 120 133.289   6.932  -0.347
  325    H    LEU 121           H        LEU 121 135.370   9.750  -2.527
  326    HA   LEU 121           HA       LEU 121 134.856  10.908   0.039
  327   1HB   LEU 121          2HB       LEU 121 137.225   9.727  -1.337
  328   2HB   LEU 121          1HB       LEU 121 137.492  10.717   0.085
  329    HG   LEU 121           HG       LEU 121 135.481   8.532   0.283
  330   1HD1  LEU 121          1HD1      LEU 121 138.359   8.142  -0.244
  331   2HD1  LEU 121          2HD1      LEU 121 136.991   7.073  -0.551
  332   3HD1  LEU 121          3HD1      LEU 121 137.664   7.198   1.074
  333   1HD2  LEU 121          1HD2      LEU 121 136.947   8.438   2.516
  334   2HD2  LEU 121          2HD2      LEU 121 135.597   9.552   2.301
  335   3HD2  LEU 121          3HD2      LEU 121 137.251  10.112   2.049
  336    H    GLN 122           H        GLN 122 136.427  11.966  -2.927
  337    HA   GLN 122           HA       GLN 122 137.545  14.348  -1.862
  338   1HB   GLN 122          2HB       GLN 122 136.988  13.320  -4.619
  339   2HB   GLN 122          1HB       GLN 122 137.444  15.004  -4.401
  340   1HG   GLN 122          2HG       GLN 122 139.284  13.539  -2.897
  341   2HG   GLN 122          1HG       GLN 122 139.085  12.646  -4.404
  342   1HE2  GLN 122          1HE2      GLN 122 141.330  14.255  -3.323
  343   2HE2  GLN 122          2HE2      GLN 122 141.694  15.409  -4.558
  344    H    ALA 123           H        ALA 123 134.411  13.497  -3.125
  345    HA   ALA 123           HA       ALA 123 133.428  16.083  -3.646
  346   1HB   ALA 123          1HB       ALA 123 132.015  14.569  -4.560
  347   2HB   ALA 123          2HB       ALA 123 131.176  14.772  -3.022
  348   3HB   ALA 123          3HB       ALA 123 132.254  13.398  -3.262
  349    H    THR 124           H        THR 124 133.856  14.299  -0.691
  350    HA   THR 124           HA       THR 124 132.041  15.710   0.940
  351    HB   THR 124           HB       THR 124 133.163  14.725   2.795
  352    HG1  THR 124           HG1      THR 124 135.362  14.341   1.049
  353   1HG2  THR 124          1HG2      THR 124 133.298  12.432   2.277
  354   2HG2  THR 124          2HG2      THR 124 133.674  12.762   0.586
  355   3HG2  THR 124          3HG2      THR 124 132.065  13.110   1.217
  356    H    GLY 125           H        GLY 125 133.040  16.933   2.962
  357   1HA   GLY 125          2HA       GLY 125 134.617  19.143   1.814
  358   2HA   GLY 125          1HA       GLY 125 133.501  19.293   3.163
  359    H    GLU 126           H        GLU 126 135.232  16.475   3.561
  360    HA   GLU 126           HA       GLU 126 136.926  17.749   5.565
  361   1HB   GLU 126          2HB       GLU 126 136.254  14.851   5.035
  362   2HB   GLU 126          1HB       GLU 126 137.352  15.389   6.300
  363   1HG   GLU 126          2HG       GLU 126 134.682  16.637   6.279
  364   2HG   GLU 126          1HG       GLU 126 134.743  14.925   6.691
  365    H    THR 127           H        THR 127 139.085  16.321   5.854
  366    HA   THR 127           HA       THR 127 140.428  16.409   3.231
  367    HB   THR 127           HB       THR 127 142.518  16.842   4.558
  368    HG1  THR 127           HG1      THR 127 141.663  16.047   6.564
  369   1HG2  THR 127          1HG2      THR 127 142.104  18.933   3.976
  370   2HG2  THR 127          2HG2      THR 127 141.286  19.139   5.525
  371   3HG2  THR 127          3HG2      THR 127 140.363  18.684   4.094
  372    H    ILE 128           H        ILE 128 140.881  14.461   2.466
  373    HA   ILE 128           HA       ILE 128 141.747  12.373   4.356
  374    HB   ILE 128           HB       ILE 128 140.170  11.828   1.844
  375   1HG1  ILE 128          2HG1      ILE 128 138.474  11.167   3.849
  376   2HG1  ILE 128          1HG1      ILE 128 139.283  12.552   4.575
  377   1HG2  ILE 128          1HG2      ILE 128 141.320   9.889   2.360
  378   2HG2  ILE 128          2HG2      ILE 128 139.789   9.650   3.202
  379   3HG2  ILE 128          3HG2      ILE 128 141.218  10.168   4.098
  380   1HD1  ILE 128          1HD1      ILE 128 137.976  12.602   1.869
  381   2HD1  ILE 128          2HD1      ILE 128 138.601  13.973   2.786
  382   3HD1  ILE 128          3HD1      ILE 128 137.185  13.097   3.366
  383    H    THR 129           H        THR 129 143.585  11.330   3.857
  384    HA   THR 129           HA       THR 129 145.097  12.238   1.568
  385    HB   THR 129           HB       THR 129 146.305  12.021   3.623
  386    HG1  THR 129           HG1      THR 129 147.722  11.413   2.154
  387   1HG2  THR 129          1HG2      THR 129 145.546  10.549   5.114
  388   2HG2  THR 129          2HG2      THR 129 146.581   9.396   4.274
  389   3HG2  THR 129          3HG2      THR 129 144.866   9.497   3.873
  390    H    GLU 130           H        GLU 130 146.455  10.430   0.442
  391    HA   GLU 130           HA       GLU 130 144.572   8.752  -0.924
  392   1HB   GLU 130          2HB       GLU 130 146.619   8.001  -2.193
  393   2HB   GLU 130          1HB       GLU 130 146.284   9.726  -2.257
  394   1HG   GLU 130          2HG       GLU 130 148.059  10.247  -0.843
  395   2HG   GLU 130          1HG       GLU 130 148.187   8.595  -0.242
  396    H    ASP 131           H        ASP 131 147.086   8.306   1.477
  397    HA   ASP 131           HA       ASP 131 147.288   5.504   1.343
  398   1HB   ASP 131          2HB       ASP 131 148.613   7.431   2.710
  399   2HB   ASP 131          1HB       ASP 131 147.620   6.760   4.001
  400    H    ASP 132           H        ASP 132 145.339   7.591   3.468
  401    HA   ASP 132           HA       ASP 132 144.101   5.600   4.958
  402   1HB   ASP 132          2HB       ASP 132 144.023   8.223   5.133
  403   2HB   ASP 132          1HB       ASP 132 142.562   8.041   4.167
  404    H    ILE 133           H        ILE 133 143.231   6.934   1.809
  405    HA   ILE 133           HA       ILE 133 140.755   5.539   1.600
  406    HB   ILE 133           HB       ILE 133 142.443   6.632  -0.652
  407   1HG1  ILE 133          2HG1      ILE 133 140.149   8.067   0.664
  408   2HG1  ILE 133          1HG1      ILE 133 141.791   8.229   1.279
  409   1HG2  ILE 133          1HG2      ILE 133 140.667   5.103  -1.354
  410   2HG2  ILE 133          2HG2      ILE 133 140.337   6.756  -1.870
  411   3HG2  ILE 133          3HG2      ILE 133 139.484   6.079  -0.483
  412   1HD1  ILE 133          1HD1      ILE 133 142.528   9.308  -0.646
  413   2HD1  ILE 133          2HD1      ILE 133 140.928   9.990  -0.358
  414   3HD1  ILE 133          3HD1      ILE 133 141.151   8.755  -1.596
  415    H    GLU 134           H        GLU 134 144.017   4.953   0.323
  416    HA   GLU 134           HA       GLU 134 143.443   2.680  -1.192
  417   1HB   GLU 134          2HB       GLU 134 145.887   3.820   0.064
  418   2HB   GLU 134          1HB       GLU 134 145.958   2.146  -0.471
  419   1HG   GLU 134          2HG       GLU 134 144.825   3.410  -2.620
  420   2HG   GLU 134          1HG       GLU 134 145.964   4.612  -2.018
  421    H    GLU 135           H        GLU 135 144.578   2.913   2.173
  422    HA   GLU 135           HA       GLU 135 144.579   0.144   2.680
  423   1HB   GLU 135          2HB       GLU 135 144.692   0.750   5.039
  424   2HB   GLU 135          1HB       GLU 135 145.771   1.761   4.090
  425   1HG   GLU 135          2HG       GLU 135 144.665   3.641   4.595
  426   2HG   GLU 135          1HG       GLU 135 143.086   2.867   4.481
  427    H    LEU 136           H        LEU 136 142.042   2.528   2.703
  428    HA   LEU 136           HA       LEU 136 140.154   1.168   4.278
  429   1HB   LEU 136          2HB       LEU 136 140.223   3.591   3.139
  430   2HB   LEU 136          1HB       LEU 136 139.204   2.773   1.971
  431    HG   LEU 136           HG       LEU 136 138.337   2.269   4.702
  432   1HD1  LEU 136          1HD1      LEU 136 138.894   5.053   3.865
  433   2HD1  LEU 136          2HD1      LEU 136 138.864   4.334   5.474
  434   3HD1  LEU 136          3HD1      LEU 136 137.352   4.741   4.662
  435   1HD2  LEU 136          1HD2      LEU 136 136.239   3.368   3.575
  436   2HD2  LEU 136          2HD2      LEU 136 136.766   1.750   3.114
  437   3HD2  LEU 136          3HD2      LEU 136 137.173   3.134   2.099
  438    H    MET 137           H        MET 137 141.082   0.846   0.924
  439    HA   MET 137           HA       MET 137 138.861  -0.665   0.048
  440   1HB   MET 137          2HB       MET 137 141.586  -0.074  -0.960
  441   2HB   MET 137          1HB       MET 137 140.816  -1.519  -1.600
  442   1HG   MET 137          2HG       MET 137 138.990   0.708  -1.609
  443   2HG   MET 137          1HG       MET 137 140.480   1.106  -2.463
  444   1HE   MET 137          1HE       MET 137 137.269   0.007  -2.442
  445   2HE   MET 137          2HE       MET 137 137.017  -1.393  -3.484
  446   3HE   MET 137          3HE       MET 137 137.142   0.220  -4.187
  447    H    LYS 138           H        LYS 138 141.912  -1.542   1.565
  448    HA   LYS 138           HA       LYS 138 141.626  -4.350   1.197
  449   1HB   LYS 138          2HB       LYS 138 143.705  -2.810   1.881
  450   2HB   LYS 138          1HB       LYS 138 143.205  -3.312   3.490
  451   1HG   LYS 138          2HG       LYS 138 143.382  -5.664   2.787
  452   2HG   LYS 138          1HG       LYS 138 143.949  -5.126   1.205
  453   1HD   LYS 138          2HD       LYS 138 145.363  -4.124   3.624
  454   2HD   LYS 138          1HD       LYS 138 145.635  -5.796   3.129
  455   1HE   LYS 138          2HE       LYS 138 146.767  -5.199   1.264
  456   2HE   LYS 138          1HE       LYS 138 145.762  -3.778   0.983
  457   1HZ   LYS 138          1HZ       LYS 138 147.510  -3.685   3.306
  458   2HZ   LYS 138          2HZ       LYS 138 147.118  -2.470   2.198
  459   3HZ   LYS 138          3HZ       LYS 138 148.276  -3.637   1.799
  460    H    ASP 139           H        ASP 139 140.472  -2.076   3.562
  461    HA   ASP 139           HA       ASP 139 139.808  -4.050   5.536
  462   1HB   ASP 139          2HB       ASP 139 140.187  -1.385   5.677
  463   2HB   ASP 139          1HB       ASP 139 138.429  -1.427   5.582
  464    H    GLY 140           H        GLY 140 138.471  -3.349   2.576
  465   1HA   GLY 140          2HA       GLY 140 135.817  -4.278   3.480
  466   2HA   GLY 140          1HA       GLY 140 136.020  -3.117   2.179
  467    H    ASP 141           H        ASP 141 138.411  -4.633   1.184
  468    HA   ASP 141           HA       ASP 141 136.918  -6.497  -0.460
  469   1HB   ASP 141          2HB       ASP 141 139.164  -4.840  -0.859
  470   2HB   ASP 141          1HB       ASP 141 139.750  -6.494  -1.004
  471    H    LYS 142           H        LYS 142 136.474  -8.279   0.772
  472    HA   LYS 142           HA       LYS 142 138.359  -9.545   2.475
  473   1HB   LYS 142          2HB       LYS 142 135.835 -10.658   1.236
  474   2HB   LYS 142          1HB       LYS 142 136.730 -11.391   2.560
  475   1HG   LYS 142          2HG       LYS 142 135.398  -8.690   2.642
  476   2HG   LYS 142          1HG       LYS 142 134.749 -10.179   3.334
  477   1HD   LYS 142          2HD       LYS 142 137.409  -8.995   4.114
  478   2HD   LYS 142          1HD       LYS 142 135.902  -8.661   4.968
  479   1HE   LYS 142          2HE       LYS 142 135.867 -10.683   5.959
  480   2HE   LYS 142          1HE       LYS 142 136.474 -11.509   4.524
  481   1HZ   LYS 142          1HZ       LYS 142 138.616 -11.253   5.167
  482   2HZ   LYS 142          2HZ       LYS 142 137.912 -11.246   6.706
  483   3HZ   LYS 142          3HZ       LYS 142 138.339  -9.787   5.965
  484    H    ASN 143           H        ASN 143 137.678  -9.761  -0.918
  485    HA   ASN 143           HA       ASN 143 139.362 -12.150  -1.164
  486   1HB   ASN 143          2HB       ASN 143 138.533 -12.115  -3.563
  487   2HB   ASN 143          1HB       ASN 143 137.316 -12.436  -2.332
  488   1HD2  ASN 143          1HD2      ASN 143 135.579 -11.715  -3.460
  489   2HD2  ASN 143          2HD2      ASN 143 135.343 -10.063  -3.908
  490    H    ASN 144           H        ASN 144 139.853  -8.951  -1.038
  491    HA   ASN 144           HA       ASN 144 141.348  -7.465  -1.909
  492   1HB   ASN 144          2HB       ASN 144 142.667  -9.639  -0.930
  493   2HB   ASN 144          1HB       ASN 144 143.312  -9.562  -2.568
  494   1HD2  ASN 144          1HD2      ASN 144 145.350  -9.046  -1.690
  495   2HD2  ASN 144          2HD2      ASN 144 145.701  -7.450  -1.128
  496    H    ASP 145           H        ASP 145 139.488  -8.388  -3.850
  497    HA   ASP 145           HA       ASP 145 140.932  -8.973  -6.275
  498   1HB   ASP 145          2HB       ASP 145 138.668  -9.868  -5.879
  499   2HB   ASP 145          1HB       ASP 145 138.027  -8.228  -5.868
  500    H    GLY 146           H        GLY 146 140.614  -6.199  -4.533
  501   1HA   GLY 146          2HA       GLY 146 141.445  -4.107  -5.199
  502   2HA   GLY 146          1HA       GLY 146 141.224  -4.578  -6.878
  503    H    ARG 147           H        ARG 147 138.396  -5.483  -5.913
  504    HA   ARG 147           HA       ARG 147 137.184  -2.814  -5.759
  505   1HB   ARG 147          2HB       ARG 147 136.229  -5.020  -7.591
  506   2HB   ARG 147          1HB       ARG 147 135.511  -3.424  -7.419
  507   1HG   ARG 147          2HG       ARG 147 138.078  -2.796  -8.059
  508   2HG   ARG 147          1HG       ARG 147 137.840  -4.291  -8.965
  509   1HD   ARG 147          2HD       ARG 147 135.501  -2.862  -9.388
  510   2HD   ARG 147          1HD       ARG 147 136.767  -1.635  -9.438
  511    HE   ARG 147           HE       ARG 147 137.628  -3.763 -11.001
  512   1HH1  ARG 147          1HH1      ARG 147 135.034  -1.427 -11.005
  513   2HH1  ARG 147          2HH1      ARG 147 134.879  -1.417 -12.729
  514   1HH2  ARG 147          1HH2      ARG 147 137.425  -3.750 -13.269
  515   2HH2  ARG 147          2HH2      ARG 147 136.236  -2.735 -14.014
  516    H    ILE 148           H        ILE 148 135.233  -2.689  -4.663
  517    HA   ILE 148           HA       ILE 148 134.540  -5.092  -3.110
  518    HB   ILE 148           HB       ILE 148 133.945  -2.218  -2.406
  519   1HG1  ILE 148          2HG1      ILE 148 135.999  -3.926  -1.034
  520   2HG1  ILE 148          1HG1      ILE 148 136.424  -3.013  -2.478
  521   1HG2  ILE 148          1HG2      ILE 148 133.121  -2.970  -0.379
  522   2HG2  ILE 148          2HG2      ILE 148 133.952  -4.521  -0.499
  523   3HG2  ILE 148          3HG2      ILE 148 132.535  -4.197  -1.500
  524   1HD1  ILE 148          1HD1      ILE 148 135.994  -2.110   0.261
  525   2HD1  ILE 148          2HD1      ILE 148 135.188  -1.120  -0.957
  526   3HD1  ILE 148          3HD1      ILE 148 136.929  -1.383  -1.047
  527    H    ASP 149           H        ASP 149 132.584  -5.970  -3.323
  528    HA   ASP 149           HA       ASP 149 130.604  -4.531  -4.951
  529   1HB   ASP 149          2HB       ASP 149 129.599  -6.710  -5.407
  530   2HB   ASP 149          1HB       ASP 149 131.312  -6.731  -5.811
  531    H    TYR 150           H        TYR 150 128.261  -5.522  -4.344
  532    HA   TYR 150           HA       TYR 150 127.553  -4.303  -1.930
  533   1HB   TYR 150          2HB       TYR 150 125.993  -4.696  -3.821
  534   2HB   TYR 150          1HB       TYR 150 126.001  -6.415  -3.444
  535    HD1  TYR 150           HD1      TYR 150 125.520  -3.226  -1.534
  536    HD2  TYR 150           HD2      TYR 150 124.111  -7.153  -2.368
  537    HE1  TYR 150           HE1      TYR 150 123.651  -2.883   0.029
  538    HE2  TYR 150           HE2      TYR 150 122.239  -6.821  -0.807
  539    HH   TYR 150           HH       TYR 150 120.983  -4.474   0.084
  540    H    ASP 151           H        ASP 151 128.788  -7.448  -2.543
  541    HA   ASP 151           HA       ASP 151 127.775  -8.615  -0.104
  542   1HB   ASP 151          2HB       ASP 151 129.435  -9.519  -2.390
  543   2HB   ASP 151          1HB       ASP 151 129.730 -10.319  -0.850
  544    H    GLU 152           H        GLU 152 130.977  -7.673  -1.334
  545    HA   GLU 152           HA       GLU 152 132.326  -8.070   1.121
  546   1HB   GLU 152          2HB       GLU 152 133.164  -6.241  -1.131
  547   2HB   GLU 152          1HB       GLU 152 134.203  -6.982   0.078
  548   1HG   GLU 152          2HG       GLU 152 134.174  -9.022  -0.942
  549   2HG   GLU 152          1HG       GLU 152 132.592  -8.760  -1.671
  550    H    PHE 153           H        PHE 153 130.734  -5.287  -0.341
  551    HA   PHE 153           HA       PHE 153 131.707  -3.423   1.599
  552   1HB   PHE 153          2HB       PHE 153 130.526  -3.170  -0.851
  553   2HB   PHE 153          1HB       PHE 153 129.205  -2.724   0.223
  554    HD1  PHE 153           HD1      PHE 153 130.136  -1.156   2.270
  555    HD2  PHE 153           HD2      PHE 153 131.733  -1.412  -1.667
  556    HE1  PHE 153           HE1      PHE 153 131.107   1.091   2.521
  557    HE2  PHE 153           HE2      PHE 153 132.707   0.834  -1.421
  558    HZ   PHE 153           HZ       PHE 153 132.393   2.089   0.674
  559    H    LEU 154           H        LEU 154 129.054  -5.641   1.466
  560    HA   LEU 154           HA       LEU 154 127.255  -4.465   3.236
  561   1HB   LEU 154          2HB       LEU 154 127.433  -6.867   1.906
  562   2HB   LEU 154          1HB       LEU 154 127.559  -7.357   3.583
  563    HG   LEU 154           HG       LEU 154 125.252  -7.469   2.849
  564   1HD1  LEU 154          1HD1      LEU 154 124.265  -5.801   4.505
  565   2HD1  LEU 154          2HD1      LEU 154 125.930  -5.314   4.824
  566   3HD1  LEU 154          3HD1      LEU 154 125.423  -6.975   5.131
  567   1HD2  LEU 154          1HD2      LEU 154 124.823  -6.017   1.164
  568   2HD2  LEU 154          2HD2      LEU 154 125.854  -4.755   1.838
  569   3HD2  LEU 154          3HD2      LEU 154 124.241  -5.021   2.499
  570    H    GLU 155           H        GLU 155 130.201  -6.278   3.842
  571    HA   GLU 155           HA       GLU 155 129.819  -6.445   6.677
  572   1HB   GLU 155          2HB       GLU 155 131.985  -7.131   4.756
  573   2HB   GLU 155          1HB       GLU 155 132.441  -6.895   6.438
  574   1HG   GLU 155          2HG       GLU 155 130.105  -8.567   6.238
  575   2HG   GLU 155          1HG       GLU 155 131.427  -9.208   5.263
  576    H    PHE 156           H        PHE 156 131.102  -4.091   4.498
  577    HA   PHE 156           HA       PHE 156 132.787  -2.721   6.320
  578   1HB   PHE 156          2HB       PHE 156 132.223  -2.537   3.609
  579   2HB   PHE 156          1HB       PHE 156 131.610  -1.022   4.263
  580    HD1  PHE 156           HD1      PHE 156 133.500  -0.447   6.408
  581    HD2  PHE 156           HD2      PHE 156 134.186  -2.009   2.510
  582    HE1  PHE 156           HE1      PHE 156 135.786   0.461   6.451
  583    HE2  PHE 156           HE2      PHE 156 136.474  -1.104   2.546
  584    HZ   PHE 156           HZ       PHE 156 137.277   0.132   4.520
  585    H    MET 157           H        MET 157 129.460  -3.039   6.318
  586    HA   MET 157           HA       MET 157 129.186  -0.566   7.888
  587   1HB   MET 157          2HB       MET 157 127.858  -1.142   5.525
  588   2HB   MET 157          1HB       MET 157 126.686  -1.572   6.761
  589   1HG   MET 157          2HG       MET 157 126.124   0.577   6.741
  590   2HG   MET 157          1HG       MET 157 127.609   0.842   7.651
  591   1HE   MET 157          1HE       MET 157 130.033   0.714   4.961
  592   2HE   MET 157          2HE       MET 157 129.774   1.049   6.673
  593   3HE   MET 157          3HE       MET 157 130.045   2.378   5.546
  594    H    LYS 158           H        LYS 158 129.600  -3.636   8.369
  595    HA   LYS 158           HA       LYS 158 127.295  -4.346   9.935
  596   1HB   LYS 158          2HB       LYS 158 128.878  -5.920   8.649
  597   2HB   LYS 158          1HB       LYS 158 129.946  -5.755  10.036
  598   1HG   LYS 158          2HG       LYS 158 128.007  -6.512  11.463
  599   2HG   LYS 158          1HG       LYS 158 127.181  -6.924   9.960
  600   1HD   LYS 158          2HD       LYS 158 128.867  -8.513   9.383
  601   2HD   LYS 158          1HD       LYS 158 129.904  -7.975  10.707
  602   1HE   LYS 158          2HE       LYS 158 127.225  -9.333  10.984
  603   2HE   LYS 158          1HE       LYS 158 128.799 -10.079  11.256
  604   1HZ   LYS 158          1HZ       LYS 158 128.223  -9.512  13.373
  605   2HZ   LYS 158          2HZ       LYS 158 127.351  -8.140  12.909
  606   3HZ   LYS 158          3HZ       LYS 158 129.042  -8.101  12.928
  607    H    GLY 159           H        GLY 159 129.008  -1.935  10.701
  608   1HA   GLY 159          2HA       GLY 159 128.790  -1.230  13.056
  609   2HA   GLY 159          1HA       GLY 159 129.481  -2.783  13.492
  610    H    VAL 160           H        VAL 160 131.349  -2.358  11.056
  611    HA   VAL 160           HA       VAL 160 133.636  -1.639  12.388
  612    HB   VAL 160           HB       VAL 160 134.664  -1.201  10.212
  613   1HG1  VAL 160          1HG1      VAL 160 132.888  -3.445   9.513
  614   2HG1  VAL 160          2HG1      VAL 160 133.687  -3.558  11.082
  615   3HG1  VAL 160          3HG1      VAL 160 134.648  -3.375   9.615
  616   1HG2  VAL 160          1HG2      VAL 160 131.824  -1.241   9.204
  617   2HG2  VAL 160          2HG2      VAL 160 133.244  -1.351   8.163
  618   3HG2  VAL 160          3HG2      VAL 160 132.969   0.099   9.129
  619    H    GLU 161           H        GLU 161 131.331   0.470  10.755
  620    HA   GLU 161           HA       GLU 161 132.835   2.798  11.754
  621   1HB   GLU 161          2HB       GLU 161 130.993   2.594   9.364
  622   2HB   GLU 161          1HB       GLU 161 131.718   4.087   9.946
  623   1HG   GLU 161          2HG       GLU 161 133.901   2.480   9.664
  624   2HG   GLU 161          1HG       GLU 161 132.867   1.933   8.343
  Start of MODEL   12
    1   1H    MET  81          1HT       MET  81  93.222  -8.862   2.027
    2   2H    MET  81          2HT       MET  81  94.899  -8.632   2.302
    3   3H    MET  81          3HT       MET  81  94.117  -7.803   1.019
    4    HA   MET  81           HA       MET  81  94.620  -6.509   3.073
    5   1HB   MET  81          2HB       MET  81  92.478  -5.315   2.875
    6   2HB   MET  81          1HB       MET  81  93.111  -5.770   1.300
    7   1HG   MET  81          2HG       MET  81  91.480  -7.895   2.085
    8   2HG   MET  81          1HG       MET  81  90.602  -6.434   2.530
    9   1HE   MET  81          1HE       MET  81  92.019  -8.701   0.099
   10   2HE   MET  81          2HE       MET  81  92.727  -7.529  -1.014
   11   3HE   MET  81          3HE       MET  81  91.218  -8.342  -1.431
   12    H    VAL  82           H        VAL  82  92.893  -5.687   4.858
   13    HA   VAL  82           HA       VAL  82  91.892  -6.067   6.869
   14    HB   VAL  82           HB       VAL  82  91.489  -8.933   6.017
   15   1HG1  VAL  82          1HG1      VAL  82  89.343  -8.292   7.496
   16   2HG1  VAL  82          2HG1      VAL  82  90.543  -7.235   8.238
   17   3HG1  VAL  82          3HG1      VAL  82  90.819  -8.976   8.176
   18   1HG2  VAL  82          1HG2      VAL  82  90.641  -7.254   4.344
   19   2HG2  VAL  82          2HG2      VAL  82  89.551  -6.667   5.599
   20   3HG2  VAL  82          3HG2      VAL  82  89.418  -8.329   5.021
   21    H    ARG  83           H        ARG  83  93.544  -9.141   6.093
   22    HA   ARG  83           HA       ARG  83  94.479  -9.672   8.651
   23   1HB   ARG  83          2HB       ARG  83  94.671 -10.881   6.169
   24   2HB   ARG  83          1HB       ARG  83  96.343 -10.509   6.564
   25   1HG   ARG  83          2HG       ARG  83  94.991 -11.640   8.840
   26   2HG   ARG  83          1HG       ARG  83  94.840 -12.691   7.430
   27   1HD   ARG  83          2HD       ARG  83  97.436 -11.551   8.457
   28   2HD   ARG  83          1HD       ARG  83  96.842 -13.173   8.811
   29    HE   ARG  83           HE       ARG  83  98.091 -12.284   6.396
   30   1HH1  ARG  83          1HH1      ARG  83  95.828 -14.583   7.729
   31   2HH1  ARG  83          2HH1      ARG  83  96.058 -15.735   6.457
   32   1HH2  ARG  83          1HH2      ARG  83  98.396 -13.799   4.724
   33   2HH2  ARG  83          2HH2      ARG  83  97.515 -15.292   4.751
   34    H    CYS  84           H        CYS  84  96.628  -8.618   6.010
   35    HA   CYS  84           HA       CYS  84  97.694  -6.385   7.322
   36   1HB   CYS  84          2HB       CYS  84  98.525  -8.611   8.626
   37   2HB   CYS  84          1HB       CYS  84  99.804  -8.454   7.428
   38    HG   CYS  84           HG       CYS  84 100.209  -7.119   9.767
   39    H    MET  85           H        MET  85 100.116  -6.030   6.413
   40    HA   MET  85           HA       MET  85  99.933  -6.583   3.527
   41   1HB   MET  85          2HB       MET  85 100.576  -4.170   5.069
   42   2HB   MET  85          1HB       MET  85 101.701  -4.495   3.757
   43   1HG   MET  85          2HG       MET  85  99.355  -4.868   2.486
   44   2HG   MET  85          1HG       MET  85  98.889  -3.655   3.676
   45   1HE   MET  85          1HE       MET  85  99.953  -4.057   0.154
   46   2HE   MET  85          2HE       MET  85  99.912  -2.322  -0.162
   47   3HE   MET  85          3HE       MET  85  98.572  -3.097   0.684
   48    H    LYS  86           H        LYS  86 102.393  -5.990   2.646
   49    HA   LYS  86           HA       LYS  86 103.932  -8.238   3.569
   50   1HB   LYS  86          2HB       LYS  86 104.395  -6.172   1.420
   51   2HB   LYS  86          1HB       LYS  86 105.557  -7.441   1.787
   52   1HG   LYS  86          2HG       LYS  86 103.811  -9.124   1.293
   53   2HG   LYS  86          1HG       LYS  86 102.731  -7.812   0.819
   54   1HD   LYS  86          2HD       LYS  86 104.943  -7.238  -0.653
   55   2HD   LYS  86          1HD       LYS  86 105.005  -9.001  -0.611
   56   1HE   LYS  86          2HE       LYS  86 102.602  -8.999  -1.342
   57   2HE   LYS  86          1HE       LYS  86 102.753  -7.261  -1.595
   58   1HZ   LYS  86          1HZ       LYS  86 104.342  -9.370  -2.955
   59   2HZ   LYS  86          2HZ       LYS  86 104.548  -7.706  -3.174
   60   3HZ   LYS  86          3HZ       LYS  86 103.105  -8.449  -3.649
   61    H    ASP  87           H        ASP  87 105.248  -5.031   2.817
   62    HA   ASP  87           HA       ASP  87 106.496  -4.978   5.481
   63   1HB   ASP  87          2HB       ASP  87 108.576  -4.130   4.455
   64   2HB   ASP  87          1HB       ASP  87 108.179  -5.753   3.898
   65    H    ASP  88           H        ASP  88 105.663  -3.265   6.483
   66    HA   ASP  88           HA       ASP  88 104.430  -1.080   5.258
   67   1HB   ASP  88          2HB       ASP  88 104.756  -1.987   7.856
   68   2HB   ASP  88          1HB       ASP  88 105.597  -0.440   7.857
   69    H    SER  89           H        SER  89 105.488   1.197   6.473
   70    HA   SER  89           HA       SER  89 107.766   1.681   4.726
   71   1HB   SER  89          2HB       SER  89 105.581   3.192   5.253
   72   2HB   SER  89          1HB       SER  89 106.727   3.889   6.396
   73    HG   SER  89           HG       SER  89 106.880   3.757   3.586
   74    H    LYS  90           H        LYS  90 107.905   0.178   7.365
   75    HA   LYS  90           HA       LYS  90 109.148   1.597   9.366
   76   1HB   LYS  90          2HB       LYS  90 108.863  -1.161   8.623
   77   2HB   LYS  90          1HB       LYS  90 110.493  -0.884   9.218
   78   1HG   LYS  90          2HG       LYS  90 107.985  -0.103  10.688
   79   2HG   LYS  90          1HG       LYS  90 108.898  -1.587  10.970
   80   1HD   LYS  90          2HD       LYS  90 110.799  -0.371  11.723
   81   2HD   LYS  90          1HD       LYS  90 110.112   1.162  11.180
   82   1HE   LYS  90          2HE       LYS  90 109.928   0.932  13.598
   83   2HE   LYS  90          1HE       LYS  90 108.334   0.956  12.843
   84   1HZ   LYS  90          1HZ       LYS  90 108.304  -0.758  14.438
   85   2HZ   LYS  90          2HZ       LYS  90 109.789  -1.384  13.930
   86   3HZ   LYS  90          3HZ       LYS  90 108.426  -1.535  12.941
   87    H    GLY  91           H        GLY  91 111.664   0.589   9.837
   88   1HA   GLY  91          2HA       GLY  91 113.238   2.265   8.074
   89   2HA   GLY  91          1HA       GLY  91 113.799   1.467   9.536
   90    H    LYS  92           H        LYS  92 115.398   1.497   7.334
   91    HA   LYS  92           HA       LYS  92 115.223  -1.276   6.350
   92   1HB   LYS  92          2HB       LYS  92 116.203   1.220   4.974
   93   2HB   LYS  92          1HB       LYS  92 116.630  -0.389   4.407
   94   1HG   LYS  92          2HG       LYS  92 113.763   0.017   4.853
   95   2HG   LYS  92          1HG       LYS  92 114.466   1.030   3.589
   96   1HD   LYS  92          2HD       LYS  92 115.307  -0.905   2.432
   97   2HD   LYS  92          1HD       LYS  92 114.805  -1.963   3.752
   98   1HE   LYS  92          2HE       LYS  92 112.454  -0.798   3.191
   99   2HE   LYS  92          1HE       LYS  92 113.208  -0.717   1.599
  100   1HZ   LYS  92          1HZ       LYS  92 112.276  -3.025   3.093
  101   2HZ   LYS  92          2HZ       LYS  92 113.742  -3.234   2.276
  102   3HZ   LYS  92          3HZ       LYS  92 112.356  -2.775   1.421
  103    H    THR  93           H        THR  93 116.826  -2.575   6.913
  104    HA   THR  93           HA       THR  93 119.292  -1.377   7.986
  105    HB   THR  93           HB       THR  93 118.008  -4.045   8.604
  106    HG1  THR  93           HG1      THR  93 118.266  -1.626  10.035
  107   1HG2  THR  93          1HG2      THR  93 120.037  -3.247  10.461
  108   2HG2  THR  93          2HG2      THR  93 120.713  -3.395   8.840
  109   3HG2  THR  93          3HG2      THR  93 119.863  -4.757   9.568
  110    H    GLU  94           H        GLU  94 118.627  -4.689   6.889
  111    HA   GLU  94           HA       GLU  94 121.147  -4.874   5.580
  112   1HB   GLU  94          2HB       GLU  94 118.748  -6.699   5.348
  113   2HB   GLU  94          1HB       GLU  94 120.395  -7.088   4.870
  114   1HG   GLU  94          2HG       GLU  94 120.122  -6.220   7.650
  115   2HG   GLU  94          1HG       GLU  94 119.268  -7.713   7.260
  116    H    GLU  95           H        GLU  95 118.030  -3.808   4.590
  117    HA   GLU  95           HA       GLU  95 118.743  -4.035   1.754
  118   1HB   GLU  95          2HB       GLU  95 116.296  -4.242   3.198
  119   2HB   GLU  95          1HB       GLU  95 116.166  -2.867   2.110
  120   1HG   GLU  95          2HG       GLU  95 115.365  -4.668   0.875
  121   2HG   GLU  95          1HG       GLU  95 117.013  -4.436   0.293
  122    H    GLU  96           H        GLU  96 119.527  -1.946   4.008
  123    HA   GLU  96           HA       GLU  96 118.794   0.473   2.522
  124   1HB   GLU  96          2HB       GLU  96 119.263   1.718   4.481
  125   2HB   GLU  96          1HB       GLU  96 118.376   0.299   5.011
  126   1HG   GLU  96          2HG       GLU  96 119.984  -0.103   6.470
  127   2HG   GLU  96          1HG       GLU  96 121.080  -0.411   5.125
  128    H    LEU  97           H        LEU  97 121.498  -1.519   3.426
  129    HA   LEU  97           HA       LEU  97 123.547   0.353   2.830
  130   1HB   LEU  97          2HB       LEU  97 123.448  -2.619   3.171
  131   2HB   LEU  97          1HB       LEU  97 124.907  -1.856   2.572
  132    HG   LEU  97           HG       LEU  97 123.585  -1.357   5.238
  133   1HD1  LEU  97          1HD1      LEU  97 126.358  -2.383   4.759
  134   2HD1  LEU  97          2HD1      LEU  97 124.974  -3.476   4.799
  135   3HD1  LEU  97          3HD1      LEU  97 125.364  -2.495   6.212
  136   1HD2  LEU  97          1HD2      LEU  97 125.902  -0.004   3.882
  137   2HD2  LEU  97          2HD2      LEU  97 125.676   0.022   5.631
  138   3HD2  LEU  97          3HD2      LEU  97 124.456   0.731   4.575
  139    H    SER  98           H        SER  98 121.430  -1.412   0.835
  140    HA   SER  98           HA       SER  98 123.153  -1.775  -1.406
  141   1HB   SER  98          2HB       SER  98 120.708  -1.792  -2.537
  142   2HB   SER  98          1HB       SER  98 121.364  -3.173  -1.655
  143    HG   SER  98           HG       SER  98 119.621  -1.168  -0.652
  144    H    ASP  99           H        ASP  99 120.582   0.584  -0.679
  145    HA   ASP  99           HA       ASP  99 120.883   2.133  -2.990
  146   1HB   ASP  99          2HB       ASP  99 119.173   2.165  -0.872
  147   2HB   ASP  99          1HB       ASP  99 120.146   3.593  -0.531
  148    H    LEU 100           H        LEU 100 122.588   2.171   0.072
  149    HA   LEU 100           HA       LEU 100 123.965   4.628  -0.401
  150   1HB   LEU 100          2HB       LEU 100 124.088   2.450   1.610
  151   2HB   LEU 100          1HB       LEU 100 125.515   3.452   1.432
  152    HG   LEU 100           HG       LEU 100 122.949   4.896   1.717
  153   1HD1  LEU 100          1HD1      LEU 100 123.199   4.637   4.248
  154   2HD1  LEU 100          2HD1      LEU 100 124.126   3.183   3.880
  155   3HD1  LEU 100          3HD1      LEU 100 122.445   3.312   3.360
  156   1HD2  LEU 100          1HD2      LEU 100 125.471   5.703   1.620
  157   2HD2  LEU 100          2HD2      LEU 100 125.374   5.394   3.353
  158   3HD2  LEU 100          3HD2      LEU 100 124.262   6.535   2.598
  159    H    PHE 101           H        PHE 101 124.418   1.379  -1.434
  160    HA   PHE 101           HA       PHE 101 127.236   1.524  -1.865
  161   1HB   PHE 101          2HB       PHE 101 126.067  -0.621  -1.580
  162   2HB   PHE 101          1HB       PHE 101 125.178  -0.338  -3.072
  163    HD1  PHE 101           HD1      PHE 101 126.613   0.003  -5.207
  164    HD2  PHE 101           HD2      PHE 101 128.046  -1.807  -1.633
  165    HE1  PHE 101           HE1      PHE 101 128.406  -1.092  -6.486
  166    HE2  PHE 101           HE2      PHE 101 129.842  -2.904  -2.906
  167    HZ   PHE 101           HZ       PHE 101 130.024  -2.547  -5.335
  168    H    ARG 102           H        ARG 102 124.377   2.152  -3.838
  169    HA   ARG 102           HA       ARG 102 125.589   2.310  -6.338
  170   1HB   ARG 102          2HB       ARG 102 123.044   2.835  -5.238
  171   2HB   ARG 102          1HB       ARG 102 123.518   4.292  -6.101
  172   1HG   ARG 102          2HG       ARG 102 122.780   3.307  -7.943
  173   2HG   ARG 102          1HG       ARG 102 124.187   2.246  -7.839
  174   1HD   ARG 102          2HD       ARG 102 122.941   0.589  -6.659
  175   2HD   ARG 102          1HD       ARG 102 121.571   1.680  -6.457
  176    HE   ARG 102           HE       ARG 102 122.114   0.032  -8.703
  177   1HH1  ARG 102          1HH1      ARG 102 120.793   3.137  -7.807
  178   2HH1  ARG 102          2HH1      ARG 102 119.763   3.239  -9.194
  179   1HH2  ARG 102          1HH2      ARG 102 120.759   0.166 -10.529
  180   2HH2  ARG 102          2HH2      ARG 102 119.743   1.553 -10.740
  181    H    MET 103           H        MET 103 124.962   4.924  -3.997
  182    HA   MET 103           HA       MET 103 125.999   7.043  -5.433
  183   1HB   MET 103          2HB       MET 103 126.554   8.042  -3.172
  184   2HB   MET 103          1HB       MET 103 124.887   7.536  -3.406
  185   1HG   MET 103          2HG       MET 103 125.274   5.529  -2.135
  186   2HG   MET 103          1HG       MET 103 126.986   5.919  -1.986
  187   1HE   MET 103          1HE       MET 103 127.038   8.946   0.396
  188   2HE   MET 103          2HE       MET 103 127.406   8.673  -1.307
  189   3HE   MET 103          3HE       MET 103 127.966   7.526  -0.089
  190    H    PHE 104           H        PHE 104 127.703   4.731  -3.380
  191    HA   PHE 104           HA       PHE 104 130.247   5.887  -3.481
  192   1HB   PHE 104          2HB       PHE 104 129.140   3.224  -2.846
  193   2HB   PHE 104          1HB       PHE 104 130.828   3.233  -3.351
  194    HD1  PHE 104           HD1      PHE 104 132.530   4.033  -1.922
  195    HD2  PHE 104           HD2      PHE 104 128.440   4.543  -0.865
  196    HE1  PHE 104           HE1      PHE 104 133.205   4.708   0.345
  197    HE2  PHE 104           HE2      PHE 104 129.106   5.219   1.406
  198    HZ   PHE 104           HZ       PHE 104 131.493   5.303   2.013
  199    H    ASP 105           H        ASP 105 128.497   3.977  -5.809
  200    HA   ASP 105           HA       ASP 105 130.833   3.561  -7.480
  201   1HB   ASP 105          2HB       ASP 105 128.631   2.057  -7.135
  202   2HB   ASP 105          1HB       ASP 105 128.108   3.003  -8.524
  203    H    LYS 106           H        LYS 106 131.212   4.537  -9.451
  204    HA   LYS 106           HA       LYS 106 129.657   6.984  -9.944
  205   1HB   LYS 106          2HB       LYS 106 132.144   7.129  -9.418
  206   2HB   LYS 106          1HB       LYS 106 132.422   6.390 -10.988
  207   1HG   LYS 106          2HG       LYS 106 132.666   8.743 -11.230
  208   2HG   LYS 106          1HG       LYS 106 131.158   8.274 -12.019
  209   1HD   LYS 106          2HD       LYS 106 130.780  10.284 -10.753
  210   2HD   LYS 106          1HD       LYS 106 129.935   8.950  -9.966
  211   1HE   LYS 106          2HE       LYS 106 132.500   9.001  -8.837
  212   2HE   LYS 106          1HE       LYS 106 131.985  10.686  -8.929
  213   1HZ   LYS 106          1HZ       LYS 106 130.954   8.521  -7.301
  214   2HZ   LYS 106          2HZ       LYS 106 129.779   9.527  -7.982
  215   3HZ   LYS 106          3HZ       LYS 106 130.987  10.184  -6.998
  216    H    ASN 107           H        ASN 107 131.267   4.292 -11.614
  217    HA   ASN 107           HA       ASN 107 129.953   4.983 -14.109
  218   1HB   ASN 107          2HB       ASN 107 131.248   3.121 -15.057
  219   2HB   ASN 107          1HB       ASN 107 132.282   4.239 -14.171
  220   1HD2  ASN 107          1HD2      ASN 107 132.034   1.163 -14.822
  221   2HD2  ASN 107          2HD2      ASN 107 132.552   0.446 -13.337
  222    H    ALA 108           H        ALA 108 128.759   3.627 -11.476
  223    HA   ALA 108           HA       ALA 108 127.210   2.022 -10.963
  224   1HB   ALA 108          1HB       ALA 108 125.290   1.990 -12.523
  225   2HB   ALA 108          2HB       ALA 108 126.253   2.906 -13.681
  226   3HB   ALA 108          3HB       ALA 108 125.831   3.620 -12.124
  227    H    ASP 109           H        ASP 109 128.951   0.360 -11.143
  228    HA   ASP 109           HA       ASP 109 128.306  -1.550 -13.293
  229   1HB   ASP 109          2HB       ASP 109 130.639  -2.317 -13.230
  230   2HB   ASP 109          1HB       ASP 109 130.536  -0.607 -13.644
  231    H    GLY 110           H        GLY 110 128.147  -1.000 -10.016
  232   1HA   GLY 110          2HA       GLY 110 127.208  -2.535  -8.492
  233   2HA   GLY 110          1HA       GLY 110 127.749  -3.853  -9.520
  234    H    TYR 111           H        TYR 111 130.349  -1.921  -9.378
  235    HA   TYR 111           HA       TYR 111 131.323  -2.893  -6.795
  236   1HB   TYR 111          2HB       TYR 111 132.904  -3.239  -9.349
  237   2HB   TYR 111          1HB       TYR 111 133.337  -3.813  -7.742
  238    HD1  TYR 111           HD1      TYR 111 132.355  -4.953 -10.778
  239    HD2  TYR 111           HD2      TYR 111 131.162  -5.234  -6.705
  240    HE1  TYR 111           HE1      TYR 111 131.252  -7.100 -11.254
  241    HE2  TYR 111           HE2      TYR 111 130.057  -7.380  -7.169
  242    HH   TYR 111           HH       TYR 111 130.390  -9.266  -8.994
  243    H    ILE 112           H        ILE 112 132.894  -1.604  -5.850
  244    HA   ILE 112           HA       ILE 112 133.370   0.961  -7.214
  245    HB   ILE 112           HB       ILE 112 133.525   0.399  -4.251
  246   1HG1  ILE 112          2HG1      ILE 112 131.401   2.180  -4.979
  247   2HG1  ILE 112          1HG1      ILE 112 131.238   0.696  -5.911
  248   1HG2  ILE 112          1HG2      ILE 112 134.897   2.246  -4.719
  249   2HG2  ILE 112          2HG2      ILE 112 133.367   2.938  -4.180
  250   3HG2  ILE 112          3HG2      ILE 112 133.759   2.898  -5.899
  251   1HD1  ILE 112          1HD1      ILE 112 130.023   0.187  -4.045
  252   2HD1  ILE 112          2HD1      ILE 112 131.070   1.120  -2.974
  253   3HD1  ILE 112          3HD1      ILE 112 131.606  -0.443  -3.589
  254    H    ASP 113           H        ASP 113 135.383   1.639  -7.617
  255    HA   ASP 113           HA       ASP 113 137.595  -0.084  -6.729
  256   1HB   ASP 113          2HB       ASP 113 138.832   1.034  -8.670
  257   2HB   ASP 113          1HB       ASP 113 137.544  -0.090  -9.092
  258    H    LEU 114           H        LEU 114 139.772   1.267  -6.815
  259    HA   LEU 114           HA       LEU 114 139.679   3.038  -4.638
  260   1HB   LEU 114          2HB       LEU 114 141.648   1.697  -6.084
  261   2HB   LEU 114          1HB       LEU 114 142.034   3.395  -6.288
  262    HG   LEU 114           HG       LEU 114 141.445   2.511  -3.524
  263   1HD1  LEU 114          1HD1      LEU 114 142.826   0.672  -4.533
  264   2HD1  LEU 114          2HD1      LEU 114 143.558   1.496  -3.157
  265   3HD1  LEU 114          3HD1      LEU 114 144.095   1.868  -4.795
  266   1HD2  LEU 114          1HD2      LEU 114 142.211   4.829  -4.474
  267   2HD2  LEU 114          2HD2      LEU 114 143.812   4.090  -4.411
  268   3HD2  LEU 114          3HD2      LEU 114 142.847   4.232  -2.941
  269    H    GLU 115           H        GLU 115 139.488   3.571  -8.077
  270    HA   GLU 115           HA       GLU 115 140.103   6.343  -8.041
  271   1HB   GLU 115          2HB       GLU 115 138.912   4.443 -10.000
  272   2HB   GLU 115          1HB       GLU 115 138.663   6.162 -10.272
  273   1HG   GLU 115          2HG       GLU 115 140.584   5.937 -11.424
  274   2HG   GLU 115          1HG       GLU 115 141.290   6.194  -9.830
  275    H    GLU 116           H        GLU 116 136.967   4.715  -8.547
  276    HA   GLU 116           HA       GLU 116 135.364   6.973  -8.345
  277   1HB   GLU 116          2HB       GLU 116 134.832   4.071  -7.757
  278   2HB   GLU 116          1HB       GLU 116 133.576   5.287  -7.593
  279   1HG   GLU 116          2HG       GLU 116 133.129   5.017  -9.740
  280   2HG   GLU 116          1HG       GLU 116 134.697   5.737 -10.104
  281    H    LEU 117           H        LEU 117 136.456   4.767  -5.800
  282    HA   LEU 117           HA       LEU 117 134.994   5.817  -3.674
  283   1HB   LEU 117          2HB       LEU 117 136.332   3.714  -3.644
  284   2HB   LEU 117          1HB       LEU 117 137.788   4.686  -3.554
  285    HG   LEU 117           HG       LEU 117 136.993   5.620  -1.395
  286   1HD1  LEU 117          1HD1      LEU 117 135.133   4.566  -0.246
  287   2HD1  LEU 117          2HD1      LEU 117 134.823   3.542  -1.648
  288   3HD1  LEU 117          3HD1      LEU 117 134.592   5.287  -1.763
  289   1HD2  LEU 117          1HD2      LEU 117 138.517   3.668  -1.533
  290   2HD2  LEU 117          2HD2      LEU 117 137.111   2.608  -1.425
  291   3HD2  LEU 117          3HD2      LEU 117 137.516   3.675  -0.080
  292    H    LYS 118           H        LYS 118 137.733   7.105  -5.341
  293    HA   LYS 118           HA       LYS 118 138.396   8.977  -3.228
  294   1HB   LYS 118          2HB       LYS 118 140.106   7.917  -4.758
  295   2HB   LYS 118          1HB       LYS 118 139.467   8.925  -6.048
  296   1HG   LYS 118          2HG       LYS 118 140.246  10.885  -5.077
  297   2HG   LYS 118          1HG       LYS 118 140.418  10.141  -3.486
  298   1HD   LYS 118          2HD       LYS 118 142.360   8.986  -4.112
  299   2HD   LYS 118          1HD       LYS 118 142.049   9.224  -5.833
  300   1HE   LYS 118          2HE       LYS 118 143.763  10.733  -5.357
  301   2HE   LYS 118          1HE       LYS 118 142.305  11.724  -5.338
  302   1HZ   LYS 118          1HZ       LYS 118 144.053  10.947  -3.134
  303   2HZ   LYS 118          2HZ       LYS 118 142.400  11.065  -2.796
  304   3HZ   LYS 118          3HZ       LYS 118 143.236  12.404  -3.405
  305    H    ILE 119           H        ILE 119 136.529   8.896  -6.157
  306    HA   ILE 119           HA       ILE 119 136.389  11.673  -6.652
  307    HB   ILE 119           HB       ILE 119 134.279   9.618  -7.315
  308   1HG1  ILE 119          2HG1      ILE 119 136.727  10.451  -8.889
  309   2HG1  ILE 119          1HG1      ILE 119 136.477   8.886  -8.126
  310   1HG2  ILE 119          1HG2      ILE 119 133.396  11.770  -7.682
  311   2HG2  ILE 119          2HG2      ILE 119 133.928  11.205  -9.265
  312   3HG2  ILE 119          3HG2      ILE 119 134.911  12.361  -8.367
  313   1HD1  ILE 119          1HD1      ILE 119 134.429   8.673  -9.616
  314   2HD1  ILE 119          2HD1      ILE 119 136.011   8.551 -10.388
  315   3HD1  ILE 119          3HD1      ILE 119 135.083  10.046 -10.509
  316    H    MET 120           H        MET 120 134.049   9.499  -5.063
  317    HA   MET 120           HA       MET 120 132.146  11.338  -4.322
  318   1HB   MET 120          2HB       MET 120 131.530   9.799  -2.521
  319   2HB   MET 120          1HB       MET 120 131.880   8.927  -4.007
  320   1HG   MET 120          2HG       MET 120 133.706   7.911  -3.149
  321   2HG   MET 120          1HG       MET 120 134.122   9.281  -2.122
  322   1HE   MET 120          1HE       MET 120 134.135   6.686   0.371
  323   2HE   MET 120          2HE       MET 120 133.842   8.342   0.901
  324   3HE   MET 120          3HE       MET 120 134.891   8.031  -0.483
  325    H    LEU 121           H        LEU 121 135.308  10.851  -2.957
  326    HA   LEU 121           HA       LEU 121 134.893  12.165  -0.488
  327   1HB   LEU 121          2HB       LEU 121 137.456  11.954  -2.068
  328   2HB   LEU 121          1HB       LEU 121 137.315  12.306  -0.356
  329    HG   LEU 121           HG       LEU 121 136.440   9.707  -1.615
  330   1HD1  LEU 121          1HD1      LEU 121 138.466   8.732  -0.935
  331   2HD1  LEU 121          2HD1      LEU 121 138.923  10.144   0.015
  332   3HD1  LEU 121          3HD1      LEU 121 138.923  10.229  -1.746
  333   1HD2  LEU 121          1HD2      LEU 121 136.723   9.023   0.864
  334   2HD2  LEU 121          2HD2      LEU 121 135.271   9.898   0.378
  335   3HD2  LEU 121          3HD2      LEU 121 136.585  10.752   1.186
  336    H    GLN 122           H        GLN 122 135.793  13.303  -3.693
  337    HA   GLN 122           HA       GLN 122 136.495  15.936  -2.952
  338   1HB   GLN 122          2HB       GLN 122 135.459  14.874  -5.586
  339   2HB   GLN 122          1HB       GLN 122 136.178  16.461  -5.352
  340   1HG   GLN 122          2HG       GLN 122 137.643  13.926  -4.703
  341   2HG   GLN 122          1HG       GLN 122 137.661  14.644  -6.312
  342   1HE2  GLN 122          1HE2      GLN 122 139.365  15.847  -6.691
  343   2HE2  GLN 122          2HE2      GLN 122 140.243  16.776  -5.528
  344    H    ALA 123           H        ALA 123 133.443  14.374  -3.564
  345    HA   ALA 123           HA       ALA 123 131.922  16.767  -3.896
  346   1HB   ALA 123          1HB       ALA 123 130.095  15.411  -4.155
  347   2HB   ALA 123          2HB       ALA 123 130.658  14.238  -2.965
  348   3HB   ALA 123          3HB       ALA 123 131.388  14.287  -4.569
  349    H    THR 124           H        THR 124 133.127  15.041  -1.165
  350    HA   THR 124           HA       THR 124 131.186  15.992   0.715
  351    HB   THR 124           HB       THR 124 132.506  14.954   2.384
  352    HG1  THR 124           HG1      THR 124 134.639  15.129   0.530
  353   1HG2  THR 124          1HG2      THR 124 132.885  12.761   1.635
  354   2HG2  THR 124          2HG2      THR 124 133.174  13.294  -0.021
  355   3HG2  THR 124          3HG2      THR 124 131.551  13.381   0.662
  356    H    GLY 125           H        GLY 125 132.250  17.114   2.783
  357   1HA   GLY 125          2HA       GLY 125 133.503  19.574   1.745
  358   2HA   GLY 125          1HA       GLY 125 132.469  19.495   3.162
  359    H    GLU 126           H        GLU 126 134.458  16.840   3.246
  360    HA   GLU 126           HA       GLU 126 136.276  18.201   5.104
  361   1HB   GLU 126          2HB       GLU 126 135.466  15.304   4.839
  362   2HB   GLU 126          1HB       GLU 126 136.749  15.853   5.911
  363   1HG   GLU 126          2HG       GLU 126 134.097  17.160   6.142
  364   2HG   GLU 126          1HG       GLU 126 134.265  15.512   6.742
  365    H    THR 127           H        THR 127 138.424  16.707   5.269
  366    HA   THR 127           HA       THR 127 139.464  16.478   2.521
  367    HB   THR 127           HB       THR 127 141.617  17.310   3.324
  368    HG1  THR 127           HG1      THR 127 141.716  16.784   5.427
  369   1HG2  THR 127          1HG2      THR 127 140.204  19.039   2.506
  370   2HG2  THR 127          2HG2      THR 127 140.994  19.628   3.969
  371   3HG2  THR 127          3HG2      THR 127 139.312  19.104   4.025
  372    H    ILE 128           H        ILE 128 139.734  14.382   2.123
  373    HA   ILE 128           HA       ILE 128 140.794  12.660   4.265
  374    HB   ILE 128           HB       ILE 128 139.534  11.652   1.727
  375   1HG1  ILE 128          2HG1      ILE 128 137.919  13.162   2.829
  376   2HG1  ILE 128          1HG1      ILE 128 137.398  11.482   2.902
  377   1HG2  ILE 128          1HG2      ILE 128 139.662   9.611   2.656
  378   2HG2  ILE 128          2HG2      ILE 128 139.247  10.202   4.264
  379   3HG2  ILE 128          3HG2      ILE 128 140.900  10.351   3.670
  380   1HD1  ILE 128          1HD1      ILE 128 137.391  11.485   5.124
  381   2HD1  ILE 128          2HD1      ILE 128 137.511  13.240   5.003
  382   3HD1  ILE 128          3HD1      ILE 128 138.968  12.268   5.214
  383    H    THR 129           H        THR 129 142.576  11.355   3.896
  384    HA   THR 129           HA       THR 129 144.282  12.209   1.697
  385    HB   THR 129           HB       THR 129 145.144  12.102   4.038
  386    HG1  THR 129           HG1      THR 129 146.471  10.293   2.314
  387   1HG2  THR 129          1HG2      THR 129 143.961   9.631   4.175
  388   2HG2  THR 129          2HG2      THR 129 145.141  10.287   5.310
  389   3HG2  THR 129          3HG2      THR 129 145.673   9.251   3.983
  390    H    GLU 130           H        GLU 130 145.582  10.533   0.545
  391    HA   GLU 130           HA       GLU 130 143.845   8.642  -0.669
  392   1HB   GLU 130          2HB       GLU 130 146.040   9.904  -1.523
  393   2HB   GLU 130          1HB       GLU 130 146.785   8.391  -1.024
  394   1HG   GLU 130          2HG       GLU 130 145.334   7.148  -2.502
  395   2HG   GLU 130          1HG       GLU 130 144.484   8.627  -2.948
  396    H    ASP 131           H        ASP 131 146.351   8.420   1.779
  397    HA   ASP 131           HA       ASP 131 146.725   5.650   1.793
  398   1HB   ASP 131          2HB       ASP 131 146.987   7.736   3.953
  399   2HB   ASP 131          1HB       ASP 131 147.361   6.042   4.244
  400    H    ASP 132           H        ASP 132 144.471   7.647   3.687
  401    HA   ASP 132           HA       ASP 132 143.303   5.613   5.184
  402   1HB   ASP 132          2HB       ASP 132 142.345   8.300   4.253
  403   2HB   ASP 132          1HB       ASP 132 141.245   7.222   5.107
  404    H    ILE 133           H        ILE 133 142.573   6.743   1.927
  405    HA   ILE 133           HA       ILE 133 140.232   5.131   1.620
  406    HB   ILE 133           HB       ILE 133 141.936   6.354  -0.552
  407   1HG1  ILE 133          2HG1      ILE 133 141.230   8.068   1.040
  408   2HG1  ILE 133          1HG1      ILE 133 140.339   8.238  -0.470
  409   1HG2  ILE 133          1HG2      ILE 133 139.068   5.419  -0.525
  410   2HG2  ILE 133          2HG2      ILE 133 140.413   4.677  -1.394
  411   3HG2  ILE 133          3HG2      ILE 133 139.841   6.281  -1.856
  412   1HD1  ILE 133          1HD1      ILE 133 139.365   7.176   2.158
  413   2HD1  ILE 133          2HD1      ILE 133 138.490   6.915   0.650
  414   3HD1  ILE 133          3HD1      ILE 133 138.768   8.555   1.237
  415    H    GLU 134           H        GLU 134 143.597   4.845   0.498
  416    HA   GLU 134           HA       GLU 134 143.378   2.543  -1.015
  417   1HB   GLU 134          2HB       GLU 134 145.549   3.918   0.433
  418   2HB   GLU 134          1HB       GLU 134 145.832   2.211   0.119
  419   1HG   GLU 134          2HG       GLU 134 145.574   2.533  -2.236
  420   2HG   GLU 134          1HG       GLU 134 145.065   4.205  -1.998
  421    H    GLU 135           H        GLU 135 143.752   2.869   2.484
  422    HA   GLU 135           HA       GLU 135 144.016   0.075   2.978
  423   1HB   GLU 135          2HB       GLU 135 143.730   0.652   5.324
  424   2HB   GLU 135          1HB       GLU 135 144.837   1.779   4.554
  425   1HG   GLU 135          2HG       GLU 135 143.410   3.539   4.750
  426   2HG   GLU 135          1HG       GLU 135 141.971   2.525   4.670
  427    H    LEU 136           H        LEU 136 141.326   2.243   2.590
  428    HA   LEU 136           HA       LEU 136 139.318   0.784   3.876
  429   1HB   LEU 136          2HB       LEU 136 139.431   3.135   2.504
  430   2HB   LEU 136          1HB       LEU 136 138.541   2.131   1.376
  431    HG   LEU 136           HG       LEU 136 137.406   1.747   3.961
  432   1HD1  LEU 136          1HD1      LEU 136 138.165   4.545   3.325
  433   2HD1  LEU 136          2HD1      LEU 136 138.008   3.738   4.886
  434   3HD1  LEU 136          3HD1      LEU 136 136.567   4.254   4.012
  435   1HD2  LEU 136          1HD2      LEU 136 135.397   2.533   2.874
  436   2HD2  LEU 136          2HD2      LEU 136 136.295   1.490   1.772
  437   3HD2  LEU 136          3HD2      LEU 136 136.344   3.240   1.565
  438    H    MET 137           H        MET 137 140.838   0.358   0.761
  439    HA   MET 137           HA       MET 137 138.881  -1.510  -0.211
  440   1HB   MET 137          2HB       MET 137 141.632  -0.742  -1.187
  441   2HB   MET 137          1HB       MET 137 140.615  -1.923  -2.001
  442   1HG   MET 137          2HG       MET 137 139.076   0.423  -1.559
  443   2HG   MET 137          1HG       MET 137 140.621   0.895  -2.265
  444   1HE   MET 137          1HE       MET 137 137.160   0.513  -3.960
  445   2HE   MET 137          2HE       MET 137 137.345  -0.389  -2.458
  446   3HE   MET 137          3HE       MET 137 137.108  -1.249  -3.978
  447    H    LYS 138           H        LYS 138 142.146  -1.721   1.154
  448    HA   LYS 138           HA       LYS 138 142.431  -4.513   0.899
  449   1HB   LYS 138          2HB       LYS 138 144.332  -3.023   1.313
  450   2HB   LYS 138          1HB       LYS 138 143.690  -2.629   2.902
  451   1HG   LYS 138          2HG       LYS 138 143.868  -5.115   3.413
  452   2HG   LYS 138          1HG       LYS 138 144.845  -5.228   1.946
  453   1HD   LYS 138          2HD       LYS 138 146.523  -4.856   3.431
  454   2HD   LYS 138          1HD       LYS 138 146.089  -3.176   3.113
  455   1HE   LYS 138          2HE       LYS 138 145.839  -2.973   5.321
  456   2HE   LYS 138          1HE       LYS 138 144.355  -3.904   5.125
  457   1HZ   LYS 138          1HZ       LYS 138 145.865  -4.788   6.848
  458   2HZ   LYS 138          2HZ       LYS 138 147.020  -5.103   5.652
  459   3HZ   LYS 138          3HZ       LYS 138 145.533  -5.910   5.624
  460    H    ASP 139           H        ASP 139 140.822  -2.516   3.259
  461    HA   ASP 139           HA       ASP 139 140.437  -4.767   5.071
  462   1HB   ASP 139          2HB       ASP 139 140.915  -2.271   5.721
  463   2HB   ASP 139          1HB       ASP 139 139.180  -2.078   5.482
  464    H    GLY 140           H        GLY 140 138.968  -3.737   2.306
  465   1HA   GLY 140          2HA       GLY 140 136.341  -4.719   3.231
  466   2HA   GLY 140          1HA       GLY 140 136.507  -3.430   2.049
  467    H    ASP 141           H        ASP 141 138.945  -5.570   1.427
  468    HA   ASP 141           HA       ASP 141 137.286  -7.046  -0.508
  469   1HB   ASP 141          2HB       ASP 141 139.865  -5.619  -0.802
  470   2HB   ASP 141          1HB       ASP 141 139.738  -7.165  -1.635
  471    H    LYS 142           H        LYS 142 137.034  -9.042   0.221
  472    HA   LYS 142           HA       LYS 142 139.100 -10.342   1.782
  473   1HB   LYS 142          2HB       LYS 142 136.265 -10.951   1.066
  474   2HB   LYS 142          1HB       LYS 142 137.307 -12.273   1.575
  475   1HG   LYS 142          2HG       LYS 142 136.177 -11.515   3.502
  476   2HG   LYS 142          1HG       LYS 142 137.836 -10.930   3.629
  477   1HD   LYS 142          2HD       LYS 142 136.558  -9.081   4.241
  478   2HD   LYS 142          1HD       LYS 142 136.931  -8.777   2.543
  479   1HE   LYS 142          2HE       LYS 142 134.777  -9.240   1.851
  480   2HE   LYS 142          1HE       LYS 142 134.425 -10.231   3.267
  481   1HZ   LYS 142          1HZ       LYS 142 133.233  -8.234   3.527
  482   2HZ   LYS 142          2HZ       LYS 142 134.563  -7.276   3.111
  483   3HZ   LYS 142          3HZ       LYS 142 134.551  -8.112   4.581
  484    H    ASN 143           H        ASN 143 137.702 -10.542  -1.434
  485    HA   ASN 143           HA       ASN 143 139.206 -12.916  -2.116
  486   1HB   ASN 143          2HB       ASN 143 138.252 -12.492  -4.412
  487   2HB   ASN 143          1HB       ASN 143 137.053 -12.717  -3.141
  488   1HD2  ASN 143          1HD2      ASN 143 135.652 -11.652  -4.708
  489   2HD2  ASN 143          2HD2      ASN 143 135.610  -9.926  -4.748
  490    H    ASN 144           H        ASN 144 139.936  -9.682  -1.847
  491    HA   ASN 144           HA       ASN 144 141.646  -8.369  -2.533
  492   1HB   ASN 144          2HB       ASN 144 142.722 -10.827  -1.996
  493   2HB   ASN 144          1HB       ASN 144 143.285 -10.545  -3.640
  494   1HD2  ASN 144          1HD2      ASN 144 142.758  -8.402  -0.863
  495   2HD2  ASN 144          2HD2      ASN 144 144.362  -7.759  -0.839
  496    H    ASP 145           H        ASP 145 139.538  -9.222  -4.500
  497    HA   ASP 145           HA       ASP 145 140.722  -9.487  -7.052
  498   1HB   ASP 145          2HB       ASP 145 138.501  -8.895  -7.925
  499   2HB   ASP 145          1HB       ASP 145 138.379 -10.079  -6.628
  500    H    GLY 146           H        GLY 146 139.748  -6.709  -5.122
  501   1HA   GLY 146          2HA       GLY 146 141.204  -4.719  -5.425
  502   2HA   GLY 146          1HA       GLY 146 141.007  -4.963  -7.153
  503    H    ARG 147           H        ARG 147 138.107  -5.669  -5.667
  504    HA   ARG 147           HA       ARG 147 137.158  -2.910  -5.635
  505   1HB   ARG 147          2HB       ARG 147 135.822  -5.035  -7.317
  506   2HB   ARG 147          1HB       ARG 147 135.321  -3.357  -7.151
  507   1HG   ARG 147          2HG       ARG 147 137.825  -2.983  -8.023
  508   2HG   ARG 147          1HG       ARG 147 137.479  -4.543  -8.774
  509   1HD   ARG 147          2HD       ARG 147 135.692  -3.688 -10.007
  510   2HD   ARG 147          1HD       ARG 147 135.536  -2.270  -8.971
  511    HE   ARG 147           HE       ARG 147 138.050  -2.380 -10.342
  512   1HH1  ARG 147          1HH1      ARG 147 134.698  -1.447 -10.641
  513   2HH1  ARG 147          2HH1      ARG 147 135.008  -0.266 -11.870
  514   1HH2  ARG 147          1HH2      ARG 147 138.457  -0.827 -11.957
  515   2HH2  ARG 147          2HH2      ARG 147 137.141   0.086 -12.616
  516    H    ILE 148           H        ILE 148 135.034  -2.681  -4.665
  517    HA   ILE 148           HA       ILE 148 134.477  -4.865  -2.770
  518    HB   ILE 148           HB       ILE 148 133.736  -1.950  -2.488
  519   1HG1  ILE 148          2HG1      ILE 148 135.974  -3.496  -1.159
  520   2HG1  ILE 148          1HG1      ILE 148 136.186  -2.308  -2.441
  521   1HG2  ILE 148          1HG2      ILE 148 133.710  -4.162  -0.441
  522   2HG2  ILE 148          2HG2      ILE 148 132.286  -3.568  -1.296
  523   3HG2  ILE 148          3HG2      ILE 148 133.175  -2.498  -0.212
  524   1HD1  ILE 148          1HD1      ILE 148 134.980  -1.705   0.247
  525   2HD1  ILE 148          2HD1      ILE 148 135.407  -0.550  -1.015
  526   3HD1  ILE 148          3HD1      ILE 148 136.672  -1.445  -0.176
  527    H    ASP 149           H        ASP 149 132.615  -5.912  -2.908
  528    HA   ASP 149           HA       ASP 149 130.520  -4.817  -4.653
  529   1HB   ASP 149          2HB       ASP 149 129.662  -7.166  -4.707
  530   2HB   ASP 149          1HB       ASP 149 131.283  -6.987  -5.371
  531    H    TYR 150           H        TYR 150 128.246  -5.562  -3.992
  532    HA   TYR 150           HA       TYR 150 127.643  -4.384  -1.494
  533   1HB   TYR 150          2HB       TYR 150 126.094  -4.371  -3.419
  534   2HB   TYR 150          1HB       TYR 150 125.871  -6.108  -3.238
  535    HD1  TYR 150           HD1      TYR 150 125.998  -3.460  -0.619
  536    HD2  TYR 150           HD2      TYR 150 123.633  -6.361  -2.641
  537    HE1  TYR 150           HE1      TYR 150 124.157  -3.052   0.961
  538    HE2  TYR 150           HE2      TYR 150 121.785  -5.961  -1.068
  539    HH   TYR 150           HH       TYR 150 121.776  -4.983   1.549
  540    H    ASP 151           H        ASP 151 128.471  -7.598  -2.374
  541    HA   ASP 151           HA       ASP 151 127.156  -8.950  -0.246
  542   1HB   ASP 151          2HB       ASP 151 129.056  -9.625  -2.373
  543   2HB   ASP 151          1HB       ASP 151 129.315 -10.538  -0.889
  544    H    GLU 152           H        GLU 152 130.609  -8.174  -0.726
  545    HA   GLU 152           HA       GLU 152 131.321  -8.842   1.933
  546   1HB   GLU 152          2HB       GLU 152 133.489  -7.802   1.395
  547   2HB   GLU 152          1HB       GLU 152 132.963  -8.939   0.161
  548   1HG   GLU 152          2HG       GLU 152 132.015  -6.847  -1.019
  549   2HG   GLU 152          1HG       GLU 152 133.100  -5.961   0.050
  550    H    PHE 153           H        PHE 153 130.404  -5.817   0.380
  551    HA   PHE 153           HA       PHE 153 131.242  -4.068   2.408
  552   1HB   PHE 153          2HB       PHE 153 129.751  -3.873  -0.009
  553   2HB   PHE 153          1HB       PHE 153 128.827  -3.070   1.251
  554    HD1  PHE 153           HD1      PHE 153 130.385  -1.994  -1.274
  555    HD2  PHE 153           HD2      PHE 153 131.193  -2.116   2.901
  556    HE1  PHE 153           HE1      PHE 153 131.816  -0.007  -1.497
  557    HE2  PHE 153           HE2      PHE 153 132.627  -0.129   2.686
  558    HZ   PHE 153           HZ       PHE 153 132.939   0.929   0.485
  559    H    LEU 154           H        LEU 154 128.459  -6.143   2.151
  560    HA   LEU 154           HA       LEU 154 126.760  -4.966   4.019
  561   1HB   LEU 154          2HB       LEU 154 126.744  -7.255   2.483
  562   2HB   LEU 154          1HB       LEU 154 126.790  -7.888   4.118
  563    HG   LEU 154           HG       LEU 154 124.503  -7.749   3.444
  564   1HD1  LEU 154          1HD1      LEU 154 125.247  -5.525   5.333
  565   2HD1  LEU 154          2HD1      LEU 154 124.848  -7.193   5.744
  566   3HD1  LEU 154          3HD1      LEU 154 123.605  -6.121   5.099
  567   1HD2  LEU 154          1HD2      LEU 154 125.229  -5.745   1.808
  568   2HD2  LEU 154          2HD2      LEU 154 124.471  -4.819   3.103
  569   3HD2  LEU 154          3HD2      LEU 154 123.557  -6.074   2.263
  570    H    GLU 155           H        GLU 155 129.546  -7.059   4.465
  571    HA   GLU 155           HA       GLU 155 129.110  -7.156   7.347
  572   1HB   GLU 155          2HB       GLU 155 131.074  -8.499   5.499
  573   2HB   GLU 155          1HB       GLU 155 131.256  -8.560   7.248
  574   1HG   GLU 155          2HG       GLU 155 129.055  -9.611   7.435
  575   2HG   GLU 155          1HG       GLU 155 128.889  -9.562   5.681
  576    H    PHE 156           H        PHE 156 131.286  -5.749   4.977
  577    HA   PHE 156           HA       PHE 156 133.203  -4.767   6.825
  578   1HB   PHE 156          2HB       PHE 156 133.682  -5.053   4.423
  579   2HB   PHE 156          1HB       PHE 156 132.535  -3.773   4.045
  580    HD1  PHE 156           HD1      PHE 156 133.494  -1.781   3.478
  581    HD2  PHE 156           HD2      PHE 156 135.418  -4.226   6.381
  582    HE1  PHE 156           HE1      PHE 156 135.288  -0.110   3.690
  583    HE2  PHE 156           HE2      PHE 156 137.214  -2.559   6.600
  584    HZ   PHE 156           HZ       PHE 156 137.150  -0.498   5.253
  585    H    MET 157           H        MET 157 130.392  -3.288   5.243
  586    HA   MET 157           HA       MET 157 130.758  -0.780   6.604
  587   1HB   MET 157          2HB       MET 157 129.691  -1.125   4.308
  588   2HB   MET 157          1HB       MET 157 128.263  -1.675   5.172
  589   1HG   MET 157          2HG       MET 157 127.604   0.430   5.289
  590   2HG   MET 157          1HG       MET 157 128.951   0.737   6.382
  591   1HE   MET 157          1HE       MET 157 131.321   0.530   5.211
  592   2HE   MET 157          2HE       MET 157 131.375   2.292   5.268
  593   3HE   MET 157          3HE       MET 157 131.756   1.446   3.768
  594    H    LYS 158           H        LYS 158 129.702  -3.707   7.689
  595    HA   LYS 158           HA       LYS 158 127.644  -2.603   9.461
  596   1HB   LYS 158          2HB       LYS 158 127.093  -4.691   8.295
  597   2HB   LYS 158          1HB       LYS 158 128.510  -5.464   8.990
  598   1HG   LYS 158          2HG       LYS 158 127.365  -6.034  10.793
  599   2HG   LYS 158          1HG       LYS 158 126.927  -4.350  11.090
  600   1HD   LYS 158          2HD       LYS 158 125.469  -5.879   8.985
  601   2HD   LYS 158          1HD       LYS 158 125.078  -6.173  10.680
  602   1HE   LYS 158          2HE       LYS 158 124.003  -4.220  10.880
  603   2HE   LYS 158          1HE       LYS 158 125.265  -3.338  10.020
  604   1HZ   LYS 158          1HZ       LYS 158 124.308  -3.894   7.952
  605   2HZ   LYS 158          2HZ       LYS 158 123.025  -3.379   8.927
  606   3HZ   LYS 158          3HZ       LYS 158 123.259  -5.029   8.641
  607    H    GLY 159           H        GLY 159 130.012  -1.549  10.039
  608   1HA   GLY 159          2HA       GLY 159 130.804  -1.280  12.353
  609   2HA   GLY 159          1HA       GLY 159 130.924  -3.034  12.425
  610    H    VAL 160           H        VAL 160 132.764  -0.374  12.246
  611    HA   VAL 160           HA       VAL 160 134.882  -1.807  10.798
  612    HB   VAL 160           HB       VAL 160 134.863   1.160  10.592
  613   1HG1  VAL 160          1HG1      VAL 160 135.408  -0.629   8.302
  614   2HG1  VAL 160          2HG1      VAL 160 136.517  -0.731   9.670
  615   3HG1  VAL 160          3HG1      VAL 160 136.267   0.810   8.851
  616   1HG2  VAL 160          1HG2      VAL 160 133.064  -0.618   8.942
  617   2HG2  VAL 160          2HG2      VAL 160 133.464   1.054   8.546
  618   3HG2  VAL 160          3HG2      VAL 160 132.565   0.687  10.019
  619    H    GLU 161           H        GLU 161 134.849  -2.096  13.410
  620    HA   GLU 161           HA       GLU 161 136.636  -0.055  14.541
  621   1HB   GLU 161          2HB       GLU 161 136.067  -1.212  16.735
  622   2HB   GLU 161          1HB       GLU 161 134.768  -0.320  15.959
  623   1HG   GLU 161          2HG       GLU 161 133.665  -2.259  15.295
  624   2HG   GLU 161          1HG       GLU 161 135.099  -3.259  15.513
  Start of MODEL   13
    1   1H    MET  81          1HT       MET  81  88.072  -9.494   3.206
    2   2H    MET  81          2HT       MET  81  87.838 -11.078   2.587
    3   3H    MET  81          3HT       MET  81  89.006 -10.041   1.876
    4    HA   MET  81           HA       MET  81  89.060 -11.402   4.469
    5   1HB   MET  81          2HB       MET  81  89.938 -12.259   2.147
    6   2HB   MET  81          1HB       MET  81  91.270 -11.157   2.460
    7   1HG   MET  81          2HG       MET  81  90.971 -12.579   4.824
    8   2HG   MET  81          1HG       MET  81  90.739 -13.775   3.551
    9   1HE   MET  81          1HE       MET  81  94.108 -14.492   2.211
   10   2HE   MET  81          2HE       MET  81  92.441 -14.280   1.675
   11   3HE   MET  81          3HE       MET  81  92.790 -15.229   3.120
   12    H    VAL  82           H        VAL  82  90.625  -8.853   2.544
   13    HA   VAL  82           HA       VAL  82  92.103  -7.205   3.124
   14    HB   VAL  82           HB       VAL  82  91.268  -5.750   4.992
   15   1HG1  VAL  82          1HG1      VAL  82  88.917  -5.496   3.787
   16   2HG1  VAL  82          2HG1      VAL  82  89.687  -6.571   2.621
   17   3HG1  VAL  82          3HG1      VAL  82  90.426  -5.017   3.010
   18   1HG2  VAL  82          1HG2      VAL  82  89.154  -6.258   6.038
   19   2HG2  VAL  82          2HG2      VAL  82  90.285  -7.574   6.347
   20   3HG2  VAL  82          3HG2      VAL  82  89.025  -7.763   5.129
   21    H    ARG  83           H        ARG  83  93.563  -9.156   3.733
   22    HA   ARG  83           HA       ARG  83  94.734  -8.506   6.318
   23   1HB   ARG  83          2HB       ARG  83  93.229 -10.916   5.844
   24   2HB   ARG  83          1HB       ARG  83  94.909 -11.320   6.165
   25   1HG   ARG  83          2HG       ARG  83  94.857 -10.388   8.295
   26   2HG   ARG  83          1HG       ARG  83  93.416  -9.432   7.944
   27   1HD   ARG  83          2HD       ARG  83  92.465 -11.931   7.546
   28   2HD   ARG  83          1HD       ARG  83  93.671 -12.239   8.795
   29    HE   ARG  83           HE       ARG  83  92.241 -10.074   9.689
   30   1HH1  ARG  83          1HH1      ARG  83  91.495 -13.358   8.772
   31   2HH1  ARG  83          2HH1      ARG  83  90.146 -13.483   9.850
   32   1HH2  ARG  83          1HH2      ARG  83  90.468 -10.239  11.108
   33   2HH2  ARG  83          2HH2      ARG  83  89.562 -11.714  11.177
   34    H    CYS  84           H        CYS  84  95.446  -8.084   3.524
   35    HA   CYS  84           HA       CYS  84  98.179  -8.847   3.663
   36   1HB   CYS  84          2HB       CYS  84  96.328 -10.527   2.088
   37   2HB   CYS  84          1HB       CYS  84  97.795 -10.032   1.248
   38    HG   CYS  84           HG       CYS  84  97.654 -11.972   3.629
   39    H    MET  85           H        MET  85  98.372  -6.591   3.409
   40    HA   MET  85           HA       MET  85  97.725  -5.586   0.716
   41   1HB   MET  85          2HB       MET  85  97.859  -4.228   3.390
   42   2HB   MET  85          1HB       MET  85  98.061  -3.300   1.909
   43   1HG   MET  85          2HG       MET  85  95.887  -3.556   1.282
   44   2HG   MET  85          1HG       MET  85  95.714  -5.100   2.112
   45   1HE   MET  85          1HE       MET  85  96.803  -1.594   2.741
   46   2HE   MET  85          2HE       MET  85  96.088  -1.122   4.283
   47   3HE   MET  85          3HE       MET  85  95.134  -1.022   2.802
   48    H    LYS  86           H        LYS  86 100.078  -4.952   3.323
   49    HA   LYS  86           HA       LYS  86 102.318  -5.448   1.628
   50   1HB   LYS  86          2HB       LYS  86 101.224  -2.780   1.667
   51   2HB   LYS  86          1HB       LYS  86 102.844  -2.775   2.350
   52   1HG   LYS  86          2HG       LYS  86 103.716  -3.833   0.345
   53   2HG   LYS  86          1HG       LYS  86 102.090  -3.901  -0.339
   54   1HD   LYS  86          2HD       LYS  86 102.042  -1.369  -0.052
   55   2HD   LYS  86          1HD       LYS  86 103.779  -1.479   0.232
   56   1HE   LYS  86          2HE       LYS  86 102.836  -2.916  -2.145
   57   2HE   LYS  86          1HE       LYS  86 102.613  -1.170  -2.210
   58   1HZ   LYS  86          1HZ       LYS  86 105.103  -1.288  -1.324
   59   2HZ   LYS  86          2HZ       LYS  86 104.718  -1.259  -2.969
   60   3HZ   LYS  86          3HZ       LYS  86 105.068  -2.728  -2.211
   61    H    ASP  87           H        ASP  87 101.292  -6.216   4.235
   62    HA   ASP  87           HA       ASP  87 103.053  -4.984   6.175
   63   1HB   ASP  87          2HB       ASP  87 100.635  -6.479   6.272
   64   2HB   ASP  87          1HB       ASP  87 101.846  -7.375   7.184
   65    H    ASP  88           H        ASP  88 105.067  -5.523   5.160
   66    HA   ASP  88           HA       ASP  88 105.912  -8.271   5.773
   67   1HB   ASP  88          2HB       ASP  88 106.488  -6.694   3.264
   68   2HB   ASP  88          1HB       ASP  88 107.437  -8.097   3.745
   69    H    SER  89           H        SER  89 107.473  -8.241   7.240
   70    HA   SER  89           HA       SER  89 108.738  -5.979   8.217
   71   1HB   SER  89          2HB       SER  89 108.618  -8.180   9.382
   72   2HB   SER  89          1HB       SER  89 109.844  -8.796   8.275
   73    HG   SER  89           HG       SER  89 111.099  -8.085   9.840
   74    H    LYS  90           H        LYS  90 109.756  -4.635   6.826
   75    HA   LYS  90           HA       LYS  90 111.995  -5.757   5.271
   76   1HB   LYS  90          2HB       LYS  90 109.887  -3.811   4.559
   77   2HB   LYS  90          1HB       LYS  90 111.511  -3.403   4.021
   78   1HG   LYS  90          2HG       LYS  90 111.556  -5.040   2.482
   79   2HG   LYS  90          1HG       LYS  90 110.673  -6.174   3.506
   80   1HD   LYS  90          2HD       LYS  90 108.713  -5.649   2.564
   81   2HD   LYS  90          1HD       LYS  90 109.038  -3.918   2.666
   82   1HE   LYS  90          2HE       LYS  90 108.748  -4.873   0.339
   83   2HE   LYS  90          1HE       LYS  90 110.200  -3.911   0.616
   84   1HZ   LYS  90          1HZ       LYS  90 110.238  -6.851   0.889
   85   2HZ   LYS  90          2HZ       LYS  90 111.536  -5.798   0.637
   86   3HZ   LYS  90          3HZ       LYS  90 110.445  -6.110  -0.617
   87    H    GLY  91           H        GLY  91 113.580  -5.430   6.816
   88   1HA   GLY  91          2HA       GLY  91 113.912  -3.115   8.367
   89   2HA   GLY  91          1HA       GLY  91 115.180  -4.269   7.982
   90    H    LYS  92           H        LYS  92 115.651  -1.521   8.222
   91    HA   LYS  92           HA       LYS  92 116.189  -0.772   5.427
   92   1HB   LYS  92          2HB       LYS  92 115.157   0.769   7.706
   93   2HB   LYS  92          1HB       LYS  92 116.450   1.571   6.826
   94   1HG   LYS  92          2HG       LYS  92 115.090   1.049   4.722
   95   2HG   LYS  92          1HG       LYS  92 113.759   0.713   5.830
   96   1HD   LYS  92          2HD       LYS  92 113.665   2.917   6.580
   97   2HD   LYS  92          1HD       LYS  92 115.300   3.276   6.024
   98   1HE   LYS  92          2HE       LYS  92 114.405   4.150   4.187
   99   2HE   LYS  92          1HE       LYS  92 113.892   2.527   3.732
  100   1HZ   LYS  92          1HZ       LYS  92 111.942   3.167   5.393
  101   2HZ   LYS  92          2HZ       LYS  92 111.883   3.526   3.741
  102   3HZ   LYS  92          3HZ       LYS  92 112.338   4.721   4.851
  103    H    THR  93           H        THR  93 117.813  -2.447   7.126
  104    HA   THR  93           HA       THR  93 120.206  -0.752   7.399
  105    HB   THR  93           HB       THR  93 119.301  -1.776   9.501
  106    HG1  THR  93           HG1      THR  93 121.355  -2.404  10.209
  107   1HG2  THR  93          1HG2      THR  93 120.370  -4.363   8.420
  108   2HG2  THR  93          2HG2      THR  93 118.655  -3.973   8.544
  109   3HG2  THR  93          3HG2      THR  93 119.646  -4.072  10.001
  110    H    GLU  94           H        GLU  94 119.189  -4.074   6.640
  111    HA   GLU  94           HA       GLU  94 121.700  -4.626   5.308
  112   1HB   GLU  94          2HB       GLU  94 119.240  -6.245   5.907
  113   2HB   GLU  94          1HB       GLU  94 120.474  -6.847   4.808
  114   1HG   GLU  94          2HG       GLU  94 122.026  -7.112   6.469
  115   2HG   GLU  94          1HG       GLU  94 121.299  -5.874   7.494
  116    H    GLU  95           H        GLU  95 118.404  -3.867   4.431
  117    HA   GLU  95           HA       GLU  95 118.919  -4.408   1.612
  118   1HB   GLU  95          2HB       GLU  95 116.517  -3.878   3.269
  119   2HB   GLU  95          1HB       GLU  95 116.457  -3.305   1.608
  120   1HG   GLU  95          2HG       GLU  95 117.405  -6.068   1.983
  121   2HG   GLU  95          1HG       GLU  95 115.713  -5.766   2.376
  122    H    GLU  96           H        GLU  96 118.924  -1.785   3.831
  123    HA   GLU  96           HA       GLU  96 118.586   0.291   1.871
  124   1HB   GLU  96          2HB       GLU  96 119.223   0.176   4.788
  125   2HB   GLU  96          1HB       GLU  96 119.549   1.661   3.907
  126   1HG   GLU  96          2HG       GLU  96 116.873   0.297   3.917
  127   2HG   GLU  96          1HG       GLU  96 117.335   1.552   5.066
  128    H    LEU  97           H        LEU  97 121.223  -1.525   3.200
  129    HA   LEU  97           HA       LEU  97 123.375   0.168   2.786
  130   1HB   LEU  97          2HB       LEU  97 123.030  -2.795   2.774
  131   2HB   LEU  97          1HB       LEU  97 124.556  -2.129   2.225
  132    HG   LEU  97           HG       LEU  97 123.475  -1.228   4.856
  133   1HD1  LEU  97          1HD1      LEU  97 125.217  -3.610   4.883
  134   2HD1  LEU  97          2HD1      LEU  97 123.531  -3.873   4.445
  135   3HD1  LEU  97          3HD1      LEU  97 123.934  -3.126   5.990
  136   1HD2  LEU  97          1HD2      LEU  97 126.118  -1.461   3.498
  137   2HD2  LEU  97          2HD2      LEU  97 126.051  -1.483   5.259
  138   3HD2  LEU  97          3HD2      LEU  97 125.415  -0.098   4.372
  139    H    SER  98           H        SER  98 121.386  -1.450   0.465
  140    HA   SER  98           HA       SER  98 123.197  -1.454  -1.712
  141   1HB   SER  98          2HB       SER  98 120.266  -1.813  -1.360
  142   2HB   SER  98          1HB       SER  98 120.829  -1.374  -2.973
  143    HG   SER  98           HG       SER  98 122.376  -3.184  -2.648
  144    H    ASP  99           H        ASP  99 120.777   0.861  -0.576
  145    HA   ASP  99           HA       ASP  99 120.907   2.661  -2.715
  146   1HB   ASP  99          2HB       ASP  99 119.404   2.528  -0.490
  147   2HB   ASP  99          1HB       ASP  99 120.539   3.778   0.011
  148    H    LEU 100           H        LEU 100 122.857   2.387   0.211
  149    HA   LEU 100           HA       LEU 100 124.372   4.762  -0.299
  150   1HB   LEU 100          2HB       LEU 100 124.741   2.444   1.587
  151   2HB   LEU 100          1HB       LEU 100 125.892   3.762   1.485
  152    HG   LEU 100           HG       LEU 100 123.177   4.735   1.847
  153   1HD1  LEU 100          1HD1      LEU 100 124.241   2.668   3.724
  154   2HD1  LEU 100          2HD1      LEU 100 122.600   2.898   3.120
  155   3HD1  LEU 100          3HD1      LEU 100 123.255   3.998   4.333
  156   1HD2  LEU 100          1HD2      LEU 100 125.551   5.036   3.665
  157   2HD2  LEU 100          2HD2      LEU 100 124.196   6.141   3.438
  158   3HD2  LEU 100          3HD2      LEU 100 125.390   5.935   2.156
  159    H    PHE 101           H        PHE 101 124.679   1.373  -1.083
  160    HA   PHE 101           HA       PHE 101 127.386   1.248  -1.732
  161   1HB   PHE 101          2HB       PHE 101 125.877  -0.715  -1.588
  162   2HB   PHE 101          1HB       PHE 101 125.116  -0.215  -3.095
  163    HD1  PHE 101           HD1      PHE 101 125.643  -1.891  -4.606
  164    HD2  PHE 101           HD2      PHE 101 128.717  -0.240  -2.171
  165    HE1  PHE 101           HE1      PHE 101 127.326  -3.160  -5.876
  166    HE2  PHE 101           HE2      PHE 101 130.405  -1.505  -3.435
  167    HZ   PHE 101           HZ       PHE 101 129.710  -2.967  -5.291
  168    H    ARG 102           H        ARG 102 124.615   1.996  -3.849
  169    HA   ARG 102           HA       ARG 102 126.041   2.398  -6.205
  170   1HB   ARG 102          2HB       ARG 102 123.503   3.741  -5.262
  171   2HB   ARG 102          1HB       ARG 102 124.105   3.789  -6.912
  172   1HG   ARG 102          2HG       ARG 102 123.559   1.605  -7.324
  173   2HG   ARG 102          1HG       ARG 102 123.683   1.141  -5.626
  174   1HD   ARG 102          2HD       ARG 102 121.440   1.181  -5.672
  175   2HD   ARG 102          1HD       ARG 102 121.634   2.930  -5.551
  176    HE   ARG 102           HE       ARG 102 121.680   1.996  -8.256
  177   1HH1  ARG 102          1HH1      ARG 102 119.589   2.891  -5.610
  178   2HH1  ARG 102          2HH1      ARG 102 118.259   3.306  -6.637
  179   1HH2  ARG 102          1HH2      ARG 102 119.931   2.539  -9.609
  180   2HH2  ARG 102          2HH2      ARG 102 118.452   3.106  -8.908
  181    H    MET 103           H        MET 103 125.281   4.657  -3.592
  182    HA   MET 103           HA       MET 103 126.173   7.020  -4.743
  183   1HB   MET 103          2HB       MET 103 126.310   6.121  -1.861
  184   2HB   MET 103          1HB       MET 103 126.607   7.770  -2.394
  185   1HG   MET 103          2HG       MET 103 124.159   7.101  -3.521
  186   2HG   MET 103          1HG       MET 103 124.112   6.405  -1.902
  187   1HE   MET 103          1HE       MET 103 122.043   9.238  -1.006
  188   2HE   MET 103          2HE       MET 103 123.015   8.347   0.164
  189   3HE   MET 103          3HE       MET 103 122.313   7.508  -1.220
  190    H    PHE 104           H        PHE 104 127.979   4.322  -3.510
  191    HA   PHE 104           HA       PHE 104 130.485   5.765  -3.424
  192   1HB   PHE 104          2HB       PHE 104 129.495   3.180  -2.530
  193   2HB   PHE 104          1HB       PHE 104 131.062   3.040  -3.322
  194    HD1  PHE 104           HD1      PHE 104 129.304   5.066  -0.738
  195    HD2  PHE 104           HD2      PHE 104 132.977   3.399  -2.094
  196    HE1  PHE 104           HE1      PHE 104 130.407   5.830   1.323
  197    HE2  PHE 104           HE2      PHE 104 134.088   4.161  -0.034
  198    HZ   PHE 104           HZ       PHE 104 132.802   5.378   1.678
  199    H    ASP 105           H        ASP 105 128.686   3.868  -5.691
  200    HA   ASP 105           HA       ASP 105 130.998   3.473  -7.422
  201   1HB   ASP 105          2HB       ASP 105 128.837   1.899  -6.961
  202   2HB   ASP 105          1HB       ASP 105 128.302   2.755  -8.406
  203    H    LYS 106           H        LYS 106 131.134   4.315  -9.532
  204    HA   LYS 106           HA       LYS 106 129.441   6.683  -9.994
  205   1HB   LYS 106          2HB       LYS 106 132.324   6.218 -10.772
  206   2HB   LYS 106          1HB       LYS 106 131.375   7.623 -11.237
  207   1HG   LYS 106          2HG       LYS 106 131.681   6.918  -8.353
  208   2HG   LYS 106          1HG       LYS 106 132.977   7.762  -9.206
  209   1HD   LYS 106          2HD       LYS 106 131.878   9.696  -9.083
  210   2HD   LYS 106          1HD       LYS 106 130.429   8.976  -9.787
  211   1HE   LYS 106          2HE       LYS 106 130.982   8.289  -6.971
  212   2HE   LYS 106          1HE       LYS 106 130.550   9.969  -7.284
  213   1HZ   LYS 106          1HZ       LYS 106 128.587   9.074  -8.531
  214   2HZ   LYS 106          2HZ       LYS 106 128.555   8.816  -6.859
  215   3HZ   LYS 106          3HZ       LYS 106 128.959   7.548  -7.902
  216    H    ASN 107           H        ASN 107 131.248   4.084 -11.606
  217    HA   ASN 107           HA       ASN 107 130.036   4.636 -14.157
  218   1HB   ASN 107          2HB       ASN 107 131.224   2.527 -14.846
  219   2HB   ASN 107          1HB       ASN 107 132.268   3.786 -14.191
  220   1HD2  ASN 107          1HD2      ASN 107 132.363   0.755 -14.344
  221   2HD2  ASN 107          2HD2      ASN 107 132.772   0.273 -12.735
  222    H    ALA 108           H        ALA 108 128.778   3.275 -11.450
  223    HA   ALA 108           HA       ALA 108 127.132   1.761 -10.985
  224   1HB   ALA 108          1HB       ALA 108 125.275   1.824 -12.779
  225   2HB   ALA 108          2HB       ALA 108 126.282   3.052 -13.546
  226   3HB   ALA 108          3HB       ALA 108 125.674   3.306 -11.911
  227    H    ASP 109           H        ASP 109 128.825   0.042 -11.292
  228    HA   ASP 109           HA       ASP 109 128.012  -1.771 -13.468
  229   1HB   ASP 109          2HB       ASP 109 130.304  -2.649 -13.512
  230   2HB   ASP 109          1HB       ASP 109 130.281  -0.922 -13.858
  231    H    GLY 110           H        GLY 110 128.867  -1.398 -10.103
  232   1HA   GLY 110          2HA       GLY 110 127.559  -2.903  -8.606
  233   2HA   GLY 110          1HA       GLY 110 128.089  -4.214  -9.648
  234    H    TYR 111           H        TYR 111 130.667  -2.235  -9.545
  235    HA   TYR 111           HA       TYR 111 131.715  -3.257  -7.006
  236   1HB   TYR 111          2HB       TYR 111 133.021  -3.593  -9.712
  237   2HB   TYR 111          1HB       TYR 111 133.855  -3.846  -8.183
  238    HD1  TYR 111           HD1      TYR 111 133.816  -5.944  -7.176
  239    HD2  TYR 111           HD2      TYR 111 130.890  -5.007 -10.120
  240    HE1  TYR 111           HE1      TYR 111 133.026  -8.273  -7.124
  241    HE2  TYR 111           HE2      TYR 111 130.093  -7.333 -10.078
  242    HH   TYR 111           HH       TYR 111 130.936  -9.521  -7.661
  243    H    ILE 112           H        ILE 112 133.361  -1.998  -6.089
  244    HA   ILE 112           HA       ILE 112 133.642   0.669  -7.302
  245    HB   ILE 112           HB       ILE 112 134.077  -0.060  -4.406
  246   1HG1  ILE 112          2HG1      ILE 112 131.687   1.426  -5.465
  247   2HG1  ILE 112          1HG1      ILE 112 131.689  -0.333  -5.387
  248   1HG2  ILE 112          1HG2      ILE 112 134.981   2.111  -5.740
  249   2HG2  ILE 112          2HG2      ILE 112 134.578   2.100  -4.025
  250   3HG2  ILE 112          3HG2      ILE 112 133.405   2.689  -5.200
  251   1HD1  ILE 112          1HD1      ILE 112 132.215   1.444  -3.022
  252   2HD1  ILE 112          2HD1      ILE 112 131.934  -0.298  -3.021
  253   3HD1  ILE 112          3HD1      ILE 112 130.627   0.807  -3.447
  254    H    ASP 113           H        ASP 113 135.604   1.497  -7.740
  255    HA   ASP 113           HA       ASP 113 137.933  -0.207  -7.166
  256   1HB   ASP 113          2HB       ASP 113 139.006   0.982  -9.087
  257   2HB   ASP 113          1HB       ASP 113 137.578   0.056  -9.538
  258    H    LEU 114           H        LEU 114 140.046   1.236  -7.249
  259    HA   LEU 114           HA       LEU 114 140.003   2.830  -4.930
  260   1HB   LEU 114          2HB       LEU 114 141.991   2.076  -6.976
  261   2HB   LEU 114          1HB       LEU 114 142.320   3.575  -6.127
  262    HG   LEU 114           HG       LEU 114 141.697   1.841  -4.074
  263   1HD1  LEU 114          1HD1      LEU 114 143.376   0.354  -6.087
  264   2HD1  LEU 114          2HD1      LEU 114 141.720  -0.051  -5.638
  265   3HD1  LEU 114          3HD1      LEU 114 143.011  -0.163  -4.442
  266   1HD2  LEU 114          1HD2      LEU 114 143.691   3.530  -4.677
  267   2HD2  LEU 114          2HD2      LEU 114 144.534   1.992  -4.878
  268   3HD2  LEU 114          3HD2      LEU 114 143.765   2.382  -3.339
  269    H    GLU 115           H        GLU 115 139.604   3.604  -8.303
  270    HA   GLU 115           HA       GLU 115 140.163   6.366  -8.162
  271   1HB   GLU 115          2HB       GLU 115 138.813   4.550 -10.076
  272   2HB   GLU 115          1HB       GLU 115 138.403   6.256 -10.197
  273   1HG   GLU 115          2HG       GLU 115 140.886   6.710 -10.297
  274   2HG   GLU 115          1HG       GLU 115 141.097   4.971 -10.503
  275    H    GLU 116           H        GLU 116 137.016   4.688  -8.245
  276    HA   GLU 116           HA       GLU 116 135.389   6.889  -7.825
  277   1HB   GLU 116          2HB       GLU 116 135.118   3.966  -7.314
  278   2HB   GLU 116          1HB       GLU 116 133.919   5.037  -6.604
  279   1HG   GLU 116          2HG       GLU 116 132.839   4.833  -8.535
  280   2HG   GLU 116          1HG       GLU 116 134.049   5.940  -9.181
  281    H    LEU 117           H        LEU 117 137.043   4.859  -5.461
  282    HA   LEU 117           HA       LEU 117 135.884   5.794  -3.123
  283   1HB   LEU 117          2HB       LEU 117 138.734   4.943  -3.617
  284   2HB   LEU 117          1HB       LEU 117 138.036   5.181  -2.026
  285    HG   LEU 117           HG       LEU 117 136.885   3.222  -3.994
  286   1HD1  LEU 117          1HD1      LEU 117 138.673   1.933  -3.737
  287   2HD1  LEU 117          2HD1      LEU 117 138.257   1.801  -2.029
  288   3HD1  LEU 117          3HD1      LEU 117 139.382   3.047  -2.569
  289   1HD2  LEU 117          1HD2      LEU 117 135.290   3.369  -2.401
  290   2HD2  LEU 117          2HD2      LEU 117 136.411   3.980  -1.182
  291   3HD2  LEU 117          3HD2      LEU 117 136.360   2.256  -1.548
  292    H    LYS 118           H        LYS 118 138.227   7.322  -5.199
  293    HA   LYS 118           HA       LYS 118 138.806   9.406  -3.258
  294   1HB   LYS 118          2HB       LYS 118 140.509   8.391  -4.870
  295   2HB   LYS 118          1HB       LYS 118 139.714   9.329  -6.129
  296   1HG   LYS 118          2HG       LYS 118 140.239  11.389  -4.973
  297   2HG   LYS 118          1HG       LYS 118 140.956  10.482  -3.640
  298   1HD   LYS 118          2HD       LYS 118 142.882  10.808  -4.752
  299   2HD   LYS 118          1HD       LYS 118 142.321   9.472  -5.759
  300   1HE   LYS 118          2HE       LYS 118 141.448  12.239  -6.430
  301   2HE   LYS 118          1HE       LYS 118 143.098  11.758  -6.819
  302   1HZ   LYS 118          1HZ       LYS 118 140.781  10.110  -7.631
  303   2HZ   LYS 118          2HZ       LYS 118 142.352  10.102  -8.258
  304   3HZ   LYS 118          3HZ       LYS 118 141.320  11.403  -8.582
  305    H    ILE 119           H        ILE 119 136.363   8.824  -5.451
  306    HA   ILE 119           HA       ILE 119 136.030  11.599  -6.265
  307    HB   ILE 119           HB       ILE 119 134.216   9.255  -6.843
  308   1HG1  ILE 119          2HG1      ILE 119 136.500  10.408  -8.460
  309   2HG1  ILE 119          1HG1      ILE 119 136.433   8.804  -7.738
  310   1HG2  ILE 119          1HG2      ILE 119 134.414  12.043  -7.956
  311   2HG2  ILE 119          2HG2      ILE 119 133.032  11.276  -7.174
  312   3HG2  ILE 119          3HG2      ILE 119 133.548  10.742  -8.774
  313   1HD1  ILE 119          1HD1      ILE 119 134.191   9.305  -9.504
  314   2HD1  ILE 119          2HD1      ILE 119 135.342   7.970  -9.480
  315   3HD1  ILE 119          3HD1      ILE 119 135.747   9.467 -10.316
  316    H    MET 120           H        MET 120 133.766   9.201  -4.880
  317    HA   MET 120           HA       MET 120 131.950  11.085  -3.920
  318   1HB   MET 120          2HB       MET 120 130.817   9.326  -2.949
  319   2HB   MET 120          1HB       MET 120 131.761   8.490  -4.171
  320   1HG   MET 120          2HG       MET 120 132.400   8.682  -1.237
  321   2HG   MET 120          1HG       MET 120 131.794   7.267  -2.094
  322   1HE   MET 120          1HE       MET 120 134.818   8.222  -0.347
  323   2HE   MET 120          2HE       MET 120 135.668   6.805  -0.965
  324   3HE   MET 120          3HE       MET 120 134.010   6.655  -0.382
  325    H    LEU 121           H        LEU 121 135.009  10.136  -2.673
  326    HA   LEU 121           HA       LEU 121 134.585  10.823   0.050
  327   1HB   LEU 121          2HB       LEU 121 136.423   9.394  -0.538
  328   2HB   LEU 121          1HB       LEU 121 137.088  10.603  -1.618
  329    HG   LEU 121           HG       LEU 121 136.812  11.407   1.216
  330   1HD1  LEU 121          1HD1      LEU 121 138.290   9.992   2.138
  331   2HD1  LEU 121          2HD1      LEU 121 139.262   9.883   0.670
  332   3HD1  LEU 121          3HD1      LEU 121 137.797   8.914   0.832
  333   1HD2  LEU 121          1HD2      LEU 121 138.519  12.818   0.716
  334   2HD2  LEU 121          2HD2      LEU 121 137.899  12.573  -0.917
  335   3HD2  LEU 121          3HD2      LEU 121 139.305  11.664  -0.362
  336    H    GLN 122           H        GLN 122 135.414  12.614  -2.823
  337    HA   GLN 122           HA       GLN 122 136.349  14.962  -1.528
  338   1HB   GLN 122          2HB       GLN 122 135.301  14.421  -4.301
  339   2HB   GLN 122          1HB       GLN 122 135.809  16.025  -3.789
  340   1HG   GLN 122          2HG       GLN 122 137.945  14.499  -3.053
  341   2HG   GLN 122          1HG       GLN 122 137.400  13.687  -4.522
  342   1HE2  GLN 122          1HE2      GLN 122 138.436  14.361  -6.245
  343   2HE2  GLN 122          2HE2      GLN 122 138.984  15.971  -6.550
  344    H    ALA 123           H        ALA 123 133.197  13.727  -2.325
  345    HA   ALA 123           HA       ALA 123 131.812  16.216  -2.047
  346   1HB   ALA 123          1HB       ALA 123 130.935  14.379  -3.414
  347   2HB   ALA 123          2HB       ALA 123 129.788  14.885  -2.173
  348   3HB   ALA 123          3HB       ALA 123 130.724  13.406  -1.957
  349    H    THR 124           H        THR 124 133.239  14.160   0.197
  350    HA   THR 124           HA       THR 124 131.358  14.222   2.298
  351    HB   THR 124           HB       THR 124 133.212  13.582   3.741
  352    HG1  THR 124           HG1      THR 124 135.314  13.651   3.014
  353   1HG2  THR 124          1HG2      THR 124 132.823  11.595   2.810
  354   2HG2  THR 124          2HG2      THR 124 134.331  11.884   1.943
  355   3HG2  THR 124          3HG2      THR 124 132.787  12.256   1.176
  356    H    GLY 125           H        GLY 125 132.413  15.250   4.513
  357   1HA   GLY 125          2HA       GLY 125 132.433  18.135   3.940
  358   2HA   GLY 125          1HA       GLY 125 131.935  17.403   5.456
  359    H    GLU 126           H        GLU 126 134.444  15.611   5.093
  360    HA   GLU 126           HA       GLU 126 136.283  17.548   6.316
  361   1HB   GLU 126          2HB       GLU 126 137.428  15.404   7.149
  362   2HB   GLU 126          1HB       GLU 126 135.889  15.845   7.876
  363   1HG   GLU 126          2HG       GLU 126 134.730  14.195   6.640
  364   2HG   GLU 126          1HG       GLU 126 136.124  13.898   5.603
  365    H    THR 127           H        THR 127 138.686  16.477   6.091
  366    HA   THR 127           HA       THR 127 139.108  16.267   3.185
  367    HB   THR 127           HB       THR 127 141.559  16.911   4.139
  368    HG1  THR 127           HG1      THR 127 139.738  18.300   5.806
  369   1HG2  THR 127          1HG2      THR 127 140.331  18.114   2.371
  370   2HG2  THR 127          2HG2      THR 127 141.170  19.185   3.493
  371   3HG2  THR 127          3HG2      THR 127 139.425  18.965   3.621
  372    H    ILE 128           H        ILE 128 139.989  14.472   2.382
  373    HA   ILE 128           HA       ILE 128 141.458  12.681   4.192
  374    HB   ILE 128           HB       ILE 128 139.376  11.784   2.193
  375   1HG1  ILE 128          2HG1      ILE 128 138.529  10.826   4.566
  376   2HG1  ILE 128          1HG1      ILE 128 139.321  12.299   5.114
  377   1HG2  ILE 128          1HG2      ILE 128 141.394  10.334   3.836
  378   2HG2  ILE 128          2HG2      ILE 128 140.861  10.037   2.182
  379   3HG2  ILE 128          3HG2      ILE 128 139.831   9.576   3.537
  380   1HD1  ILE 128          1HD1      ILE 128 137.361  12.388   2.864
  381   2HD1  ILE 128          2HD1      ILE 128 137.845  13.665   3.980
  382   3HD1  ILE 128          3HD1      ILE 128 136.811  12.350   4.538
  383    H    THR 129           H        THR 129 143.309  11.911   3.385
  384    HA   THR 129           HA       THR 129 144.120  12.748   0.736
  385    HB   THR 129           HB       THR 129 145.648  12.950   2.669
  386    HG1  THR 129           HG1      THR 129 146.717  11.059   0.867
  387   1HG2  THR 129          1HG2      THR 129 146.245  11.293   4.024
  388   2HG2  THR 129          2HG2      THR 129 146.461  10.161   2.692
  389   3HG2  THR 129          3HG2      THR 129 144.855  10.427   3.369
  390    H    GLU 130           H        GLU 130 145.416  11.115  -0.599
  391    HA   GLU 130           HA       GLU 130 143.690   9.043  -1.406
  392   1HB   GLU 130          2HB       GLU 130 145.348  10.184  -2.874
  393   2HB   GLU 130          1HB       GLU 130 146.635   9.334  -2.027
  394   1HG   GLU 130          2HG       GLU 130 145.209   7.222  -2.713
  395   2HG   GLU 130          1HG       GLU 130 144.646   8.314  -3.977
  396    H    ASP 131           H        ASP 131 146.192   9.158   0.973
  397    HA   ASP 131           HA       ASP 131 146.912   6.443   1.063
  398   1HB   ASP 131          2HB       ASP 131 147.786   8.657   2.335
  399   2HB   ASP 131          1HB       ASP 131 146.831   7.933   3.624
  400    H    ASP 132           H        ASP 132 144.600   8.236   3.101
  401    HA   ASP 132           HA       ASP 132 143.628   6.089   4.563
  402   1HB   ASP 132          2HB       ASP 132 142.662   8.800   3.890
  403   2HB   ASP 132          1HB       ASP 132 141.418   7.659   4.392
  404    H    ILE 133           H        ILE 133 142.783   7.169   1.336
  405    HA   ILE 133           HA       ILE 133 140.430   5.650   1.014
  406    HB   ILE 133           HB       ILE 133 142.375   6.452  -1.153
  407   1HG1  ILE 133          2HG1      ILE 133 140.040   7.972   0.030
  408   2HG1  ILE 133          1HG1      ILE 133 141.741   8.397   0.189
  409   1HG2  ILE 133          1HG2      ILE 133 140.129   4.859  -1.308
  410   2HG2  ILE 133          2HG2      ILE 133 140.889   5.720  -2.646
  411   3HG2  ILE 133          3HG2      ILE 133 139.536   6.452  -1.782
  412   1HD1  ILE 133          1HD1      ILE 133 141.778   9.416  -1.789
  413   2HD1  ILE 133          2HD1      ILE 133 140.019   9.380  -1.683
  414   3HD1  ILE 133          3HD1      ILE 133 140.874   8.122  -2.576
  415    H    GLU 134           H        GLU 134 143.833   4.913   0.397
  416    HA   GLU 134           HA       GLU 134 143.472   2.463  -0.913
  417   1HB   GLU 134          2HB       GLU 134 145.642   4.004  -0.008
  418   2HB   GLU 134          1HB       GLU 134 145.830   2.431   0.752
  419   1HG   GLU 134          2HG       GLU 134 145.146   1.979  -1.949
  420   2HG   GLU 134          1HG       GLU 134 146.403   3.215  -1.922
  421    H    GLU 135           H        GLU 135 143.921   3.187   2.535
  422    HA   GLU 135           HA       GLU 135 143.927   0.555   3.475
  423   1HB   GLU 135          2HB       GLU 135 143.480   3.232   4.641
  424   2HB   GLU 135          1HB       GLU 135 142.796   1.890   5.547
  425   1HG   GLU 135          2HG       GLU 135 145.352   1.040   4.911
  426   2HG   GLU 135          1HG       GLU 135 145.544   2.751   5.294
  427    H    LEU 136           H        LEU 136 141.305   2.654   2.531
  428    HA   LEU 136           HA       LEU 136 139.166   1.351   3.771
  429   1HB   LEU 136          2HB       LEU 136 139.457   3.504   2.094
  430   2HB   LEU 136          1HB       LEU 136 138.599   2.360   1.079
  431    HG   LEU 136           HG       LEU 136 137.594   2.941   3.839
  432   1HD1  LEU 136          1HD1      LEU 136 136.189   4.727   2.888
  433   2HD1  LEU 136          2HD1      LEU 136 137.103   4.619   1.384
  434   3HD1  LEU 136          3HD1      LEU 136 137.906   5.131   2.868
  435   1HD2  LEU 136          1HD2      LEU 136 136.693   1.084   2.404
  436   2HD2  LEU 136          2HD2      LEU 136 136.116   2.323   1.291
  437   3HD2  LEU 136          3HD2      LEU 136 135.501   2.266   2.943
  438    H    MET 137           H        MET 137 140.945   0.588   0.855
  439    HA   MET 137           HA       MET 137 139.087  -1.400  -0.055
  440   1HB   MET 137          2HB       MET 137 141.836  -0.534  -0.881
  441   2HB   MET 137          1HB       MET 137 141.159  -2.031  -1.512
  442   1HG   MET 137          2HG       MET 137 139.304   0.188  -1.710
  443   2HG   MET 137          1HG       MET 137 140.820   0.499  -2.554
  444   1HE   MET 137          1HE       MET 137 137.934   0.146  -4.411
  445   2HE   MET 137          2HE       MET 137 137.533  -0.415  -2.788
  446   3HE   MET 137          3HE       MET 137 137.323  -1.491  -4.170
  447    H    LYS 138           H        LYS 138 142.198  -1.431   1.636
  448    HA   LYS 138           HA       LYS 138 142.531  -4.222   1.705
  449   1HB   LYS 138          2HB       LYS 138 143.770  -1.888   2.923
  450   2HB   LYS 138          1HB       LYS 138 143.730  -3.258   4.026
  451   1HG   LYS 138          2HG       LYS 138 144.813  -4.641   2.290
  452   2HG   LYS 138          1HG       LYS 138 144.928  -3.209   1.265
  453   1HD   LYS 138          2HD       LYS 138 146.049  -2.248   3.509
  454   2HD   LYS 138          1HD       LYS 138 146.473  -3.954   3.672
  455   1HE   LYS 138          2HE       LYS 138 147.645  -3.958   1.622
  456   2HE   LYS 138          1HE       LYS 138 146.964  -2.404   1.144
  457   1HZ   LYS 138          1HZ       LYS 138 148.276  -1.288   2.737
  458   2HZ   LYS 138          2HZ       LYS 138 149.322  -2.359   1.950
  459   3HZ   LYS 138          3HZ       LYS 138 148.741  -2.728   3.494
  460    H    ASP 139           H        ASP 139 140.533  -2.091   3.575
  461    HA   ASP 139           HA       ASP 139 139.986  -4.201   5.531
  462   1HB   ASP 139          2HB       ASP 139 140.404  -1.575   5.954
  463   2HB   ASP 139          1HB       ASP 139 138.651  -1.567   5.779
  464    H    GLY 140           H        GLY 140 138.810  -3.353   2.578
  465   1HA   GLY 140          2HA       GLY 140 136.076  -4.170   3.334
  466   2HA   GLY 140          1HA       GLY 140 136.397  -2.998   2.066
  467    H    ASP 141           H        ASP 141 138.742  -4.585   1.115
  468    HA   ASP 141           HA       ASP 141 137.222  -6.390  -0.575
  469   1HB   ASP 141          2HB       ASP 141 139.672  -4.875  -0.823
  470   2HB   ASP 141          1HB       ASP 141 139.939  -6.557  -1.269
  471    H    LYS 142           H        LYS 142 136.745  -8.201   0.548
  472    HA   LYS 142           HA       LYS 142 138.765  -9.561   2.112
  473   1HB   LYS 142          2HB       LYS 142 135.851 -10.025   1.565
  474   2HB   LYS 142          1HB       LYS 142 136.831 -11.281   2.308
  475   1HG   LYS 142          2HG       LYS 142 135.616  -9.925   3.954
  476   2HG   LYS 142          1HG       LYS 142 137.366  -9.830   4.157
  477   1HD   LYS 142          2HD       LYS 142 136.148  -7.781   2.417
  478   2HD   LYS 142          1HD       LYS 142 135.745  -7.681   4.131
  479   1HE   LYS 142          2HE       LYS 142 138.547  -7.831   3.027
  480   2HE   LYS 142          1HE       LYS 142 137.735  -6.341   3.506
  481   1HZ   LYS 142          1HZ       LYS 142 139.275  -7.803   5.130
  482   2HZ   LYS 142          2HZ       LYS 142 137.752  -8.431   5.512
  483   3HZ   LYS 142          3HZ       LYS 142 138.046  -6.774   5.671
  484    H    ASN 143           H        ASN 143 137.238  -9.847  -1.017
  485    HA   ASN 143           HA       ASN 143 138.352 -12.467  -1.528
  486   1HB   ASN 143          2HB       ASN 143 137.408 -12.079  -3.838
  487   2HB   ASN 143          1HB       ASN 143 136.228 -12.034  -2.533
  488   1HD2  ASN 143          1HD2      ASN 143 135.296 -10.945  -4.647
  489   2HD2  ASN 143          2HD2      ASN 143 135.366  -9.219  -4.627
  490    H    ASN 144           H        ASN 144 139.538  -9.349  -1.563
  491    HA   ASN 144           HA       ASN 144 141.413  -8.371  -2.371
  492   1HB   ASN 144          2HB       ASN 144 142.064 -11.272  -2.381
  493   2HB   ASN 144          1HB       ASN 144 143.160 -10.195  -3.242
  494   1HD2  ASN 144          1HD2      ASN 144 143.678 -11.750  -0.875
  495   2HD2  ASN 144          2HD2      ASN 144 144.118 -10.633   0.367
  496    H    ASP 145           H        ASP 145 139.149  -8.993  -4.228
  497    HA   ASP 145           HA       ASP 145 140.360  -9.546  -6.771
  498   1HB   ASP 145          2HB       ASP 145 138.136  -9.102  -7.692
  499   2HB   ASP 145          1HB       ASP 145 138.035 -10.184  -6.306
  500    H    GLY 146           H        GLY 146 140.456  -6.860  -4.841
  501   1HA   GLY 146          2HA       GLY 146 141.487  -4.837  -5.394
  502   2HA   GLY 146          1HA       GLY 146 141.230  -5.196  -7.095
  503    H    ARG 147           H        ARG 147 138.306  -5.805  -5.942
  504    HA   ARG 147           HA       ARG 147 137.434  -3.001  -5.868
  505   1HB   ARG 147          2HB       ARG 147 136.071  -5.153  -7.494
  506   2HB   ARG 147          1HB       ARG 147 135.609  -3.459  -7.392
  507   1HG   ARG 147          2HG       ARG 147 138.365  -3.840  -8.250
  508   2HG   ARG 147          1HG       ARG 147 137.184  -4.581  -9.332
  509   1HD   ARG 147          2HD       ARG 147 135.985  -2.450  -9.473
  510   2HD   ARG 147          1HD       ARG 147 137.171  -1.713  -8.396
  511    HE   ARG 147           HE       ARG 147 138.623  -1.546 -10.159
  512   1HH1  ARG 147          1HH1      ARG 147 136.030  -3.714 -11.028
  513   2HH1  ARG 147          2HH1      ARG 147 136.510  -3.824 -12.687
  514   1HH2  ARG 147          1HH2      ARG 147 139.256  -1.688 -12.342
  515   2HH2  ARG 147          2HH2      ARG 147 138.343  -2.675 -13.434
  516    H    ILE 148           H        ILE 148 135.349  -2.665  -4.897
  517    HA   ILE 148           HA       ILE 148 134.673  -4.790  -2.976
  518    HB   ILE 148           HB       ILE 148 134.120  -1.827  -2.757
  519   1HG1  ILE 148          2HG1      ILE 148 136.084  -3.452  -1.141
  520   2HG1  ILE 148          1HG1      ILE 148 136.550  -2.585  -2.602
  521   1HG2  ILE 148          1HG2      ILE 148 132.463  -3.168  -1.592
  522   2HG2  ILE 148          2HG2      ILE 148 133.508  -2.340  -0.437
  523   3HG2  ILE 148          3HG2      ILE 148 133.740  -4.058  -0.764
  524   1HD1  ILE 148          1HD1      ILE 148 135.524  -1.438  -0.025
  525   2HD1  ILE 148          2HD1      ILE 148 135.678  -0.499  -1.510
  526   3HD1  ILE 148          3HD1      ILE 148 137.109  -1.212  -0.765
  527    H    ASP 149           H        ASP 149 132.808  -5.789  -3.188
  528    HA   ASP 149           HA       ASP 149 130.749  -4.603  -4.915
  529   1HB   ASP 149          2HB       ASP 149 131.758  -6.943  -5.350
  530   2HB   ASP 149          1HB       ASP 149 130.774  -7.466  -3.987
  531    H    TYR 150           H        TYR 150 128.456  -5.221  -4.296
  532    HA   TYR 150           HA       TYR 150 127.794  -4.066  -1.845
  533   1HB   TYR 150          2HB       TYR 150 126.218  -4.177  -3.709
  534   2HB   TYR 150          1HB       TYR 150 126.149  -5.930  -3.570
  535    HD1  TYR 150           HD1      TYR 150 124.090  -6.606  -2.781
  536    HD2  TYR 150           HD2      TYR 150 125.876  -3.130  -1.098
  537    HE1  TYR 150           HE1      TYR 150 122.206  -6.405  -1.212
  538    HE2  TYR 150           HE2      TYR 150 123.996  -2.921   0.476
  539    HH   TYR 150           HH       TYR 150 121.876  -5.330   1.139
  540    H    ASP 151           H        ASP 151 128.092  -7.465  -2.756
  541    HA   ASP 151           HA       ASP 151 127.105  -8.624  -0.419
  542   1HB   ASP 151          2HB       ASP 151 128.850  -9.490  -2.645
  543   2HB   ASP 151          1HB       ASP 151 128.992 -10.422  -1.158
  544    H    GLU 152           H        GLU 152 130.478  -7.881  -1.277
  545    HA   GLU 152           HA       GLU 152 131.543  -8.632   1.236
  546   1HB   GLU 152          2HB       GLU 152 132.745  -6.689  -0.738
  547   2HB   GLU 152          1HB       GLU 152 133.598  -7.619   0.485
  548   1HG   GLU 152          2HG       GLU 152 132.076  -9.315  -1.299
  549   2HG   GLU 152          1HG       GLU 152 133.236  -8.308  -2.164
  550    H    PHE 153           H        PHE 153 130.504  -5.525  -0.095
  551    HA   PHE 153           HA       PHE 153 131.431  -3.892   1.982
  552   1HB   PHE 153          2HB       PHE 153 130.082  -3.489  -0.393
  553   2HB   PHE 153          1HB       PHE 153 128.906  -2.991   0.818
  554    HD1  PHE 153           HD1      PHE 153 131.148  -1.687  -1.313
  555    HD2  PHE 153           HD2      PHE 153 130.330  -1.685   2.863
  556    HE1  PHE 153           HE1      PHE 153 132.302   0.474  -1.092
  557    HE2  PHE 153           HE2      PHE 153 131.484   0.476   3.092
  558    HZ   PHE 153           HZ       PHE 153 132.471   1.559   1.112
  559    H    LEU 154           H        LEU 154 128.647  -5.977   1.799
  560    HA   LEU 154           HA       LEU 154 126.980  -4.862   3.713
  561   1HB   LEU 154          2HB       LEU 154 127.523  -7.709   2.929
  562   2HB   LEU 154          1HB       LEU 154 126.399  -7.336   4.220
  563    HG   LEU 154           HG       LEU 154 126.158  -6.659   1.300
  564   1HD1  LEU 154          1HD1      LEU 154 124.841  -8.484   3.209
  565   2HD1  LEU 154          2HD1      LEU 154 125.162  -8.677   1.485
  566   3HD1  LEU 154          3HD1      LEU 154 123.806  -7.687   2.024
  567   1HD2  LEU 154          1HD2      LEU 154 124.959  -5.306   3.640
  568   2HD2  LEU 154          2HD2      LEU 154 123.883  -5.677   2.294
  569   3HD2  LEU 154          3HD2      LEU 154 125.317  -4.686   2.029
  570    H    GLU 155           H        GLU 155 129.876  -6.815   4.133
  571    HA   GLU 155           HA       GLU 155 129.563  -7.014   6.989
  572   1HB   GLU 155          2HB       GLU 155 131.486  -7.978   4.961
  573   2HB   GLU 155          1HB       GLU 155 132.146  -7.702   6.567
  574   1HG   GLU 155          2HG       GLU 155 129.643  -9.144   6.675
  575   2HG   GLU 155          1HG       GLU 155 130.836  -9.968   5.672
  576    H    PHE 156           H        PHE 156 131.137  -4.873   4.748
  577    HA   PHE 156           HA       PHE 156 133.043  -3.694   6.411
  578   1HB   PHE 156          2HB       PHE 156 132.448  -3.386   3.838
  579   2HB   PHE 156          1HB       PHE 156 131.573  -1.988   4.455
  580    HD1  PHE 156           HD1      PHE 156 134.204  -2.408   2.668
  581    HD2  PHE 156           HD2      PHE 156 133.406  -1.184   6.665
  582    HE1  PHE 156           HE1      PHE 156 136.296  -1.113   2.687
  583    HE2  PHE 156           HE2      PHE 156 135.495   0.113   6.691
  584    HZ   PHE 156           HZ       PHE 156 136.944   0.150   4.699
  585    H    MET 157           H        MET 157 129.723  -2.587   5.719
  586    HA   MET 157           HA       MET 157 129.883  -0.644   7.860
  587   1HB   MET 157          2HB       MET 157 128.397  -0.880   5.482
  588   2HB   MET 157          1HB       MET 157 127.224  -0.958   6.788
  589   1HG   MET 157          2HG       MET 157 127.268   1.266   6.691
  590   2HG   MET 157          1HG       MET 157 128.777   1.119   7.589
  591   1HE   MET 157          1HE       MET 157 131.114   1.049   6.513
  592   2HE   MET 157          2HE       MET 157 131.483   1.450   4.836
  593   3HE   MET 157          3HE       MET 157 130.743  -0.102   5.229
  594    H    LYS 158           H        LYS 158 129.432  -3.860   7.921
  595    HA   LYS 158           HA       LYS 158 127.291  -3.823   9.925
  596   1HB   LYS 158          2HB       LYS 158 128.444  -5.886   8.129
  597   2HB   LYS 158          1HB       LYS 158 127.882  -6.435   9.701
  598   1HG   LYS 158          2HG       LYS 158 126.021  -4.688   8.245
  599   2HG   LYS 158          1HG       LYS 158 126.329  -6.261   7.505
  600   1HD   LYS 158          2HD       LYS 158 124.706  -6.974   8.889
  601   2HD   LYS 158          1HD       LYS 158 125.984  -6.961  10.106
  602   1HE   LYS 158          2HE       LYS 158 124.694  -4.366   9.713
  603   2HE   LYS 158          1HE       LYS 158 123.601  -5.624  10.288
  604   1HZ   LYS 158          1HZ       LYS 158 126.202  -5.337  11.604
  605   2HZ   LYS 158          2HZ       LYS 158 124.718  -5.828  12.247
  606   3HZ   LYS 158          3HZ       LYS 158 125.006  -4.189  11.944
  607    H    GLY 159           H        GLY 159 129.754  -2.640  10.579
  608   1HA   GLY 159          2HA       GLY 159 130.611  -2.817  12.881
  609   2HA   GLY 159          1HA       GLY 159 130.796  -4.542  12.586
  610    H    VAL 160           H        VAL 160 132.517  -1.802  12.888
  611    HA   VAL 160           HA       VAL 160 134.645  -2.828  11.140
  612    HB   VAL 160           HB       VAL 160 134.662   0.094  11.476
  613   1HG1  VAL 160          1HG1      VAL 160 134.770  -1.428   8.903
  614   2HG1  VAL 160          2HG1      VAL 160 136.132  -1.454  10.023
  615   3HG1  VAL 160          3HG1      VAL 160 135.576   0.076   9.346
  616   1HG2  VAL 160          1HG2      VAL 160 132.456  -1.254   9.931
  617   2HG2  VAL 160          2HG2      VAL 160 132.984   0.397   9.614
  618   3HG2  VAL 160          3HG2      VAL 160 132.309  -0.026  11.188
  619    H    GLU 161           H        GLU 161 134.487  -3.468  13.798
  620    HA   GLU 161           HA       GLU 161 136.513  -1.742  15.061
  621   1HB   GLU 161          2HB       GLU 161 135.730  -2.583  17.211
  622   2HB   GLU 161          1HB       GLU 161 134.399  -1.874  16.308
  623   1HG   GLU 161          2HG       GLU 161 134.060  -4.371  15.529
  624   2HG   GLU 161          1HG       GLU 161 134.906  -4.704  17.040
  Start of MODEL   14
    1   1H    MET  81          1HT       MET  81  97.122 -18.069   9.189
    2   2H    MET  81          2HT       MET  81  96.942 -16.708   8.159
    3   3H    MET  81          3HT       MET  81  97.042 -18.286   7.490
    4    HA   MET  81           HA       MET  81  94.800 -17.261   7.591
    5   1HB   MET  81          2HB       MET  81  95.686 -19.930   8.548
    6   2HB   MET  81          1HB       MET  81  93.989 -19.531   8.780
    7   1HG   MET  81          2HG       MET  81  93.994 -18.908   6.299
    8   2HG   MET  81          1HG       MET  81  95.523 -19.780   6.222
    9   1HE   MET  81          1HE       MET  81  94.750 -22.391   8.398
   10   2HE   MET  81          2HE       MET  81  95.870 -22.076   7.072
   11   3HE   MET  81          3HE       MET  81  94.690 -23.381   6.940
   12    H    VAL  82           H        VAL  82  93.676 -15.902   8.812
   13    HA   VAL  82           HA       VAL  82  92.665 -14.918  10.599
   14    HB   VAL  82           HB       VAL  82  93.225 -17.472  12.108
   15   1HG1  VAL  82          1HG1      VAL  82  91.379 -16.851  13.489
   16   2HG1  VAL  82          2HG1      VAL  82  90.982 -15.488  12.442
   17   3HG1  VAL  82          3HG1      VAL  82  92.466 -15.465  13.395
   18   1HG2  VAL  82          1HG2      VAL  82  92.126 -18.015  10.008
   19   2HG2  VAL  82          2HG2      VAL  82  90.889 -16.797  10.321
   20   3HG2  VAL  82          3HG2      VAL  82  91.007 -18.220  11.357
   21    H    ARG  83           H        ARG  83  94.226 -13.342  10.925
   22    HA   ARG  83           HA       ARG  83  95.795 -12.152  12.063
   23   1HB   ARG  83          2HB       ARG  83  94.854 -14.125  14.101
   24   2HB   ARG  83          1HB       ARG  83  96.258 -13.133  14.473
   25   1HG   ARG  83          2HG       ARG  83  94.954 -11.116  14.122
   26   2HG   ARG  83          1HG       ARG  83  93.547 -12.086  13.682
   27   1HD   ARG  83          2HD       ARG  83  93.072 -11.704  15.881
   28   2HD   ARG  83          1HD       ARG  83  94.012 -13.187  16.036
   29    HE   ARG  83           HE       ARG  83  95.885 -11.251  16.250
   30   1HH1  ARG  83          1HH1      ARG  83  92.840 -11.806  17.864
   31   2HH1  ARG  83          2HH1      ARG  83  93.342 -11.051  19.340
   32   1HH2  ARG  83          1HH2      ARG  83  96.547 -10.260  18.191
   33   2HH2  ARG  83          2HH2      ARG  83  95.447 -10.173  19.526
   34    H    CYS  84           H        CYS  84  98.004 -12.301  13.109
   35    HA   CYS  84           HA       CYS  84  99.435 -14.725  12.258
   36   1HB   CYS  84          2HB       CYS  84  99.876 -11.916  11.405
   37   2HB   CYS  84          1HB       CYS  84 101.314 -12.871  11.747
   38    HG   CYS  84           HG       CYS  84 100.204 -14.611   9.925
   39    H    MET  85           H        MET  85 101.755 -14.679  13.146
   40    HA   MET  85           HA       MET  85 101.569 -14.366  15.990
   41   1HB   MET  85          2HB       MET  85 103.370 -15.659  14.088
   42   2HB   MET  85          1HB       MET  85 104.220 -14.927  15.441
   43   1HG   MET  85          2HG       MET  85 103.328 -16.358  16.963
   44   2HG   MET  85          1HG       MET  85 101.839 -16.585  16.045
   45   1HE   MET  85          1HE       MET  85 105.199 -17.506  16.952
   46   2HE   MET  85          2HE       MET  85 105.667 -18.922  16.012
   47   3HE   MET  85          3HE       MET  85 104.454 -19.070  17.284
   48    H    LYS  86           H        LYS  86 103.644 -12.936  13.472
   49    HA   LYS  86           HA       LYS  86 103.967 -10.583  15.205
   50   1HB   LYS  86          2HB       LYS  86 106.127 -12.063  13.707
   51   2HB   LYS  86          1HB       LYS  86 106.331 -10.416  14.288
   52   1HG   LYS  86          2HG       LYS  86 105.856 -11.232  16.587
   53   2HG   LYS  86          1HG       LYS  86 105.838 -12.876  15.950
   54   1HD   LYS  86          2HD       LYS  86 108.175 -12.263  15.000
   55   2HD   LYS  86          1HD       LYS  86 108.130 -10.964  16.196
   56   1HE   LYS  86          2HE       LYS  86 107.853 -12.557  17.983
   57   2HE   LYS  86          1HE       LYS  86 107.722 -13.884  16.829
   58   1HZ   LYS  86          1HZ       LYS  86 109.957 -13.813  16.358
   59   2HZ   LYS  86          2HZ       LYS  86 109.962 -13.423  18.004
   60   3HZ   LYS  86          3HZ       LYS  86 110.135 -12.203  16.845
   61    H    ASP  87           H        ASP  87 102.996  -8.964  14.187
   62    HA   ASP  87           HA       ASP  87 102.889  -8.907  11.279
   63   1HB   ASP  87          2HB       ASP  87 101.345  -6.994  11.613
   64   2HB   ASP  87          1HB       ASP  87 100.822  -8.445  12.463
   65    H    ASP  88           H        ASP  88 104.702  -7.506  13.826
   66    HA   ASP  88           HA       ASP  88 105.377  -5.020  12.739
   67   1HB   ASP  88          2HB       ASP  88 105.971  -6.285  15.052
   68   2HB   ASP  88          1HB       ASP  88 107.504  -6.473  14.204
   69    H    SER  89           H        SER  89 106.694  -4.395  11.140
   70    HA   SER  89           HA       SER  89 108.480  -6.409   9.941
   71   1HB   SER  89          2HB       SER  89 107.063  -4.279   8.342
   72   2HB   SER  89          1HB       SER  89 107.898  -5.714   7.748
   73    HG   SER  89           HG       SER  89 105.346  -5.447   8.801
   74    H    LYS  90           H        LYS  90 110.535  -5.818  10.042
   75    HA   LYS  90           HA       LYS  90 111.442  -3.346  10.960
   76   1HB   LYS  90          2HB       LYS  90 112.654  -5.759   9.792
   77   2HB   LYS  90          1HB       LYS  90 113.590  -4.290   9.559
   78   1HG   LYS  90          2HG       LYS  90 114.028  -4.045  11.784
   79   2HG   LYS  90          1HG       LYS  90 112.546  -4.867  12.278
   80   1HD   LYS  90          2HD       LYS  90 114.506  -6.222  12.798
   81   2HD   LYS  90          1HD       LYS  90 113.505  -7.011  11.579
   82   1HE   LYS  90          2HE       LYS  90 115.027  -6.010   9.842
   83   2HE   LYS  90          1HE       LYS  90 116.086  -5.515  11.162
   84   1HZ   LYS  90          1HZ       LYS  90 117.013  -7.508  10.740
   85   2HZ   LYS  90          2HZ       LYS  90 115.608  -8.163  10.060
   86   3HZ   LYS  90          3HZ       LYS  90 115.774  -8.082  11.742
   87    H    GLY  91           H        GLY  91 112.931  -1.858   9.747
   88   1HA   GLY  91          2HA       GLY  91 111.884  -1.387   7.022
   89   2HA   GLY  91          1HA       GLY  91 112.201  -0.086   8.160
   90    H    LYS  92           H        LYS  92 114.421   0.323   8.774
   91    HA   LYS  92           HA       LYS  92 116.183   0.078   6.510
   92   1HB   LYS  92          2HB       LYS  92 116.796   1.267   9.217
   93   2HB   LYS  92          1HB       LYS  92 117.653   1.558   7.708
   94   1HG   LYS  92          2HG       LYS  92 115.040   2.259   7.133
   95   2HG   LYS  92          1HG       LYS  92 115.288   2.842   8.780
   96   1HD   LYS  92          2HD       LYS  92 116.745   4.432   8.130
   97   2HD   LYS  92          1HD       LYS  92 117.509   3.383   6.933
   98   1HE   LYS  92          2HE       LYS  92 116.518   4.862   5.518
   99   2HE   LYS  92          1HE       LYS  92 115.179   3.731   5.708
  100   1HZ   LYS  92          1HZ       LYS  92 115.551   6.308   7.136
  101   2HZ   LYS  92          2HZ       LYS  92 114.334   5.189   7.500
  102   3HZ   LYS  92          3HZ       LYS  92 114.364   5.942   5.985
  103    H    THR  93           H        THR  93 116.552  -2.180   6.440
  104    HA   THR  93           HA       THR  93 118.263  -3.211   8.604
  105    HB   THR  93           HB       THR  93 116.151  -4.450   8.290
  106    HG1  THR  93           HG1      THR  93 117.126  -6.503   8.074
  107   1HG2  THR  93          1HG2      THR  93 115.367  -5.219   6.356
  108   2HG2  THR  93          2HG2      THR  93 116.959  -5.742   5.807
  109   3HG2  THR  93          3HG2      THR  93 116.470  -4.060   5.615
  110    H    GLU  94           H        GLU  94 119.139  -5.484   7.016
  111    HA   GLU  94           HA       GLU  94 121.411  -4.309   5.787
  112   1HB   GLU  94          2HB       GLU  94 120.388  -7.053   6.235
  113   2HB   GLU  94          1HB       GLU  94 121.528  -6.851   4.912
  114   1HG   GLU  94          2HG       GLU  94 123.105  -7.116   6.455
  115   2HG   GLU  94          1HG       GLU  94 122.732  -5.462   6.936
  116    H    GLU  95           H        GLU  95 118.291  -4.699   4.641
  117    HA   GLU  95           HA       GLU  95 118.937  -5.287   1.897
  118   1HB   GLU  95          2HB       GLU  95 116.594  -4.997   1.451
  119   2HB   GLU  95          1HB       GLU  95 116.754  -5.896   2.953
  120   1HG   GLU  95          2HG       GLU  95 115.318  -4.441   3.814
  121   2HG   GLU  95          1HG       GLU  95 116.646  -3.282   3.798
  122    H    GLU  96           H        GLU  96 118.471  -2.441   3.858
  123    HA   GLU  96           HA       GLU  96 118.263  -0.617   1.656
  124   1HB   GLU  96          2HB       GLU  96 118.410   1.130   3.338
  125   2HB   GLU  96          1HB       GLU  96 117.292  -0.119   3.866
  126   1HG   GLU  96          2HG       GLU  96 118.443  -0.435   5.725
  127   2HG   GLU  96          1HG       GLU  96 119.924  -0.724   4.810
  128    H    LEU  97           H        LEU  97 120.847  -2.138   3.345
  129    HA   LEU  97           HA       LEU  97 122.910  -0.295   3.066
  130   1HB   LEU  97          2HB       LEU  97 122.809  -3.284   3.171
  131   2HB   LEU  97          1HB       LEU  97 124.332  -2.479   2.841
  132    HG   LEU  97           HG       LEU  97 122.640  -2.002   5.295
  133   1HD1  LEU  97          1HD1      LEU  97 125.074  -3.718   4.856
  134   2HD1  LEU  97          2HD1      LEU  97 123.482  -4.224   5.422
  135   3HD1  LEU  97          3HD1      LEU  97 124.502  -3.216   6.448
  136   1HD2  LEU  97          1HD2      LEU  97 125.320  -0.987   4.396
  137   2HD2  LEU  97          2HD2      LEU  97 124.828  -0.983   6.090
  138   3HD2  LEU  97          3HD2      LEU  97 123.906  -0.061   4.902
  139    H    SER  98           H        SER  98 121.275  -2.135   0.651
  140    HA   SER  98           HA       SER  98 123.334  -2.157  -1.306
  141   1HB   SER  98          2HB       SER  98 121.632  -2.863  -2.852
  142   2HB   SER  98          1HB       SER  98 121.303  -3.647  -1.307
  143    HG   SER  98           HG       SER  98 119.751  -1.990  -0.912
  144    H    ASP  99           H        ASP  99 120.704   0.064  -0.536
  145    HA   ASP  99           HA       ASP  99 120.888   1.725  -2.781
  146   1HB   ASP  99          2HB       ASP  99 119.244   1.650  -0.653
  147   2HB   ASP  99          1HB       ASP  99 120.267   3.001  -0.174
  148    H    LEU 100           H        LEU 100 122.594   1.826   0.316
  149    HA   LEU 100           HA       LEU 100 123.992   4.238  -0.205
  150   1HB   LEU 100          2HB       LEU 100 124.433   1.975   1.725
  151   2HB   LEU 100          1HB       LEU 100 125.523   3.346   1.641
  152    HG   LEU 100           HG       LEU 100 122.703   4.102   1.910
  153   1HD1  LEU 100          1HD1      LEU 100 123.932   2.176   3.780
  154   2HD1  LEU 100          2HD1      LEU 100 122.235   2.473   3.402
  155   3HD1  LEU 100          3HD1      LEU 100 123.095   3.552   4.500
  156   1HD2  LEU 100          1HD2      LEU 100 124.333   5.792   2.122
  157   2HD2  LEU 100          2HD2      LEU 100 125.305   4.826   3.230
  158   3HD2  LEU 100          3HD2      LEU 100 123.757   5.483   3.758
  159    H    PHE 101           H        PHE 101 124.463   0.973  -1.206
  160    HA   PHE 101           HA       PHE 101 127.244   0.999  -1.642
  161   1HB   PHE 101          2HB       PHE 101 125.879  -1.061  -1.635
  162   2HB   PHE 101          1HB       PHE 101 125.122  -0.551  -3.141
  163    HD1  PHE 101           HD1      PHE 101 126.263  -0.748  -5.231
  164    HD2  PHE 101           HD2      PHE 101 128.222  -1.760  -1.592
  165    HE1  PHE 101           HE1      PHE 101 128.055  -1.851  -6.506
  166    HE2  PHE 101           HE2      PHE 101 130.018  -2.863  -2.860
  167    HZ   PHE 101           HZ       PHE 101 129.936  -2.909  -5.322
  168    H    ARG 102           H        ARG 102 124.536   1.670  -3.866
  169    HA   ARG 102           HA       ARG 102 126.054   2.233  -6.133
  170   1HB   ARG 102          2HB       ARG 102 123.309   2.612  -5.261
  171   2HB   ARG 102          1HB       ARG 102 123.852   3.938  -6.278
  172   1HG   ARG 102          2HG       ARG 102 124.691   1.487  -7.459
  173   2HG   ARG 102          1HG       ARG 102 122.978   1.367  -7.055
  174   1HD   ARG 102          2HD       ARG 102 123.268   3.911  -8.146
  175   2HD   ARG 102          1HD       ARG 102 124.285   2.878  -9.150
  176    HE   ARG 102           HE       ARG 102 122.394   1.937 -10.012
  177   1HH1  ARG 102          1HH1      ARG 102 121.568   3.532  -7.020
  178   2HH1  ARG 102          2HH1      ARG 102 119.866   3.271  -7.206
  179   1HH2  ARG 102          1HH2      ARG 102 120.156   1.593 -10.259
  180   2HH2  ARG 102          2HH2      ARG 102 119.064   2.171  -9.044
  181    H    MET 103           H        MET 103 125.261   4.224  -3.365
  182    HA   MET 103           HA       MET 103 125.905   6.743  -4.374
  183   1HB   MET 103          2HB       MET 103 125.742   5.512  -1.688
  184   2HB   MET 103          1HB       MET 103 126.700   6.982  -1.801
  185   1HG   MET 103          2HG       MET 103 124.575   7.846  -3.101
  186   2HG   MET 103          1HG       MET 103 123.785   6.580  -2.162
  187   1HE   MET 103          1HE       MET 103 122.303   9.008  -0.605
  188   2HE   MET 103          2HE       MET 103 122.822   8.091   0.808
  189   3HE   MET 103          3HE       MET 103 122.466   7.254  -0.703
  190    H    PHE 104           H        PHE 104 127.947   4.117  -3.326
  191    HA   PHE 104           HA       PHE 104 130.343   5.735  -3.299
  192   1HB   PHE 104          2HB       PHE 104 129.584   3.247  -2.215
  193   2HB   PHE 104          1HB       PHE 104 130.879   2.907  -3.358
  194    HD1  PHE 104           HD1      PHE 104 130.174   3.722  -0.055
  195    HD2  PHE 104           HD2      PHE 104 132.919   4.611  -3.182
  196    HE1  PHE 104           HE1      PHE 104 131.829   4.455   1.612
  197    HE2  PHE 104           HE2      PHE 104 134.581   5.344  -1.521
  198    HZ   PHE 104           HZ       PHE 104 134.036   5.266   0.880
  199    H    ASP 105           H        ASP 105 128.492   4.294  -5.697
  200    HA   ASP 105           HA       ASP 105 130.789   3.811  -7.451
  201   1HB   ASP 105          2HB       ASP 105 128.502   2.357  -7.103
  202   2HB   ASP 105          1HB       ASP 105 128.084   3.325  -8.514
  203    H    LYS 106           H        LYS 106 131.150   4.970  -9.297
  204    HA   LYS 106           HA       LYS 106 129.537   7.408  -9.610
  205   1HB   LYS 106          2HB       LYS 106 132.406   6.805 -10.312
  206   2HB   LYS 106          1HB       LYS 106 131.575   8.255 -10.856
  207   1HG   LYS 106          2HG       LYS 106 131.458   7.704  -7.963
  208   2HG   LYS 106          1HG       LYS 106 133.040   8.133  -8.618
  209   1HD   LYS 106          2HD       LYS 106 132.381  10.259  -8.400
  210   2HD   LYS 106          1HD       LYS 106 131.361   9.960  -9.809
  211   1HE   LYS 106          2HE       LYS 106 129.977  10.916  -8.128
  212   2HE   LYS 106          1HE       LYS 106 129.564   9.205  -8.232
  213   1HZ   LYS 106          1HZ       LYS 106 129.785   9.346  -6.009
  214   2HZ   LYS 106          2HZ       LYS 106 130.821  10.681  -6.064
  215   3HZ   LYS 106          3HZ       LYS 106 131.427   9.128  -6.349
  216    H    ASN 107           H        ASN 107 130.960   4.700 -11.355
  217    HA   ASN 107           HA       ASN 107 129.673   5.598 -13.828
  218   1HB   ASN 107          2HB       ASN 107 131.004   3.766 -14.891
  219   2HB   ASN 107          1HB       ASN 107 131.985   4.998 -14.102
  220   1HD2  ASN 107          1HD2      ASN 107 133.743   3.711 -13.760
  221   2HD2  ASN 107          2HD2      ASN 107 133.750   2.382 -12.659
  222    H    ALA 108           H        ALA 108 128.612   4.005 -11.273
  223    HA   ALA 108           HA       ALA 108 127.141   2.306 -10.841
  224   1HB   ALA 108          1HB       ALA 108 125.186   2.294 -12.314
  225   2HB   ALA 108          2HB       ALA 108 126.081   3.234 -13.507
  226   3HB   ALA 108          3HB       ALA 108 125.704   3.937 -11.934
  227    H    ASP 109           H        ASP 109 129.013   0.785 -11.181
  228    HA   ASP 109           HA       ASP 109 128.442  -1.024 -13.435
  229   1HB   ASP 109          2HB       ASP 109 130.829  -1.725 -13.296
  230   2HB   ASP 109          1HB       ASP 109 130.621  -0.037 -13.750
  231    H    GLY 110           H        GLY 110 128.289  -0.694 -10.110
  232   1HA   GLY 110          2HA       GLY 110 127.396  -2.343  -8.685
  233   2HA   GLY 110          1HA       GLY 110 127.925  -3.576  -9.817
  234    H    TYR 111           H        TYR 111 130.595  -1.965  -9.802
  235    HA   TYR 111           HA       TYR 111 131.603  -3.002  -7.240
  236   1HB   TYR 111          2HB       TYR 111 132.902  -3.286  -9.958
  237   2HB   TYR 111          1HB       TYR 111 133.683  -3.689  -8.432
  238    HD1  TYR 111           HD1      TYR 111 130.784  -4.551 -10.591
  239    HD2  TYR 111           HD2      TYR 111 133.378  -5.803  -7.460
  240    HE1  TYR 111           HE1      TYR 111 129.827  -6.812 -10.711
  241    HE2  TYR 111           HE2      TYR 111 132.429  -8.068  -7.572
  242    HH   TYR 111           HH       TYR 111 131.245  -9.491  -9.196
  243    H    ILE 112           H        ILE 112 133.233  -1.821  -6.261
  244    HA   ILE 112           HA       ILE 112 133.700   0.842  -7.426
  245    HB   ILE 112           HB       ILE 112 133.998   0.050  -4.529
  246   1HG1  ILE 112          2HG1      ILE 112 131.782   1.832  -5.224
  247   2HG1  ILE 112          1HG1      ILE 112 131.613   0.223  -5.915
  248   1HG2  ILE 112          1HG2      ILE 112 134.551   2.196  -4.079
  249   2HG2  ILE 112          2HG2      ILE 112 133.534   2.845  -5.364
  250   3HG2  ILE 112          3HG2      ILE 112 135.110   2.157  -5.751
  251   1HD1  ILE 112          1HD1      ILE 112 130.777   0.912  -3.455
  252   2HD1  ILE 112          2HD1      ILE 112 132.388   0.298  -3.084
  253   3HD1  ILE 112          3HD1      ILE 112 131.223  -0.728  -3.923
  254    H    ASP 113           H        ASP 113 135.709   1.483  -7.906
  255    HA   ASP 113           HA       ASP 113 137.925  -0.308  -7.167
  256   1HB   ASP 113          2HB       ASP 113 139.093   0.845  -9.133
  257   2HB   ASP 113          1HB       ASP 113 137.781  -0.264  -9.523
  258    H    LEU 114           H        LEU 114 140.114   0.960  -7.228
  259    HA   LEU 114           HA       LEU 114 140.036   2.808  -5.088
  260   1HB   LEU 114          2HB       LEU 114 142.192   1.823  -6.920
  261   2HB   LEU 114          1HB       LEU 114 142.512   3.136  -5.802
  262    HG   LEU 114           HG       LEU 114 143.243   0.992  -4.891
  263   1HD1  LEU 114          1HD1      LEU 114 140.846   1.700  -3.268
  264   2HD1  LEU 114          2HD1      LEU 114 142.107   2.910  -3.521
  265   3HD1  LEU 114          3HD1      LEU 114 142.501   1.372  -2.754
  266   1HD2  LEU 114          1HD2      LEU 114 141.887  -0.850  -4.598
  267   2HD2  LEU 114          2HD2      LEU 114 141.306  -0.222  -6.140
  268   3HD2  LEU 114          3HD2      LEU 114 140.403   0.100  -4.659
  269    H    GLU 115           H        GLU 115 140.142   3.162  -8.565
  270    HA   GLU 115           HA       GLU 115 140.888   5.920  -8.552
  271   1HB   GLU 115          2HB       GLU 115 139.604   4.219 -10.694
  272   2HB   GLU 115          1HB       GLU 115 140.192   5.857 -10.941
  273   1HG   GLU 115          2HG       GLU 115 142.055   3.816  -9.844
  274   2HG   GLU 115          1HG       GLU 115 141.657   3.778 -11.561
  275    H    GLU 116           H        GLU 116 137.862   4.164  -8.448
  276    HA   GLU 116           HA       GLU 116 136.174   6.364  -9.069
  277   1HB   GLU 116          2HB       GLU 116 135.820   3.651  -8.729
  278   2HB   GLU 116          1HB       GLU 116 135.015   4.321  -7.317
  279   1HG   GLU 116          2HG       GLU 116 133.547   5.614  -8.668
  280   2HG   GLU 116          1HG       GLU 116 134.463   5.235 -10.126
  281    H    LEU 117           H        LEU 117 136.604   4.679  -5.969
  282    HA   LEU 117           HA       LEU 117 135.367   6.499  -4.322
  283   1HB   LEU 117          2HB       LEU 117 136.778   5.625  -2.496
  284   2HB   LEU 117          1HB       LEU 117 136.079   4.362  -3.489
  285    HG   LEU 117           HG       LEU 117 138.332   4.339  -4.728
  286   1HD1  LEU 117          1HD1      LEU 117 140.028   5.008  -2.677
  287   2HD1  LEU 117          2HD1      LEU 117 138.838   6.309  -2.641
  288   3HD1  LEU 117          3HD1      LEU 117 139.730   5.972  -4.125
  289   1HD2  LEU 117          1HD2      LEU 117 137.331   2.855  -2.698
  290   2HD2  LEU 117          2HD2      LEU 117 138.840   3.420  -1.981
  291   3HD2  LEU 117          3HD2      LEU 117 138.867   2.529  -3.503
  292    H    LYS 118           H        LYS 118 138.477   6.758  -5.843
  293    HA   LYS 118           HA       LYS 118 139.588   8.763  -4.190
  294   1HB   LYS 118          2HB       LYS 118 140.357   7.321  -6.493
  295   2HB   LYS 118          1HB       LYS 118 140.488   9.024  -6.905
  296   1HG   LYS 118          2HG       LYS 118 141.707   7.845  -4.425
  297   2HG   LYS 118          1HG       LYS 118 142.558   7.951  -5.967
  298   1HD   LYS 118          2HD       LYS 118 141.278  10.385  -4.790
  299   2HD   LYS 118          1HD       LYS 118 142.848   9.839  -4.198
  300   1HE   LYS 118          2HE       LYS 118 143.903  10.600  -6.013
  301   2HE   LYS 118          1HE       LYS 118 142.717   9.877  -7.100
  302   1HZ   LYS 118          1HZ       LYS 118 142.150  12.370  -5.614
  303   2HZ   LYS 118          2HZ       LYS 118 141.360  11.757  -6.977
  304   3HZ   LYS 118          3HZ       LYS 118 142.923  12.385  -7.120
  305    H    ILE 119           H        ILE 119 137.034   8.864  -6.431
  306    HA   ILE 119           HA       ILE 119 137.366  11.682  -7.059
  307    HB   ILE 119           HB       ILE 119 135.054   9.894  -7.795
  308   1HG1  ILE 119          2HG1      ILE 119 137.439  10.536  -9.530
  309   2HG1  ILE 119          1HG1      ILE 119 137.348   9.075  -8.551
  310   1HG2  ILE 119          1HG2      ILE 119 135.907  12.138  -9.506
  311   2HG2  ILE 119          2HG2      ILE 119 135.185  12.572  -7.956
  312   3HG2  ILE 119          3HG2      ILE 119 134.289  11.570  -9.099
  313   1HD1  ILE 119          1HD1      ILE 119 135.128   9.703 -10.433
  314   2HD1  ILE 119          2HD1      ILE 119 135.713   8.141  -9.857
  315   3HD1  ILE 119          3HD1      ILE 119 136.640   9.044 -11.056
  316    H    MET 120           H        MET 120 134.960   9.616  -5.443
  317    HA   MET 120           HA       MET 120 133.233  11.652  -4.631
  318   1HB   MET 120          2HB       MET 120 132.331  10.046  -3.040
  319   2HB   MET 120          1HB       MET 120 132.634   9.277  -4.591
  320   1HG   MET 120          2HG       MET 120 133.798   7.720  -3.550
  321   2HG   MET 120          1HG       MET 120 134.977   8.945  -3.093
  322   1HE   MET 120          1HE       MET 120 135.243   9.027   0.206
  323   2HE   MET 120          2HE       MET 120 135.876   8.410  -1.320
  324   3HE   MET 120          3HE       MET 120 135.222   7.294  -0.121
  325    H    LEU 121           H        LEU 121 136.215  10.500  -3.169
  326    HA   LEU 121           HA       LEU 121 135.752  11.955  -0.719
  327   1HB   LEU 121          2HB       LEU 121 138.018  11.228  -0.102
  328   2HB   LEU 121          1HB       LEU 121 136.980   9.899  -0.574
  329    HG   LEU 121           HG       LEU 121 138.152  10.295  -2.928
  330   1HD1  LEU 121          1HD1      LEU 121 140.235  11.227  -2.897
  331   2HD1  LEU 121          2HD1      LEU 121 140.484  10.880  -1.187
  332   3HD1  LEU 121          3HD1      LEU 121 139.453  12.222  -1.671
  333   1HD2  LEU 121          1HD2      LEU 121 139.757   8.548  -2.310
  334   2HD2  LEU 121          2HD2      LEU 121 138.148   8.209  -1.671
  335   3HD2  LEU 121          3HD2      LEU 121 139.406   8.835  -0.607
  336    H    GLN 122           H        GLN 122 137.781  12.363  -3.604
  337    HA   GLN 122           HA       GLN 122 139.184  14.625  -2.669
  338   1HB   GLN 122          2HB       GLN 122 139.765  15.016  -5.013
  339   2HB   GLN 122          1HB       GLN 122 139.954  13.321  -4.585
  340   1HG   GLN 122          2HG       GLN 122 137.814  12.819  -5.636
  341   2HG   GLN 122          1HG       GLN 122 137.633  14.517  -6.077
  342   1HE2  GLN 122          1HE2      GLN 122 138.269  15.056  -8.030
  343   2HE2  GLN 122          2HE2      GLN 122 139.393  14.187  -9.015
  344    H    ALA 123           H        ALA 123 136.241  14.310  -4.616
  345    HA   ALA 123           HA       ALA 123 135.783  17.009  -5.127
  346   1HB   ALA 123          1HB       ALA 123 134.336  15.771  -6.346
  347   2HB   ALA 123          2HB       ALA 123 133.265  16.101  -4.984
  348   3HB   ALA 123          3HB       ALA 123 134.126  14.564  -5.077
  349    H    THR 124           H        THR 124 135.480  15.233  -2.187
  350    HA   THR 124           HA       THR 124 134.192  17.553  -0.918
  351    HB   THR 124           HB       THR 124 132.730  15.600  -0.881
  352    HG1  THR 124           HG1      THR 124 133.841  16.047   1.686
  353   1HG2  THR 124          1HG2      THR 124 133.253  13.557   0.029
  354   2HG2  THR 124          2HG2      THR 124 134.656  14.187   0.894
  355   3HG2  THR 124          3HG2      THR 124 134.720  13.975  -0.855
  356    H    GLY 125           H        GLY 125 135.766  18.682   0.052
  357   1HA   GLY 125          2HA       GLY 125 138.020  17.275   1.265
  358   2HA   GLY 125          1HA       GLY 125 137.886  19.009   1.024
  359    H    GLU 126           H        GLU 126 135.284  17.203   2.467
  360    HA   GLU 126           HA       GLU 126 135.995  18.342   5.088
  361   1HB   GLU 126          2HB       GLU 126 133.325  18.177   3.711
  362   2HB   GLU 126          1HB       GLU 126 133.455  18.384   5.453
  363   1HG   GLU 126          2HG       GLU 126 135.013  20.244   3.766
  364   2HG   GLU 126          1HG       GLU 126 133.260  20.425   3.757
  365    H    THR 127           H        THR 127 135.366  15.515   3.349
  366    HA   THR 127           HA       THR 127 134.671  14.051   5.803
  367    HB   THR 127           HB       THR 127 133.637  12.386   4.475
  368    HG1  THR 127           HG1      THR 127 133.809  12.423   2.186
  369   1HG2  THR 127          1HG2      THR 127 131.836  13.501   3.787
  370   2HG2  THR 127          2HG2      THR 127 132.763  14.499   2.665
  371   3HG2  THR 127          3HG2      THR 127 132.682  14.933   4.374
  372    H    ILE 128           H        ILE 128 135.361  11.493   4.930
  373    HA   ILE 128           HA       ILE 128 137.964  11.207   5.738
  374    HB   ILE 128           HB       ILE 128 136.639   9.373   3.745
  375   1HG1  ILE 128          2HG1      ILE 128 136.190   8.285   6.233
  376   2HG1  ILE 128          1HG1      ILE 128 135.955  10.003   6.531
  377   1HG2  ILE 128          1HG2      ILE 128 138.993   8.911   4.172
  378   2HG2  ILE 128          2HG2      ILE 128 137.971   7.644   4.854
  379   3HG2  ILE 128          3HG2      ILE 128 138.679   8.869   5.908
  380   1HD1  ILE 128          1HD1      ILE 128 134.620   9.180   4.116
  381   2HD1  ILE 128          2HD1      ILE 128 133.970   9.968   5.554
  382   3HD1  ILE 128          3HD1      ILE 128 134.111   8.211   5.498
  383    H    THR 129           H        THR 129 139.915  11.484   4.883
  384    HA   THR 129           HA       THR 129 140.176  12.579   2.236
  385    HB   THR 129           HB       THR 129 142.515  11.762   3.919
  386    HG1  THR 129           HG1      THR 129 141.428  12.789   5.463
  387   1HG2  THR 129          1HG2      THR 129 141.936  14.009   2.026
  388   2HG2  THR 129          2HG2      THR 129 143.217  12.796   1.952
  389   3HG2  THR 129          3HG2      THR 129 143.277  14.070   3.171
  390    H    GLU 130           H        GLU 130 141.898  11.754   0.746
  391    HA   GLU 130           HA       GLU 130 141.299   9.230  -0.202
  392   1HB   GLU 130          2HB       GLU 130 143.457   9.424  -1.489
  393   2HB   GLU 130          1HB       GLU 130 142.357  10.784  -1.658
  394   1HG   GLU 130          2HG       GLU 130 144.340  11.032   0.494
  395   2HG   GLU 130          1HG       GLU 130 144.991  11.012  -1.145
  396    H    ASP 131           H        ASP 131 143.460  10.104   2.357
  397    HA   ASP 131           HA       ASP 131 145.113   7.806   2.301
  398   1HB   ASP 131          2HB       ASP 131 144.653  10.080   4.091
  399   2HB   ASP 131          1HB       ASP 131 145.090   8.599   4.940
  400    H    ASP 132           H        ASP 132 142.496   8.636   4.576
  401    HA   ASP 132           HA       ASP 132 142.335   6.117   5.772
  402   1HB   ASP 132          2HB       ASP 132 140.637   8.536   5.672
  403   2HB   ASP 132          1HB       ASP 132 139.815   7.041   6.113
  404    H    ILE 133           H        ILE 133 140.780   7.374   2.877
  405    HA   ILE 133           HA       ILE 133 138.888   5.289   2.579
  406    HB   ILE 133           HB       ILE 133 140.092   7.088   0.469
  407   1HG1  ILE 133          2HG1      ILE 133 138.916   8.280   2.288
  408   2HG1  ILE 133          1HG1      ILE 133 138.068   8.422   0.752
  409   1HG2  ILE 133          1HG2      ILE 133 137.854   5.102   0.392
  410   2HG2  ILE 133          2HG2      ILE 133 139.164   5.356  -0.762
  411   3HG2  ILE 133          3HG2      ILE 133 137.838   6.515  -0.664
  412   1HD1  ILE 133          1HD1      ILE 133 137.326   6.820   3.164
  413   2HD1  ILE 133          2HD1      ILE 133 136.664   6.443   1.573
  414   3HD1  ILE 133          3HD1      ILE 133 136.382   8.029   2.293
  415    H    GLU 134           H        GLU 134 141.971   5.846   0.852
  416    HA   GLU 134           HA       GLU 134 142.069   3.561  -0.658
  417   1HB   GLU 134          2HB       GLU 134 143.806   5.603  -0.138
  418   2HB   GLU 134          1HB       GLU 134 144.647   4.239   0.586
  419   1HG   GLU 134          2HG       GLU 134 144.230   3.047  -1.639
  420   2HG   GLU 134          1HG       GLU 134 143.846   4.648  -2.270
  421    H    GLU 135           H        GLU 135 142.583   3.879   2.772
  422    HA   GLU 135           HA       GLU 135 143.722   1.251   3.087
  423   1HB   GLU 135          2HB       GLU 135 143.014   3.516   4.867
  424   2HB   GLU 135          1HB       GLU 135 143.002   1.914   5.594
  425   1HG   GLU 135          2HG       GLU 135 145.369   1.993   4.153
  426   2HG   GLU 135          1HG       GLU 135 145.230   3.600   4.865
  427    H    LEU 136           H        LEU 136 140.554   2.705   3.224
  428    HA   LEU 136           HA       LEU 136 139.194   0.697   4.637
  429   1HB   LEU 136          2HB       LEU 136 138.540   3.082   3.256
  430   2HB   LEU 136          1HB       LEU 136 137.503   1.821   2.615
  431    HG   LEU 136           HG       LEU 136 137.212   1.353   5.257
  432   1HD1  LEU 136          1HD1      LEU 136 137.476   3.145   6.599
  433   2HD1  LEU 136          2HD1      LEU 136 137.065   4.294   5.326
  434   3HD1  LEU 136          3HD1      LEU 136 138.684   3.596   5.393
  435   1HD2  LEU 136          1HD2      LEU 136 135.207   3.046   4.971
  436   2HD2  LEU 136          2HD2      LEU 136 135.255   1.518   4.093
  437   3HD2  LEU 136          3HD2      LEU 136 135.730   3.012   3.287
  438    H    MET 137           H        MET 137 140.222   0.914   1.307
  439    HA   MET 137           HA       MET 137 138.582  -1.020   0.147
  440   1HB   MET 137          2HB       MET 137 140.437   0.585  -0.848
  441   2HB   MET 137          1HB       MET 137 141.447  -0.843  -0.671
  442   1HG   MET 137          2HG       MET 137 140.688  -1.047  -2.829
  443   2HG   MET 137          1HG       MET 137 139.544  -2.049  -1.940
  444   1HE   MET 137          1HE       MET 137 138.277  -0.779  -5.006
  445   2HE   MET 137          2HE       MET 137 136.842  -1.132  -4.044
  446   3HE   MET 137          3HE       MET 137 138.281  -2.137  -3.879
  447    H    LYS 138           H        LYS 138 141.768  -1.397   1.678
  448    HA   LYS 138           HA       LYS 138 142.023  -4.155   1.302
  449   1HB   LYS 138          2HB       LYS 138 143.404  -2.088   2.724
  450   2HB   LYS 138          1HB       LYS 138 143.240  -3.488   3.776
  451   1HG   LYS 138          2HG       LYS 138 144.358  -4.892   2.213
  452   2HG   LYS 138          1HG       LYS 138 144.329  -3.632   0.977
  453   1HD   LYS 138          2HD       LYS 138 145.622  -2.944   3.548
  454   2HD   LYS 138          1HD       LYS 138 146.461  -4.115   2.528
  455   1HE   LYS 138          2HE       LYS 138 145.727  -2.180   0.731
  456   2HE   LYS 138          1HE       LYS 138 146.086  -1.237   2.178
  457   1HZ   LYS 138          1HZ       LYS 138 148.267  -1.733   2.063
  458   2HZ   LYS 138          2HZ       LYS 138 147.932  -1.988   0.426
  459   3HZ   LYS 138          3HZ       LYS 138 148.012  -3.302   1.487
  460    H    ASP 139           H        ASP 139 140.129  -2.341   3.576
  461    HA   ASP 139           HA       ASP 139 139.575  -4.749   5.150
  462   1HB   ASP 139          2HB       ASP 139 138.821  -1.861   5.636
  463   2HB   ASP 139          1HB       ASP 139 138.428  -3.200   6.710
  464    H    GLY 140           H        GLY 140 138.459  -3.752   2.355
  465   1HA   GLY 140          2HA       GLY 140 135.650  -4.351   3.034
  466   2HA   GLY 140          1HA       GLY 140 136.095  -3.196   1.787
  467    H    ASP 141           H        ASP 141 138.275  -4.783   0.732
  468    HA   ASP 141           HA       ASP 141 136.740  -6.456  -1.025
  469   1HB   ASP 141          2HB       ASP 141 139.351  -5.224  -1.024
  470   2HB   ASP 141          1HB       ASP 141 139.478  -6.918  -1.488
  471    H    LYS 142           H        LYS 142 135.981  -8.267  -0.059
  472    HA   LYS 142           HA       LYS 142 137.622  -9.847   1.705
  473   1HB   LYS 142          2HB       LYS 142 134.874 -10.330   0.545
  474   2HB   LYS 142          1HB       LYS 142 135.655 -11.389   1.711
  475   1HG   LYS 142          2HG       LYS 142 135.070  -8.482   2.219
  476   2HG   LYS 142          1HG       LYS 142 134.001  -9.805   2.688
  477   1HD   LYS 142          2HD       LYS 142 136.814 -10.082   3.522
  478   2HD   LYS 142          1HD       LYS 142 135.918  -8.768   4.286
  479   1HE   LYS 142          2HE       LYS 142 134.106 -10.498   4.752
  480   2HE   LYS 142          1HE       LYS 142 135.310 -11.711   4.316
  481   1HZ   LYS 142          1HZ       LYS 142 136.765 -10.646   6.050
  482   2HZ   LYS 142          2HZ       LYS 142 135.415 -11.478   6.640
  483   3HZ   LYS 142          3HZ       LYS 142 135.401  -9.787   6.566
  484    H    ASN 143           H        ASN 143 136.526 -10.006  -1.633
  485    HA   ASN 143           HA       ASN 143 137.675 -12.630  -2.044
  486   1HB   ASN 143          2HB       ASN 143 136.993 -12.218  -4.438
  487   2HB   ASN 143          1HB       ASN 143 135.676 -12.168  -3.271
  488   1HD2  ASN 143          1HD2      ASN 143 134.908 -11.052  -5.389
  489   2HD2  ASN 143          2HD2      ASN 143 135.027  -9.329  -5.380
  490    H    ASN 144           H        ASN 144 138.908  -9.545  -1.876
  491    HA   ASN 144           HA       ASN 144 140.795  -8.511  -2.609
  492   1HB   ASN 144          2HB       ASN 144 141.490 -11.319  -2.038
  493   2HB   ASN 144          1HB       ASN 144 142.671 -10.443  -3.009
  494   1HD2  ASN 144          1HD2      ASN 144 144.128 -10.637  -1.255
  495   2HD2  ASN 144          2HD2      ASN 144 144.011  -9.586   0.113
  496    H    ASP 145           H        ASP 145 138.899  -9.384  -4.700
  497    HA   ASP 145           HA       ASP 145 140.434 -10.248  -6.952
  498   1HB   ASP 145          2HB       ASP 145 138.407  -9.760  -8.252
  499   2HB   ASP 145          1HB       ASP 145 138.025 -10.690  -6.806
  500    H    GLY 146           H        GLY 146 139.376  -7.162  -5.662
  501   1HA   GLY 146          2HA       GLY 146 141.211  -5.433  -6.263
  502   2HA   GLY 146          1HA       GLY 146 140.679  -5.768  -7.903
  503    H    ARG 147           H        ARG 147 137.907  -6.094  -6.351
  504    HA   ARG 147           HA       ARG 147 137.314  -3.252  -6.027
  505   1HB   ARG 147          2HB       ARG 147 135.665  -5.056  -7.806
  506   2HB   ARG 147          1HB       ARG 147 135.373  -3.353  -7.477
  507   1HG   ARG 147          2HG       ARG 147 137.967  -3.415  -8.444
  508   2HG   ARG 147          1HG       ARG 147 137.104  -4.593  -9.435
  509   1HD   ARG 147          2HD       ARG 147 135.334  -2.827  -9.773
  510   2HD   ARG 147          1HD       ARG 147 136.444  -1.684  -9.019
  511    HE   ARG 147           HE       ARG 147 137.687  -1.667 -10.946
  512   1HH1  ARG 147          1HH1      ARG 147 135.460  -4.351 -11.052
  513   2HH1  ARG 147          2HH1      ARG 147 135.793  -4.724 -12.710
  514   1HH2  ARG 147          1HH2      ARG 147 138.125  -2.154 -13.127
  515   2HH2  ARG 147          2HH2      ARG 147 137.305  -3.476 -13.889
  516    H    ILE 148           H        ILE 148 135.169  -2.892  -5.034
  517    HA   ILE 148           HA       ILE 148 134.510  -5.111  -3.218
  518    HB   ILE 148           HB       ILE 148 133.897  -2.185  -2.799
  519   1HG1  ILE 148          2HG1      ILE 148 136.077  -3.741  -1.417
  520   2HG1  ILE 148          1HG1      ILE 148 136.380  -2.838  -2.898
  521   1HG2  ILE 148          1HG2      ILE 148 134.042  -4.272  -0.663
  522   2HG2  ILE 148          2HG2      ILE 148 132.582  -4.098  -1.637
  523   3HG2  ILE 148          3HG2      ILE 148 133.168  -2.740  -0.676
  524   1HD1  ILE 148          1HD1      ILE 148 135.981  -0.788  -1.864
  525   2HD1  ILE 148          2HD1      ILE 148 136.901  -1.709  -0.674
  526   3HD1  ILE 148          3HD1      ILE 148 135.155  -1.537  -0.497
  527    H    ASP 149           H        ASP 149 132.601  -6.049  -3.361
  528    HA   ASP 149           HA       ASP 149 130.531  -4.788  -5.020
  529   1HB   ASP 149          2HB       ASP 149 129.545  -7.143  -5.014
  530   2HB   ASP 149          1HB       ASP 149 131.057  -6.926  -5.893
  531    H    TYR 150           H        TYR 150 128.238  -5.737  -4.276
  532    HA   TYR 150           HA       TYR 150 127.736  -4.510  -1.752
  533   1HB   TYR 150          2HB       TYR 150 126.083  -4.401  -3.542
  534   2HB   TYR 150          1HB       TYR 150 125.926  -6.154  -3.534
  535    HD1  TYR 150           HD1      TYR 150 125.926  -3.591  -0.807
  536    HD2  TYR 150           HD2      TYR 150 123.839  -6.745  -2.755
  537    HE1  TYR 150           HE1      TYR 150 124.124  -3.418   0.858
  538    HE2  TYR 150           HE2      TYR 150 122.030  -6.581  -1.096
  539    HH   TYR 150           HH       TYR 150 122.010  -5.639   1.517
  540    H    ASP 151           H        ASP 151 128.540  -7.701  -2.701
  541    HA   ASP 151           HA       ASP 151 127.290  -9.096  -0.562
  542   1HB   ASP 151          2HB       ASP 151 129.461  -9.755  -2.525
  543   2HB   ASP 151          1HB       ASP 151 129.139 -10.836  -1.172
  544    H    GLU 152           H        GLU 152 130.734  -8.324  -1.111
  545    HA   GLU 152           HA       GLU 152 131.502  -9.000   1.523
  546   1HB   GLU 152          2HB       GLU 152 133.651  -7.913   0.953
  547   2HB   GLU 152          1HB       GLU 152 133.121  -9.078  -0.252
  548   1HG   GLU 152          2HG       GLU 152 132.080  -6.930  -1.364
  549   2HG   GLU 152          1HG       GLU 152 133.337  -6.128  -0.424
  550    H    PHE 153           H        PHE 153 130.595  -5.930   0.022
  551    HA   PHE 153           HA       PHE 153 131.452  -4.234   2.083
  552   1HB   PHE 153          2HB       PHE 153 130.143  -3.891  -0.331
  553   2HB   PHE 153          1HB       PHE 153 128.956  -3.356   0.851
  554    HD1  PHE 153           HD1      PHE 153 130.680  -1.825  -1.317
  555    HD2  PHE 153           HD2      PHE 153 130.911  -2.289   2.907
  556    HE1  PHE 153           HE1      PHE 153 131.841   0.338  -1.145
  557    HE2  PHE 153           HE2      PHE 153 132.070  -0.127   3.086
  558    HZ   PHE 153           HZ       PHE 153 132.537   1.190   1.058
  559    H    LEU 154           H        LEU 154 128.740  -6.374   1.885
  560    HA   LEU 154           HA       LEU 154 127.015  -5.228   3.754
  561   1HB   LEU 154          2HB       LEU 154 127.109  -7.574   2.275
  562   2HB   LEU 154          1HB       LEU 154 127.132  -8.132   3.936
  563    HG   LEU 154           HG       LEU 154 124.856  -8.072   3.134
  564   1HD1  LEU 154          1HD1      LEU 154 125.004  -7.596   5.435
  565   2HD1  LEU 154          2HD1      LEU 154 123.899  -6.392   4.771
  566   3HD1  LEU 154          3HD1      LEU 154 125.567  -5.951   5.141
  567   1HD2  LEU 154          1HD2      LEU 154 123.790  -6.086   2.330
  568   2HD2  LEU 154          2HD2      LEU 154 125.260  -6.337   1.389
  569   3HD2  LEU 154          3HD2      LEU 154 125.226  -5.119   2.664
  570    H    GLU 155           H        GLU 155 129.929  -7.121   4.181
  571    HA   GLU 155           HA       GLU 155 129.542  -7.453   7.021
  572   1HB   GLU 155          2HB       GLU 155 131.696  -8.166   5.068
  573   2HB   GLU 155          1HB       GLU 155 132.063  -8.165   6.788
  574   1HG   GLU 155          2HG       GLU 155 129.760  -9.591   6.751
  575   2HG   GLU 155          1HG       GLU 155 130.462 -10.034   5.195
  576    H    PHE 156           H        PHE 156 131.199  -5.237   4.887
  577    HA   PHE 156           HA       PHE 156 133.019  -4.042   6.580
  578   1HB   PHE 156          2HB       PHE 156 132.145  -3.552   4.045
  579   2HB   PHE 156          1HB       PHE 156 131.502  -2.153   4.898
  580    HD1  PHE 156           HD1      PHE 156 133.762  -2.461   2.726
  581    HD2  PHE 156           HD2      PHE 156 133.745  -1.920   6.947
  582    HE1  PHE 156           HE1      PHE 156 135.966  -1.378   2.592
  583    HE2  PHE 156           HE2      PHE 156 135.949  -0.835   6.820
  584    HZ   PHE 156           HZ       PHE 156 137.062  -0.562   4.642
  585    H    MET 157           H        MET 157 129.558  -3.853   6.627
  586    HA   MET 157           HA       MET 157 129.489  -1.544   8.369
  587   1HB   MET 157          2HB       MET 157 127.647  -2.823   6.672
  588   2HB   MET 157          1HB       MET 157 127.018  -3.046   8.299
  589   1HG   MET 157          2HG       MET 157 126.059  -1.058   7.859
  590   2HG   MET 157          1HG       MET 157 127.609  -0.454   8.441
  591   1HE   MET 157          1HE       MET 157 129.559  -0.043   7.052
  592   2HE   MET 157          2HE       MET 157 129.489   0.747   5.478
  593   3HE   MET 157          3HE       MET 157 129.567  -1.013   5.579
  594    H    LYS 158           H        LYS 158 127.960  -4.723   8.792
  595    HA   LYS 158           HA       LYS 158 127.959  -4.599  11.599
  596   1HB   LYS 158          2HB       LYS 158 126.750  -6.184   9.762
  597   2HB   LYS 158          1HB       LYS 158 127.972  -7.288  10.377
  598   1HG   LYS 158          2HG       LYS 158 126.294  -5.776  12.315
  599   2HG   LYS 158          1HG       LYS 158 125.599  -7.161  11.469
  600   1HD   LYS 158          2HD       LYS 158 126.478  -8.316  13.199
  601   2HD   LYS 158          1HD       LYS 158 127.958  -8.209  12.246
  602   1HE   LYS 158          2HE       LYS 158 128.224  -7.586  14.651
  603   2HE   LYS 158          1HE       LYS 158 128.726  -6.339  13.512
  604   1HZ   LYS 158          1HZ       LYS 158 127.163  -5.839  15.575
  605   2HZ   LYS 158          2HZ       LYS 158 125.967  -6.234  14.446
  606   3HZ   LYS 158          3HZ       LYS 158 127.050  -4.975  14.124
  607    H    GLY 159           H        GLY 159 130.319  -3.877  11.640
  608   1HA   GLY 159          2HA       GLY 159 132.092  -4.832  13.065
  609   2HA   GLY 159          1HA       GLY 159 132.025  -6.258  12.040
  610    H    VAL 160           H        VAL 160 133.009  -2.899  12.228
  611    HA   VAL 160           HA       VAL 160 134.372  -3.055   9.658
  612    HB   VAL 160           HB       VAL 160 134.513  -0.716  11.542
  613   1HG1  VAL 160          1HG1      VAL 160 134.368   0.305   9.062
  614   2HG1  VAL 160          2HG1      VAL 160 135.111  -1.254   8.703
  615   3HG1  VAL 160          3HG1      VAL 160 135.885  -0.151   9.839
  616   1HG2  VAL 160          1HG2      VAL 160 132.159  -1.745  10.154
  617   2HG2  VAL 160          2HG2      VAL 160 132.523  -0.064   9.769
  618   3HG2  VAL 160          3HG2      VAL 160 132.281  -0.552  11.447
  619    H    GLU 161           H        GLU 161 135.291  -2.095  12.972
  620    HA   GLU 161           HA       GLU 161 138.077  -2.329  12.465
  621   1HB   GLU 161          2HB       GLU 161 136.716  -2.380  15.160
  622   2HB   GLU 161          1HB       GLU 161 138.375  -1.910  14.811
  623   1HG   GLU 161          2HG       GLU 161 137.320  -0.068  13.359
  624   2HG   GLU 161          1HG       GLU 161 135.840  -0.428  14.246
  Start of MODEL   15
    1   1H    MET  81          1HT       MET  81  88.276 -15.838   7.448
    2   2H    MET  81          2HT       MET  81  86.561 -15.891   7.453
    3   3H    MET  81          3HT       MET  81  87.378 -14.435   7.849
    4    HA   MET  81           HA       MET  81  87.080 -15.757   5.257
    5   1HB   MET  81          2HB       MET  81  86.264 -13.568   4.610
    6   2HB   MET  81          1HB       MET  81  85.413 -14.104   6.051
    7   1HG   MET  81          2HG       MET  81  87.622 -12.670   6.981
    8   2HG   MET  81          1HG       MET  81  86.992 -11.741   5.623
    9   1HE   MET  81          1HE       MET  81  84.435 -12.968   9.265
   10   2HE   MET  81          2HE       MET  81  86.118 -13.444   9.046
   11   3HE   MET  81          3HE       MET  81  84.872 -14.088   7.976
   12    H    VAL  82           H        VAL  82  89.218 -13.834   7.231
   13    HA   VAL  82           HA       VAL  82  91.159 -13.813   5.022
   14    HB   VAL  82           HB       VAL  82  90.833 -11.531   6.969
   15   1HG1  VAL  82          1HG1      VAL  82  92.428 -11.764   4.420
   16   2HG1  VAL  82          2HG1      VAL  82  93.088 -11.840   6.054
   17   3HG1  VAL  82          3HG1      VAL  82  92.343 -10.351   5.473
   18   1HG2  VAL  82          1HG2      VAL  82  89.514 -12.084   4.388
   19   2HG2  VAL  82          2HG2      VAL  82  90.157 -10.456   4.598
   20   3HG2  VAL  82          3HG2      VAL  82  88.982 -11.094   5.748
   21    H    ARG  83           H        ARG  83  93.329 -14.012   5.615
   22    HA   ARG  83           HA       ARG  83  94.267 -13.994   8.276
   23   1HB   ARG  83          2HB       ARG  83  92.790 -16.218   7.868
   24   2HB   ARG  83          1HB       ARG  83  94.358 -16.796   7.320
   25   1HG   ARG  83          2HG       ARG  83  95.242 -16.782   9.397
   26   2HG   ARG  83          1HG       ARG  83  94.327 -15.358   9.896
   27   1HD   ARG  83          2HD       ARG  83  93.375 -17.038  11.172
   28   2HD   ARG  83          1HD       ARG  83  92.280 -16.941   9.793
   29    HE   ARG  83           HE       ARG  83  94.289 -18.849   9.279
   30   1HH1  ARG  83          1HH1      ARG  83  91.445 -18.378  11.246
   31   2HH1  ARG  83          2HH1      ARG  83  91.079 -20.068  11.343
   32   1HH2  ARG  83          1HH2      ARG  83  93.810 -21.072   9.405
   33   2HH2  ARG  83          2HH2      ARG  83  92.422 -21.597  10.299
   34    H    CYS  84           H        CYS  84  96.474 -14.046   8.348
   35    HA   CYS  84           HA       CYS  84  98.617 -13.945   7.592
   36   1HB   CYS  84          2HB       CYS  84  97.776 -16.418   6.942
   37   2HB   CYS  84          1HB       CYS  84  98.125 -15.802   5.331
   38    HG   CYS  84           HG       CYS  84 100.313 -16.828   6.097
   39    H    MET  85           H        MET  85  99.990 -13.358   5.686
   40    HA   MET  85           HA       MET  85  98.448 -11.944   3.619
   41   1HB   MET  85          2HB       MET  85 100.150 -10.802   5.656
   42   2HB   MET  85          1HB       MET  85 100.780 -10.435   4.056
   43   1HG   MET  85          2HG       MET  85  97.882 -10.036   4.496
   44   2HG   MET  85          1HG       MET  85  98.989  -8.909   5.279
   45   1HE   MET  85          1HE       MET  85  98.616 -10.234   1.137
   46   2HE   MET  85          2HE       MET  85  97.339  -9.025   1.279
   47   3HE   MET  85          3HE       MET  85  97.414 -10.367   2.421
   48    H    LYS  86           H        LYS  86  99.799 -14.512   3.549
   49    HA   LYS  86           HA       LYS  86 101.036 -15.714   2.064
   50   1HB   LYS  86          2HB       LYS  86 100.427 -13.296   0.677
   51   2HB   LYS  86          1HB       LYS  86 102.090 -13.732   0.307
   52   1HG   LYS  86          2HG       LYS  86 101.491 -15.541  -0.888
   53   2HG   LYS  86          1HG       LYS  86 100.138 -15.932   0.176
   54   1HD   LYS  86          2HD       LYS  86  99.266 -15.305  -1.972
   55   2HD   LYS  86          1HD       LYS  86  98.885 -14.027  -0.818
   56   1HE   LYS  86          2HE       LYS  86 101.295 -13.197  -1.774
   57   2HE   LYS  86          1HE       LYS  86 100.604 -13.980  -3.196
   58   1HZ   LYS  86          1HZ       LYS  86  98.669 -12.349  -1.917
   59   2HZ   LYS  86          2HZ       LYS  86  99.257 -12.263  -3.500
   60   3HZ   LYS  86          3HZ       LYS  86 100.058 -11.443  -2.257
   61    H    ASP  87           H        ASP  87 102.745 -12.582   2.092
   62    HA   ASP  87           HA       ASP  87 105.060 -13.966   3.276
   63   1HB   ASP  87          2HB       ASP  87 105.009 -13.077   0.707
   64   2HB   ASP  87          1HB       ASP  87 105.640 -11.655   1.533
   65    H    ASP  88           H        ASP  88 106.704 -11.705   3.493
   66    HA   ASP  88           HA       ASP  88 105.181  -9.955   5.305
   67   1HB   ASP  88          2HB       ASP  88 107.086  -9.947   6.856
   68   2HB   ASP  88          1HB       ASP  88 106.453 -11.576   6.637
   69    H    SER  89           H        SER  89 105.566  -7.820   5.112
   70    HA   SER  89           HA       SER  89 107.805  -6.988   3.387
   71   1HB   SER  89          2HB       SER  89 104.943  -6.455   3.149
   72   2HB   SER  89          1HB       SER  89 105.909  -4.980   3.143
   73    HG   SER  89           HG       SER  89 105.521  -6.173   1.062
   74    H    LYS  90           H        LYS  90 109.107  -6.596   5.221
   75    HA   LYS  90           HA       LYS  90 108.204  -4.665   7.189
   76   1HB   LYS  90          2HB       LYS  90 109.965  -6.784   7.276
   77   2HB   LYS  90          1HB       LYS  90 111.040  -5.394   7.240
   78   1HG   LYS  90          2HG       LYS  90 109.593  -4.463   9.135
   79   2HG   LYS  90          1HG       LYS  90 108.966  -6.108   9.279
   80   1HD   LYS  90          2HD       LYS  90 111.660  -6.541   9.187
   81   2HD   LYS  90          1HD       LYS  90 111.571  -5.006  10.053
   82   1HE   LYS  90          2HE       LYS  90 111.505  -6.742  11.681
   83   2HE   LYS  90          1HE       LYS  90 109.879  -6.067  11.570
   84   1HZ   LYS  90          1HZ       LYS  90 110.853  -8.621  10.422
   85   2HZ   LYS  90          2HZ       LYS  90 109.361  -7.938  10.020
   86   3HZ   LYS  90          3HZ       LYS  90 109.671  -8.409  11.614
   87    H    GLY  91           H        GLY  91 110.518  -3.267   7.745
   88   1HA   GLY  91          2HA       GLY  91 110.704  -1.547   5.360
   89   2HA   GLY  91          1HA       GLY  91 110.900  -0.998   7.016
   90    H    LYS  92           H        LYS  92 112.907  -0.715   7.725
   91    HA   LYS  92           HA       LYS  92 115.141  -1.139   6.058
   92   1HB   LYS  92          2HB       LYS  92 114.922   0.609   7.855
   93   2HB   LYS  92          1HB       LYS  92 115.186  -0.664   9.038
   94   1HG   LYS  92          2HG       LYS  92 117.385  -1.103   8.104
   95   2HG   LYS  92          1HG       LYS  92 117.120   0.130   6.871
   96   1HD   LYS  92          2HD       LYS  92 118.161   1.495   8.323
   97   2HD   LYS  92          1HD       LYS  92 116.601   1.528   9.147
   98   1HE   LYS  92          2HE       LYS  92 117.863   0.908  10.921
   99   2HE   LYS  92          1HE       LYS  92 117.628  -0.697  10.232
  100   1HZ   LYS  92          1HZ       LYS  92 119.788   0.090   8.905
  101   2HZ   LYS  92          2HZ       LYS  92 119.860  -0.745  10.374
  102   3HZ   LYS  92          3HZ       LYS  92 120.025   0.939  10.350
  103    H    THR  93           H        THR  93 115.400  -3.275   5.494
  104    HA   THR  93           HA       THR  93 115.954  -5.149   7.694
  105    HB   THR  93           HB       THR  93 115.028  -5.681   4.865
  106    HG1  THR  93           HG1      THR  93 113.143  -5.797   5.746
  107   1HG2  THR  93          1HG2      THR  93 114.733  -8.053   6.040
  108   2HG2  THR  93          2HG2      THR  93 116.193  -7.509   6.866
  109   3HG2  THR  93          3HG2      THR  93 116.163  -7.614   5.105
  110    H    GLU  94           H        GLU  94 116.898  -5.874   4.407
  111    HA   GLU  94           HA       GLU  94 119.707  -5.670   5.247
  112   1HB   GLU  94          2HB       GLU  94 118.190  -7.607   3.627
  113   2HB   GLU  94          1HB       GLU  94 119.759  -7.169   2.965
  114   1HG   GLU  94          2HG       GLU  94 120.787  -7.760   5.139
  115   2HG   GLU  94          1HG       GLU  94 119.208  -8.314   5.691
  116    H    GLU  95           H        GLU  95 118.023  -5.649   2.107
  117    HA   GLU  95           HA       GLU  95 119.783  -4.262   0.600
  118   1HB   GLU  95          2HB       GLU  95 116.968  -4.828   0.477
  119   2HB   GLU  95          1HB       GLU  95 117.269  -3.207  -0.135
  120   1HG   GLU  95          2HG       GLU  95 119.226  -4.988  -1.203
  121   2HG   GLU  95          1HG       GLU  95 117.618  -5.666  -1.456
  122    H    GLU  96           H        GLU  96 117.778  -2.952   3.117
  123    HA   GLU  96           HA       GLU  96 117.718  -0.263   2.508
  124   1HB   GLU  96          2HB       GLU  96 117.707   0.123   4.985
  125   2HB   GLU  96          1HB       GLU  96 116.537  -1.062   4.426
  126   1HG   GLU  96          2HG       GLU  96 117.429  -2.026   6.332
  127   2HG   GLU  96          1HG       GLU  96 118.310  -2.810   5.023
  128    H    LEU  97           H        LEU  97 120.436  -2.201   3.463
  129    HA   LEU  97           HA       LEU  97 122.101   0.133   3.990
  130   1HB   LEU  97          2HB       LEU  97 122.265  -2.749   4.524
  131   2HB   LEU  97          1HB       LEU  97 123.788  -2.025   4.046
  132    HG   LEU  97           HG       LEU  97 122.091  -0.973   6.306
  133   1HD1  LEU  97          1HD1      LEU  97 124.610  -2.406   6.863
  134   2HD1  LEU  97          2HD1      LEU  97 123.232  -3.396   6.385
  135   3HD1  LEU  97          3HD1      LEU  97 123.110  -2.337   7.790
  136   1HD2  LEU  97          1HD2      LEU  97 124.912  -0.436   5.398
  137   2HD2  LEU  97          2HD2      LEU  97 124.252   0.100   6.943
  138   3HD2  LEU  97          3HD2      LEU  97 123.562   0.697   5.434
  139    H    SER  98           H        SER  98 121.257  -1.870   1.372
  140    HA   SER  98           HA       SER  98 123.709  -1.678  -0.088
  141   1HB   SER  98          2HB       SER  98 121.894  -3.452  -0.382
  142   2HB   SER  98          1HB       SER  98 120.984  -2.227  -1.267
  143    HG   SER  98           HG       SER  98 123.649  -2.902  -1.936
  144    H    ASP  99           H        ASP  99 120.946   0.349   0.355
  145    HA   ASP  99           HA       ASP  99 120.892   1.830  -1.983
  146   1HB   ASP  99          2HB       ASP  99 120.017   2.211   0.785
  147   2HB   ASP  99          1HB       ASP  99 120.393   3.722  -0.038
  148    H    LEU 100           H        LEU 100 122.936   2.283   0.876
  149    HA   LEU 100           HA       LEU 100 124.232   4.612  -0.115
  150   1HB   LEU 100          2HB       LEU 100 125.430   2.764   1.922
  151   2HB   LEU 100          1HB       LEU 100 125.597   4.503   1.788
  152    HG   LEU 100           HG       LEU 100 124.188   4.418   3.568
  153   1HD1  LEU 100          1HD1      LEU 100 121.906   4.003   1.724
  154   2HD1  LEU 100          2HD1      LEU 100 123.001   5.345   1.395
  155   3HD1  LEU 100          3HD1      LEU 100 122.167   5.247   2.946
  156   1HD2  LEU 100          1HD2      LEU 100 122.361   2.276   2.780
  157   2HD2  LEU 100          2HD2      LEU 100 123.174   2.572   4.316
  158   3HD2  LEU 100          3HD2      LEU 100 124.032   1.761   3.008
  159    H    PHE 101           H        PHE 101 124.542   1.334  -0.928
  160    HA   PHE 101           HA       PHE 101 127.332   1.248  -1.459
  161   1HB   PHE 101          2HB       PHE 101 125.963  -0.791  -1.181
  162   2HB   PHE 101          1HB       PHE 101 125.118  -0.416  -2.677
  163    HD1  PHE 101           HD1      PHE 101 125.687  -2.302  -3.955
  164    HD2  PHE 101           HD2      PHE 101 128.743  -0.019  -2.071
  165    HE1  PHE 101           HE1      PHE 101 127.391  -3.540  -5.226
  166    HE2  PHE 101           HE2      PHE 101 130.452  -1.255  -3.337
  167    HZ   PHE 101           HZ       PHE 101 129.778  -3.016  -4.917
  168    H    ARG 102           H        ARG 102 124.496   1.824  -3.537
  169    HA   ARG 102           HA       ARG 102 125.939   2.150  -5.930
  170   1HB   ARG 102          2HB       ARG 102 123.918   3.126  -6.831
  171   2HB   ARG 102          1HB       ARG 102 123.491   1.761  -5.807
  172   1HG   ARG 102          2HG       ARG 102 122.033   3.118  -4.829
  173   2HG   ARG 102          1HG       ARG 102 123.420   3.905  -4.075
  174   1HD   ARG 102          2HD       ARG 102 122.439   5.721  -5.044
  175   2HD   ARG 102          1HD       ARG 102 123.476   5.208  -6.374
  176    HE   ARG 102           HE       ARG 102 121.067   3.896  -6.707
  177   1HH1  ARG 102          1HH1      ARG 102 122.188   7.199  -6.615
  178   2HH1  ARG 102          2HH1      ARG 102 120.955   7.779  -7.686
  179   1HH2  ARG 102          1HH2      ARG 102 119.445   4.656  -8.114
  180   2HH2  ARG 102          2HH2      ARG 102 119.398   6.336  -8.536
  181    H    MET 103           H        MET 103 125.208   4.332  -3.304
  182    HA   MET 103           HA       MET 103 125.726   6.777  -4.564
  183   1HB   MET 103          2HB       MET 103 126.173   5.960  -1.688
  184   2HB   MET 103          1HB       MET 103 126.207   7.617  -2.272
  185   1HG   MET 103          2HG       MET 103 123.781   6.208  -3.028
  186   2HG   MET 103          1HG       MET 103 124.019   6.280  -1.285
  187   1HE   MET 103          1HE       MET 103 121.370   9.003  -2.255
  188   2HE   MET 103          2HE       MET 103 121.620   7.258  -2.303
  189   3HE   MET 103          3HE       MET 103 121.878   8.227  -3.755
  190    H    PHE 104           H        PHE 104 127.881   4.400  -3.121
  191    HA   PHE 104           HA       PHE 104 130.222   6.034  -3.312
  192   1HB   PHE 104          2HB       PHE 104 129.650   3.190  -2.621
  193   2HB   PHE 104          1HB       PHE 104 131.296   3.619  -3.072
  194    HD1  PHE 104           HD1      PHE 104 132.534   3.562  -1.125
  195    HD2  PHE 104           HD2      PHE 104 128.757   5.523  -1.130
  196    HE1  PHE 104           HE1      PHE 104 132.951   4.365   1.163
  197    HE2  PHE 104           HE2      PHE 104 129.169   6.331   1.158
  198    HZ   PHE 104           HZ       PHE 104 131.268   5.751   2.307
  199    H    ASP 105           H        ASP 105 128.433   4.200  -5.560
  200    HA   ASP 105           HA       ASP 105 130.703   3.772  -7.336
  201   1HB   ASP 105          2HB       ASP 105 128.135   2.551  -6.976
  202   2HB   ASP 105          1HB       ASP 105 128.261   3.126  -8.635
  203    H    LYS 106           H        LYS 106 130.930   4.748  -9.348
  204    HA   LYS 106           HA       LYS 106 129.340   7.200  -9.708
  205   1HB   LYS 106          2HB       LYS 106 132.204   6.534 -10.268
  206   2HB   LYS 106          1HB       LYS 106 131.407   7.783 -11.217
  207   1HG   LYS 106          2HG       LYS 106 131.264   7.884  -8.240
  208   2HG   LYS 106          1HG       LYS 106 132.733   8.406  -9.068
  209   1HD   LYS 106          2HD       LYS 106 131.757  10.264  -9.902
  210   2HD   LYS 106          1HD       LYS 106 130.211   9.457 -10.171
  211   1HE   LYS 106          2HE       LYS 106 131.236  10.262  -7.454
  212   2HE   LYS 106          1HE       LYS 106 130.176  11.270  -8.439
  213   1HZ   LYS 106          1HZ       LYS 106 129.298   8.533  -8.007
  214   2HZ   LYS 106          2HZ       LYS 106 128.403   9.968  -8.021
  215   3HZ   LYS 106          3HZ       LYS 106 129.285   9.534  -6.643
  216    H    ASN 107           H        ASN 107 130.663   4.374 -11.334
  217    HA   ASN 107           HA       ASN 107 129.255   5.119 -13.797
  218   1HB   ASN 107          2HB       ASN 107 130.558   3.288 -14.842
  219   2HB   ASN 107          1HB       ASN 107 131.584   4.509 -14.097
  220   1HD2  ASN 107          1HD2      ASN 107 131.786   1.520 -14.704
  221   2HD2  ASN 107          2HD2      ASN 107 132.395   0.852 -13.233
  222    H    ALA 108           H        ALA 108 128.453   3.580 -11.064
  223    HA   ALA 108           HA       ALA 108 127.004   1.922 -10.460
  224   1HB   ALA 108          1HB       ALA 108 125.096   1.699 -12.280
  225   2HB   ALA 108          2HB       ALA 108 125.861   3.162 -12.905
  226   3HB   ALA 108          3HB       ALA 108 125.240   3.126 -11.254
  227    H    ASP 109           H        ASP 109 129.101   0.598 -11.107
  228    HA   ASP 109           HA       ASP 109 128.388  -1.364 -13.176
  229   1HB   ASP 109          2HB       ASP 109 130.765  -2.022 -13.118
  230   2HB   ASP 109          1HB       ASP 109 130.565  -0.313 -13.492
  231    H    GLY 110           H        GLY 110 128.314  -0.954  -9.850
  232   1HA   GLY 110          2HA       GLY 110 127.386  -2.619  -8.425
  233   2HA   GLY 110          1HA       GLY 110 128.047  -3.854  -9.487
  234    H    TYR 111           H        TYR 111 130.613  -2.089  -9.421
  235    HA   TYR 111           HA       TYR 111 131.552  -2.940  -6.767
  236   1HB   TYR 111          2HB       TYR 111 133.188  -3.178  -9.297
  237   2HB   TYR 111          1HB       TYR 111 133.602  -3.779  -7.695
  238    HD1  TYR 111           HD1      TYR 111 132.270  -5.684  -6.731
  239    HD2  TYR 111           HD2      TYR 111 131.908  -4.481 -10.795
  240    HE1  TYR 111           HE1      TYR 111 131.246  -7.853  -7.275
  241    HE2  TYR 111           HE2      TYR 111 130.881  -6.646 -11.351
  242    HH   TYR 111           HH       TYR 111 129.592  -8.447 -10.102
  243    H    ILE 112           H        ILE 112 133.441  -1.783  -5.992
  244    HA   ILE 112           HA       ILE 112 133.680   0.900  -7.193
  245    HB   ILE 112           HB       ILE 112 134.010   0.226  -4.269
  246   1HG1  ILE 112          2HG1      ILE 112 131.722   1.817  -5.377
  247   2HG1  ILE 112          1HG1      ILE 112 131.641   0.058  -5.382
  248   1HG2  ILE 112          1HG2      ILE 112 134.389   2.649  -5.903
  249   2HG2  ILE 112          2HG2      ILE 112 135.157   2.165  -4.390
  250   3HG2  ILE 112          3HG2      ILE 112 133.543   2.876  -4.372
  251   1HD1  ILE 112          1HD1      ILE 112 131.935   0.027  -2.971
  252   2HD1  ILE 112          2HD1      ILE 112 130.545   1.009  -3.429
  253   3HD1  ILE 112          3HD1      ILE 112 132.056   1.785  -2.955
  254    H    ASP 113           H        ASP 113 135.685   1.735  -7.513
  255    HA   ASP 113           HA       ASP 113 137.963   0.010  -6.794
  256   1HB   ASP 113          2HB       ASP 113 139.103   0.954  -8.796
  257   2HB   ASP 113          1HB       ASP 113 137.653   0.038  -9.193
  258    H    LEU 114           H        LEU 114 140.081   1.542  -7.170
  259    HA   LEU 114           HA       LEU 114 139.971   3.374  -4.988
  260   1HB   LEU 114          2HB       LEU 114 142.222   2.973  -6.952
  261   2HB   LEU 114          1HB       LEU 114 142.333   3.682  -5.352
  262    HG   LEU 114           HG       LEU 114 141.447   0.838  -5.727
  263   1HD1  LEU 114          1HD1      LEU 114 144.284   1.795  -5.387
  264   2HD1  LEU 114          2HD1      LEU 114 143.607   1.109  -6.864
  265   3HD1  LEU 114          3HD1      LEU 114 143.737   0.118  -5.411
  266   1HD2  LEU 114          1HD2      LEU 114 141.014   1.541  -3.549
  267   2HD2  LEU 114          2HD2      LEU 114 142.484   2.512  -3.468
  268   3HD2  LEU 114          3HD2      LEU 114 142.586   0.751  -3.423
  269    H    GLU 115           H        GLU 115 139.706   3.652  -8.428
  270    HA   GLU 115           HA       GLU 115 140.401   6.415  -8.608
  271   1HB   GLU 115          2HB       GLU 115 140.416   4.689 -10.488
  272   2HB   GLU 115          1HB       GLU 115 138.671   4.898 -10.554
  273   1HG   GLU 115          2HG       GLU 115 139.447   7.466 -10.687
  274   2HG   GLU 115          1HG       GLU 115 140.834   6.685 -11.447
  275    H    GLU 116           H        GLU 116 137.383   4.632  -8.208
  276    HA   GLU 116           HA       GLU 116 135.767   7.016  -8.414
  277   1HB   GLU 116          2HB       GLU 116 135.278   4.114  -8.072
  278   2HB   GLU 116          1HB       GLU 116 134.062   5.192  -7.402
  279   1HG   GLU 116          2HG       GLU 116 133.211   4.933  -9.482
  280   2HG   GLU 116          1HG       GLU 116 134.262   6.317  -9.782
  281    H    LEU 117           H        LEU 117 136.725   4.778  -5.834
  282    HA   LEU 117           HA       LEU 117 135.338   5.843  -3.710
  283   1HB   LEU 117          2HB       LEU 117 136.776   3.792  -3.703
  284   2HB   LEU 117          1HB       LEU 117 138.177   4.838  -3.575
  285    HG   LEU 117           HG       LEU 117 137.374   5.674  -1.417
  286   1HD1  LEU 117          1HD1      LEU 117 135.468   4.430  -0.341
  287   2HD1  LEU 117          2HD1      LEU 117 135.074   3.809  -1.942
  288   3HD1  LEU 117          3HD1      LEU 117 135.021   5.544  -1.633
  289   1HD2  LEU 117          1HD2      LEU 117 138.778   3.983  -0.898
  290   2HD2  LEU 117          2HD2      LEU 117 137.941   2.825  -1.933
  291   3HD2  LEU 117          3HD2      LEU 117 137.295   3.212  -0.338
  292    H    LYS 118           H        LYS 118 138.067   7.192  -5.377
  293    HA   LYS 118           HA       LYS 118 138.691   9.084  -3.285
  294   1HB   LYS 118          2HB       LYS 118 140.353   9.956  -4.829
  295   2HB   LYS 118          1HB       LYS 118 140.455   8.203  -4.757
  296   1HG   LYS 118          2HG       LYS 118 139.961   7.968  -6.923
  297   2HG   LYS 118          1HG       LYS 118 138.695   9.194  -6.867
  298   1HD   LYS 118          2HD       LYS 118 140.074  10.826  -7.571
  299   2HD   LYS 118          1HD       LYS 118 141.424  10.240  -6.597
  300   1HE   LYS 118          2HE       LYS 118 140.523   8.789  -9.062
  301   2HE   LYS 118          1HE       LYS 118 141.641  10.148  -9.155
  302   1HZ   LYS 118          1HZ       LYS 118 142.051   7.483  -7.999
  303   2HZ   LYS 118          2HZ       LYS 118 142.904   8.788  -7.346
  304   3HZ   LYS 118          3HZ       LYS 118 143.080   8.399  -8.982
  305    H    ILE 119           H        ILE 119 136.711   8.984  -6.141
  306    HA   ILE 119           HA       ILE 119 136.449  11.786  -6.520
  307    HB   ILE 119           HB       ILE 119 134.516   9.608  -7.324
  308   1HG1  ILE 119          2HG1      ILE 119 136.604  10.887  -9.079
  309   2HG1  ILE 119          1HG1      ILE 119 136.963   9.455  -8.119
  310   1HG2  ILE 119          1HG2      ILE 119 134.639  12.516  -7.801
  311   2HG2  ILE 119          2HG2      ILE 119 133.254  11.424  -7.775
  312   3HG2  ILE 119          3HG2      ILE 119 134.278  11.517  -9.209
  313   1HD1  ILE 119          1HD1      ILE 119 134.676   8.698  -9.363
  314   2HD1  ILE 119          2HD1      ILE 119 136.305   8.352  -9.944
  315   3HD1  ILE 119          3HD1      ILE 119 135.417   9.735 -10.582
  316    H    MET 120           H        MET 120 134.231   9.398  -5.068
  317    HA   MET 120           HA       MET 120 132.305  11.221  -4.196
  318   1HB   MET 120          2HB       MET 120 131.665   9.413  -2.570
  319   2HB   MET 120          1HB       MET 120 131.766   8.898  -4.248
  320   1HG   MET 120          2HG       MET 120 133.484   7.505  -3.859
  321   2HG   MET 120          1HG       MET 120 134.229   8.580  -2.676
  322   1HE   MET 120          1HE       MET 120 134.767   7.219  -0.556
  323   2HE   MET 120          2HE       MET 120 133.432   7.095   0.589
  324   3HE   MET 120          3HE       MET 120 133.768   8.629  -0.211
  325    H    LEU 121           H        LEU 121 135.448  10.574  -2.960
  326    HA   LEU 121           HA       LEU 121 134.885  11.567  -0.305
  327   1HB   LEU 121          2HB       LEU 121 137.317  10.572  -1.730
  328   2HB   LEU 121          1HB       LEU 121 137.505  11.495  -0.251
  329    HG   LEU 121           HG       LEU 121 135.981   8.906  -0.536
  330   1HD1  LEU 121          1HD1      LEU 121 138.273   9.119   1.288
  331   2HD1  LEU 121          2HD1      LEU 121 138.667   9.203  -0.430
  332   3HD1  LEU 121          3HD1      LEU 121 137.794   7.810   0.206
  333   1HD2  LEU 121          1HD2      LEU 121 136.247   9.243   2.103
  334   2HD2  LEU 121          2HD2      LEU 121 134.841   9.807   1.200
  335   3HD2  LEU 121          3HD2      LEU 121 136.135  10.933   1.611
  336    H    GLN 122           H        GLN 122 136.569  12.729  -3.203
  337    HA   GLN 122           HA       GLN 122 137.475  15.154  -2.087
  338   1HB   GLN 122          2HB       GLN 122 137.624  15.906  -4.488
  339   2HB   GLN 122          1HB       GLN 122 138.489  14.424  -4.108
  340   1HG   GLN 122          2HG       GLN 122 136.776  13.096  -5.114
  341   2HG   GLN 122          1HG       GLN 122 135.752  14.512  -5.344
  342   1HE2  GLN 122          1HE2      GLN 122 136.947  16.320  -6.588
  343   2HE2  GLN 122          2HE2      GLN 122 137.765  15.806  -8.022
  344    H    ALA 123           H        ALA 123 134.538  14.291  -3.833
  345    HA   ALA 123           HA       ALA 123 133.413  16.801  -4.169
  346   1HB   ALA 123          1HB       ALA 123 131.562  15.703  -4.845
  347   2HB   ALA 123          2HB       ALA 123 131.538  14.651  -3.429
  348   3HB   ALA 123          3HB       ALA 123 132.629  14.299  -4.770
  349    H    THR 124           H        THR 124 133.635  14.828  -1.290
  350    HA   THR 124           HA       THR 124 131.655  16.000   0.280
  351    HB   THR 124           HB       THR 124 132.762  15.081   2.166
  352    HG1  THR 124           HG1      THR 124 134.915  14.692   2.244
  353   1HG2  THR 124          1HG2      THR 124 133.999  13.019   0.705
  354   2HG2  THR 124          2HG2      THR 124 132.580  13.529  -0.211
  355   3HG2  THR 124          3HG2      THR 124 132.410  13.018   1.469
  356    H    GLY 125           H        GLY 125 132.730  17.089   2.519
  357   1HA   GLY 125          2HA       GLY 125 133.611  19.700   1.518
  358   2HA   GLY 125          1HA       GLY 125 132.891  19.390   3.089
  359    H    GLU 126           H        GLU 126 134.879  16.969   3.125
  360    HA   GLU 126           HA       GLU 126 137.065  18.537   4.290
  361   1HB   GLU 126          2HB       GLU 126 137.677  16.275   5.319
  362   2HB   GLU 126          1HB       GLU 126 136.222  17.064   5.910
  363   1HG   GLU 126          2HG       GLU 126 134.832  15.617   4.600
  364   2HG   GLU 126          1HG       GLU 126 136.241  14.911   3.811
  365    H    THR 127           H        THR 127 139.205  17.074   4.260
  366    HA   THR 127           HA       THR 127 139.648  16.308   1.447
  367    HB   THR 127           HB       THR 127 142.113  17.035   2.138
  368    HG1  THR 127           HG1      THR 127 142.111  18.722   3.566
  369   1HG2  THR 127          1HG2      THR 127 140.759  18.020   0.304
  370   2HG2  THR 127          2HG2      THR 127 141.796  19.174   1.142
  371   3HG2  THR 127          3HG2      THR 127 140.066  19.135   1.481
  372    H    ILE 128           H        ILE 128 140.053  14.216   1.256
  373    HA   ILE 128           HA       ILE 128 141.269  12.785   3.517
  374    HB   ILE 128           HB       ILE 128 139.890  11.559   1.133
  375   1HG1  ILE 128          2HG1      ILE 128 138.340  13.028   2.383
  376   2HG1  ILE 128          1HG1      ILE 128 137.907  11.329   2.530
  377   1HG2  ILE 128          1HG2      ILE 128 140.589  10.454   3.850
  378   2HG2  ILE 128          2HG2      ILE 128 141.409  10.080   2.332
  379   3HG2  ILE 128          3HG2      ILE 128 139.731   9.589   2.574
  380   1HD1  ILE 128          1HD1      ILE 128 137.641  12.251   4.668
  381   2HD1  ILE 128          2HD1      ILE 128 139.180  13.107   4.580
  382   3HD1  ILE 128          3HD1      ILE 128 139.155  11.349   4.730
  383    H    THR 129           H        THR 129 143.090  11.537   3.271
  384    HA   THR 129           HA       THR 129 144.795  12.216   1.039
  385    HB   THR 129           HB       THR 129 146.437  10.719   2.314
  386    HG1  THR 129           HG1      THR 129 144.643   9.684   3.496
  387   1HG2  THR 129          1HG2      THR 129 145.542  12.779   4.225
  388   2HG2  THR 129          2HG2      THR 129 145.978  13.321   2.605
  389   3HG2  THR 129          3HG2      THR 129 147.148  12.438   3.584
  390    H    GLU 130           H        GLU 130 146.296  10.119   0.452
  391    HA   GLU 130           HA       GLU 130 144.513   8.439  -1.061
  392   1HB   GLU 130          2HB       GLU 130 147.528   8.430  -0.826
  393   2HB   GLU 130          1HB       GLU 130 146.604   7.455  -1.961
  394   1HG   GLU 130          2HG       GLU 130 145.737   9.513  -2.988
  395   2HG   GLU 130          1HG       GLU 130 146.726  10.461  -1.880
  396    H    ASP 131           H        ASP 131 146.816   8.002   1.596
  397    HA   ASP 131           HA       ASP 131 146.705   5.239   1.842
  398   1HB   ASP 131          2HB       ASP 131 147.332   7.490   3.679
  399   2HB   ASP 131          1HB       ASP 131 147.012   5.923   4.417
  400    H    ASP 132           H        ASP 132 144.574   7.700   3.238
  401    HA   ASP 132           HA       ASP 132 143.010   6.014   4.828
  402   1HB   ASP 132          2HB       ASP 132 142.593   8.692   3.569
  403   2HB   ASP 132          1HB       ASP 132 141.206   7.870   4.277
  404    H    ILE 133           H        ILE 133 142.847   6.763   1.402
  405    HA   ILE 133           HA       ILE 133 140.319   5.499   0.968
  406    HB   ILE 133           HB       ILE 133 142.455   6.069  -1.087
  407   1HG1  ILE 133          2HG1      ILE 133 140.134   7.870  -0.424
  408   2HG1  ILE 133          1HG1      ILE 133 141.686   8.035   0.392
  409   1HG2  ILE 133          1HG2      ILE 133 140.648   6.063  -2.678
  410   2HG2  ILE 133          2HG2      ILE 133 139.466   5.826  -1.390
  411   3HG2  ILE 133          3HG2      ILE 133 140.625   4.551  -1.770
  412   1HD1  ILE 133          1HD1      ILE 133 142.231   7.931  -2.364
  413   2HD1  ILE 133          2HD1      ILE 133 142.377   9.309  -1.272
  414   3HD1  ILE 133          3HD1      ILE 133 140.870   9.033  -2.148
  415    H    GLU 134           H        GLU 134 143.628   4.585  -0.023
  416    HA   GLU 134           HA       GLU 134 143.009   2.027  -0.932
  417   1HB   GLU 134          2HB       GLU 134 145.533   3.257   0.142
  418   2HB   GLU 134          1HB       GLU 134 145.485   1.565  -0.333
  419   1HG   GLU 134          2HG       GLU 134 145.372   2.041  -2.537
  420   2HG   GLU 134          1HG       GLU 134 144.440   3.516  -2.286
  421    H    GLU 135           H        GLU 135 143.568   3.211   2.306
  422    HA   GLU 135           HA       GLU 135 143.954   0.702   3.562
  423   1HB   GLU 135          2HB       GLU 135 143.264   3.457   4.487
  424   2HB   GLU 135          1HB       GLU 135 143.046   2.116   5.602
  425   1HG   GLU 135          2HG       GLU 135 145.633   2.153   4.230
  426   2HG   GLU 135          1HG       GLU 135 145.339   3.527   5.296
  427    H    LEU 136           H        LEU 136 141.121   2.533   2.650
  428    HA   LEU 136           HA       LEU 136 139.218   1.185   4.223
  429   1HB   LEU 136          2HB       LEU 136 139.223   3.078   2.035
  430   2HB   LEU 136          1HB       LEU 136 137.940   1.899   1.838
  431    HG   LEU 136           HG       LEU 136 137.347   2.471   4.297
  432   1HD1  LEU 136          1HD1      LEU 136 139.495   3.806   4.550
  433   2HD1  LEU 136          2HD1      LEU 136 138.010   4.566   5.125
  434   3HD1  LEU 136          3HD1      LEU 136 138.706   5.051   3.579
  435   1HD2  LEU 136          1HD2      LEU 136 136.012   4.437   3.511
  436   2HD2  LEU 136          2HD2      LEU 136 135.860   2.996   2.507
  437   3HD2  LEU 136          3HD2      LEU 136 136.877   4.335   1.978
  438    H    MET 137           H        MET 137 140.355   0.596   0.910
  439    HA   MET 137           HA       MET 137 138.673  -1.537   0.283
  440   1HB   MET 137          2HB       MET 137 141.513  -1.023  -0.619
  441   2HB   MET 137          1HB       MET 137 140.418  -2.178  -1.364
  442   1HG   MET 137          2HG       MET 137 139.020   0.238  -1.298
  443   2HG   MET 137          1HG       MET 137 140.662   0.652  -1.785
  444   1HE   MET 137          1HE       MET 137 137.503   0.081  -4.244
  445   2HE   MET 137          2HE       MET 137 137.446  -0.180  -2.500
  446   3HE   MET 137          3HE       MET 137 137.361  -1.555  -3.602
  447    H    LYS 138           H        LYS 138 141.917  -1.577   1.737
  448    HA   LYS 138           HA       LYS 138 142.270  -4.319   1.939
  449   1HB   LYS 138          2HB       LYS 138 143.264  -1.995   3.549
  450   2HB   LYS 138          1HB       LYS 138 143.626  -3.633   4.070
  451   1HG   LYS 138          2HG       LYS 138 144.783  -4.097   2.027
  452   2HG   LYS 138          1HG       LYS 138 144.279  -2.553   1.339
  453   1HD   LYS 138          2HD       LYS 138 146.589  -2.444   2.107
  454   2HD   LYS 138          1HD       LYS 138 145.562  -1.374   3.064
  455   1HE   LYS 138          2HE       LYS 138 145.464  -3.032   4.843
  456   2HE   LYS 138          1HE       LYS 138 146.437  -4.143   3.880
  457   1HZ   LYS 138          1HZ       LYS 138 147.324  -1.493   4.891
  458   2HZ   LYS 138          2HZ       LYS 138 148.259  -2.552   3.962
  459   3HZ   LYS 138          3HZ       LYS 138 147.780  -2.996   5.522
  460    H    ASP 139           H        ASP 139 140.186  -2.233   3.755
  461    HA   ASP 139           HA       ASP 139 139.716  -4.283   5.783
  462   1HB   ASP 139          2HB       ASP 139 139.190  -1.368   5.571
  463   2HB   ASP 139          1HB       ASP 139 138.052  -2.317   6.524
  464    H    GLY 140           H        GLY 140 138.430  -3.278   2.807
  465   1HA   GLY 140          2HA       GLY 140 135.884  -4.638   3.441
  466   2HA   GLY 140          1HA       GLY 140 135.977  -3.263   2.354
  467    H    ASP 141           H        ASP 141 138.624  -5.392   2.086
  468    HA   ASP 141           HA       ASP 141 137.409  -6.602  -0.311
  469   1HB   ASP 141          2HB       ASP 141 139.457  -4.939  -0.436
  470   2HB   ASP 141          1HB       ASP 141 140.375  -6.375   0.003
  471    H    LYS 142           H        LYS 142 136.648  -8.451   0.706
  472    HA   LYS 142           HA       LYS 142 138.422 -10.091   2.289
  473   1HB   LYS 142          2HB       LYS 142 135.715 -10.902   1.245
  474   2HB   LYS 142          1HB       LYS 142 136.553 -11.495   2.673
  475   1HG   LYS 142          2HG       LYS 142 135.559  -8.672   2.366
  476   2HG   LYS 142          1HG       LYS 142 134.643  -9.967   3.140
  477   1HD   LYS 142          2HD       LYS 142 137.207 -10.008   4.298
  478   2HD   LYS 142          1HD       LYS 142 136.720  -8.313   4.226
  479   1HE   LYS 142          2HE       LYS 142 135.104 -10.564   5.419
  480   2HE   LYS 142          1HE       LYS 142 136.033  -9.372   6.327
  481   1HZ   LYS 142          1HZ       LYS 142 134.615  -7.637   5.341
  482   2HZ   LYS 142          2HZ       LYS 142 133.737  -8.733   6.283
  483   3HZ   LYS 142          3HZ       LYS 142 133.681  -8.836   4.597
  484    H    ASN 143           H        ASN 143 137.006 -10.177  -0.948
  485    HA   ASN 143           HA       ASN 143 138.263 -12.720  -1.542
  486   1HB   ASN 143          2HB       ASN 143 137.243 -12.352  -3.817
  487   2HB   ASN 143          1HB       ASN 143 136.092 -12.409  -2.485
  488   1HD2  ASN 143          1HD2      ASN 143 134.614 -11.300  -3.838
  489   2HD2  ASN 143          2HD2      ASN 143 134.736  -9.591  -4.064
  490    H    ASN 144           H        ASN 144 139.267  -9.530  -1.531
  491    HA   ASN 144           HA       ASN 144 140.921  -8.349  -2.574
  492   1HB   ASN 144          2HB       ASN 144 142.041 -11.101  -2.162
  493   2HB   ASN 144          1HB       ASN 144 143.019  -9.855  -2.932
  494   1HD2  ASN 144          1HD2      ASN 144 143.827  -8.197  -1.730
  495   2HD2  ASN 144          2HD2      ASN 144 143.707  -8.121  -0.009
  496    H    ASP 145           H        ASP 145 138.977  -9.072  -4.423
  497    HA   ASP 145           HA       ASP 145 140.290 -10.179  -6.752
  498   1HB   ASP 145          2HB       ASP 145 138.100  -9.777  -7.863
  499   2HB   ASP 145          1HB       ASP 145 137.967 -10.748  -6.399
  500    H    GLY 146           H        GLY 146 140.561  -7.266  -5.348
  501   1HA   GLY 146          2HA       GLY 146 141.792  -5.510  -6.386
  502   2HA   GLY 146          1HA       GLY 146 141.094  -5.973  -7.929
  503    H    ARG 147           H        ARG 147 138.521  -6.109  -5.999
  504    HA   ARG 147           HA       ARG 147 137.973  -3.280  -5.737
  505   1HB   ARG 147          2HB       ARG 147 136.358  -5.004  -7.624
  506   2HB   ARG 147          1HB       ARG 147 135.945  -3.363  -7.144
  507   1HG   ARG 147          2HG       ARG 147 138.276  -2.759  -8.088
  508   2HG   ARG 147          1HG       ARG 147 138.156  -4.311  -8.916
  509   1HD   ARG 147          2HD       ARG 147 135.714  -2.785  -9.170
  510   2HD   ARG 147          1HD       ARG 147 137.103  -1.874  -9.756
  511    HE   ARG 147           HE       ARG 147 137.006  -4.574 -10.728
  512   1HH1  ARG 147          1HH1      ARG 147 135.901  -1.307 -11.258
  513   2HH1  ARG 147          2HH1      ARG 147 135.633  -1.540 -12.953
  514   1HH2  ARG 147          1HH2      ARG 147 136.653  -4.883 -12.957
  515   2HH2  ARG 147          2HH2      ARG 147 136.059  -3.569 -13.917
  516    H    ILE 148           H        ILE 148 135.728  -2.933  -4.837
  517    HA   ILE 148           HA       ILE 148 135.110  -5.136  -2.985
  518    HB   ILE 148           HB       ILE 148 134.688  -2.159  -2.697
  519   1HG1  ILE 148          2HG1      ILE 148 136.311  -4.103  -1.042
  520   2HG1  ILE 148          1HG1      ILE 148 136.979  -3.047  -2.282
  521   1HG2  ILE 148          1HG2      ILE 148 134.096  -3.310  -0.258
  522   2HG2  ILE 148          2HG2      ILE 148 133.302  -4.369  -1.423
  523   3HG2  ILE 148          3HG2      ILE 148 132.939  -2.646  -1.410
  524   1HD1  ILE 148          1HD1      ILE 148 135.398  -1.597  -0.333
  525   2HD1  ILE 148          2HD1      ILE 148 137.045  -1.315  -0.897
  526   3HD1  ILE 148          3HD1      ILE 148 136.743  -2.476   0.395
  527    H    ASP 149           H        ASP 149 133.207  -6.106  -3.075
  528    HA   ASP 149           HA       ASP 149 131.147  -4.985  -4.845
  529   1HB   ASP 149          2HB       ASP 149 130.237  -7.296  -4.905
  530   2HB   ASP 149          1HB       ASP 149 131.890  -7.196  -5.502
  531    H    TYR 150           H        TYR 150 128.852  -5.751  -4.165
  532    HA   TYR 150           HA       TYR 150 128.147  -4.417  -1.818
  533   1HB   TYR 150          2HB       TYR 150 126.538  -4.740  -3.591
  534   2HB   TYR 150          1HB       TYR 150 126.622  -6.489  -3.407
  535    HD1  TYR 150           HD1      TYR 150 126.174  -3.684  -0.970
  536    HD2  TYR 150           HD2      TYR 150 124.616  -7.289  -2.604
  537    HE1  TYR 150           HE1      TYR 150 124.312  -3.599   0.633
  538    HE2  TYR 150           HE2      TYR 150 122.749  -7.213  -1.006
  539    HH   TYR 150           HH       TYR 150 121.564  -5.629   0.369
  540    H    ASP 151           H        ASP 151 129.071  -7.736  -2.335
  541    HA   ASP 151           HA       ASP 151 127.992  -8.808   0.053
  542   1HB   ASP 151          2HB       ASP 151 129.895  -9.698  -2.029
  543   2HB   ASP 151          1HB       ASP 151 130.056 -10.475  -0.458
  544    H    GLU 152           H        GLU 152 131.376  -8.002  -0.749
  545    HA   GLU 152           HA       GLU 152 132.205  -8.259   1.974
  546   1HB   GLU 152          2HB       GLU 152 134.389  -7.490   1.163
  547   2HB   GLU 152          1HB       GLU 152 133.736  -8.784   0.168
  548   1HG   GLU 152          2HG       GLU 152 132.840  -6.841  -1.298
  549   2HG   GLU 152          1HG       GLU 152 134.071  -5.893  -0.467
  550    H    PHE 153           H        PHE 153 130.837  -5.680   0.176
  551    HA   PHE 153           HA       PHE 153 132.008  -3.638   1.881
  552   1HB   PHE 153          2HB       PHE 153 131.301  -3.530  -0.705
  553   2HB   PHE 153          1HB       PHE 153 129.813  -2.930   0.014
  554    HD1  PHE 153           HD1      PHE 153 129.864  -0.687  -0.655
  555    HD2  PHE 153           HD2      PHE 153 133.267  -2.380   1.255
  556    HE1  PHE 153           HE1      PHE 153 130.870   1.551  -0.471
  557    HE2  PHE 153           HE2      PHE 153 134.276  -0.146   1.449
  558    HZ   PHE 153           HZ       PHE 153 133.077   1.823   0.585
  559    H    LEU 154           H        LEU 154 128.870  -5.203   1.411
  560    HA   LEU 154           HA       LEU 154 127.323  -3.520   3.019
  561   1HB   LEU 154          2HB       LEU 154 125.736  -5.280   3.164
  562   2HB   LEU 154          1HB       LEU 154 126.455  -5.356   1.568
  563    HG   LEU 154           HG       LEU 154 128.021  -7.142   2.678
  564   1HD1  LEU 154          1HD1      LEU 154 125.813  -8.101   4.258
  565   2HD1  LEU 154          2HD1      LEU 154 126.372  -6.534   4.845
  566   3HD1  LEU 154          3HD1      LEU 154 127.503  -7.879   4.707
  567   1HD2  LEU 154          1HD2      LEU 154 126.058  -7.297   0.926
  568   2HD2  LEU 154          2HD2      LEU 154 125.249  -8.124   2.257
  569   3HD2  LEU 154          3HD2      LEU 154 126.777  -8.744   1.632
  570    H    GLU 155           H        GLU 155 129.261  -6.345   3.888
  571    HA   GLU 155           HA       GLU 155 128.594  -6.388   6.626
  572   1HB   GLU 155          2HB       GLU 155 130.576  -7.661   4.880
  573   2HB   GLU 155          1HB       GLU 155 131.147  -7.414   6.523
  574   1HG   GLU 155          2HG       GLU 155 128.896  -8.486   7.210
  575   2HG   GLU 155          1HG       GLU 155 128.866  -9.075   5.547
  576    H    PHE 156           H        PHE 156 130.838  -4.495   4.770
  577    HA   PHE 156           HA       PHE 156 132.632  -3.630   6.684
  578   1HB   PHE 156          2HB       PHE 156 132.208  -3.050   4.073
  579   2HB   PHE 156          1HB       PHE 156 131.640  -1.559   4.814
  580    HD1  PHE 156           HD1      PHE 156 134.158  -2.311   3.014
  581    HD2  PHE 156           HD2      PHE 156 133.550  -1.466   7.140
  582    HE1  PHE 156           HE1      PHE 156 136.476  -1.512   3.190
  583    HE2  PHE 156           HE2      PHE 156 135.868  -0.666   7.322
  584    HZ   PHE 156           HZ       PHE 156 137.333  -0.687   5.344
  585    H    MET 157           H        MET 157 129.348  -2.501   6.052
  586    HA   MET 157           HA       MET 157 129.580  -0.566   8.240
  587   1HB   MET 157          2HB       MET 157 127.875  -0.816   5.844
  588   2HB   MET 157          1HB       MET 157 127.059  -0.216   7.281
  589   1HG   MET 157          2HG       MET 157 128.137   1.751   7.239
  590   2HG   MET 157          1HG       MET 157 129.652   1.031   6.699
  591   1HE   MET 157          1HE       MET 157 129.472  -0.357   4.425
  592   2HE   MET 157          2HE       MET 157 130.333   1.070   3.844
  593   3HE   MET 157          3HE       MET 157 128.958   0.438   2.937
  594    H    LYS 158           H        LYS 158 128.807  -3.733   7.957
  595    HA   LYS 158           HA       LYS 158 126.585  -3.653   9.865
  596   1HB   LYS 158          2HB       LYS 158 127.051  -5.264   7.669
  597   2HB   LYS 158          1HB       LYS 158 127.518  -6.295   9.013
  598   1HG   LYS 158          2HG       LYS 158 124.914  -4.832   9.074
  599   2HG   LYS 158          1HG       LYS 158 125.079  -6.333   8.160
  600   1HD   LYS 158          2HD       LYS 158 125.059  -7.580  10.016
  601   2HD   LYS 158          1HD       LYS 158 126.207  -6.521  10.837
  602   1HE   LYS 158          2HE       LYS 158 124.586  -5.376  11.898
  603   2HE   LYS 158          1HE       LYS 158 123.512  -5.402  10.501
  604   1HZ   LYS 158          1HZ       LYS 158 123.922  -7.952  11.826
  605   2HZ   LYS 158          2HZ       LYS 158 122.506  -7.271  11.200
  606   3HZ   LYS 158          3HZ       LYS 158 123.072  -6.794  12.722
  607    H    GLY 159           H        GLY 159 128.943  -2.760  10.899
  608   1HA   GLY 159          2HA       GLY 159 129.743  -3.225  13.127
  609   2HA   GLY 159          1HA       GLY 159 129.664  -4.941  12.746
  610    H    VAL 160           H        VAL 160 131.760  -2.461  13.215
  611    HA   VAL 160           HA       VAL 160 133.821  -3.803  11.607
  612    HB   VAL 160           HB       VAL 160 134.318  -0.941  11.935
  613   1HG1  VAL 160          1HG1      VAL 160 134.145  -2.177   9.266
  614   2HG1  VAL 160          2HG1      VAL 160 135.290  -2.916  10.386
  615   3HG1  VAL 160          3HG1      VAL 160 135.426  -1.203   9.991
  616   1HG2  VAL 160          1HG2      VAL 160 131.934  -1.826  10.314
  617   2HG2  VAL 160          2HG2      VAL 160 132.743  -0.273  10.111
  618   3HG2  VAL 160          3HG2      VAL 160 131.958  -0.666  11.641
  619    H    GLU 161           H        GLU 161 133.282  -4.271  14.317
  620    HA   GLU 161           HA       GLU 161 135.173  -2.736  15.885
  621   1HB   GLU 161          2HB       GLU 161 134.446  -4.109  17.757
  622   2HB   GLU 161          1HB       GLU 161 133.050  -3.497  16.880
  623   1HG   GLU 161          2HG       GLU 161 132.352  -5.622  17.052
  624   2HG   GLU 161          1HG       GLU 161 133.374  -5.853  15.634
  Start of MODEL   16
    1   1H    MET  81          1HT       MET  81  90.970  -7.516  13.554
    2   2H    MET  81          2HT       MET  81  90.098  -7.299  12.092
    3   3H    MET  81          3HT       MET  81  90.631  -5.935  12.988
    4    HA   MET  81           HA       MET  81  92.490  -7.925  11.910
    5   1HB   MET  81          2HB       MET  81  90.762  -6.367  10.391
    6   2HB   MET  81          1HB       MET  81  92.249  -5.429  10.418
    7   1HG   MET  81          2HG       MET  81  92.608  -8.287   9.873
    8   2HG   MET  81          1HG       MET  81  91.689  -7.407   8.654
    9   1HE   MET  81          1HE       MET  81  94.655  -6.838   6.498
   10   2HE   MET  81          2HE       MET  81  92.899  -6.928   6.645
   11   3HE   MET  81          3HE       MET  81  93.891  -8.325   7.061
   12    H    VAL  82           H        VAL  82  92.421  -6.478  14.430
   13    HA   VAL  82           HA       VAL  82  94.373  -4.338  14.083
   14    HB   VAL  82           HB       VAL  82  92.501  -3.995  15.650
   15   1HG1  VAL  82          1HG1      VAL  82  92.016  -5.329  17.422
   16   2HG1  VAL  82          2HG1      VAL  82  93.695  -5.818  17.657
   17   3HG1  VAL  82          3HG1      VAL  82  92.736  -6.547  16.370
   18   1HG2  VAL  82          1HG2      VAL  82  94.503  -2.728  16.021
   19   2HG2  VAL  82          2HG2      VAL  82  95.253  -4.075  16.878
   20   3HG2  VAL  82          3HG2      VAL  82  93.871  -3.238  17.586
   21    H    ARG  83           H        ARG  83  94.121  -7.590  15.396
   22    HA   ARG  83           HA       ARG  83  96.883  -7.519  16.326
   23   1HB   ARG  83          2HB       ARG  83  94.644  -8.783  17.286
   24   2HB   ARG  83          1HB       ARG  83  95.464 -10.086  16.439
   25   1HG   ARG  83          2HG       ARG  83  96.538 -10.349  18.387
   26   2HG   ARG  83          1HG       ARG  83  97.529  -9.008  17.809
   27   1HD   ARG  83          2HD       ARG  83  96.082  -7.431  18.999
   28   2HD   ARG  83          1HD       ARG  83  95.097  -8.774  19.579
   29    HE   ARG  83           HE       ARG  83  97.641  -9.362  20.400
   30   1HH1  ARG  83          1HH1      ARG  83  95.455  -6.677  20.843
   31   2HH1  ARG  83          2HH1      ARG  83  96.089  -6.256  22.399
   32   1HH2  ARG  83          1HH2      ARG  83  98.474  -8.811  22.447
   33   2HH2  ARG  83          2HH2      ARG  83  97.802  -7.468  23.310
   34    H    CYS  84           H        CYS  84  98.125  -9.663  15.846
   35    HA   CYS  84           HA       CYS  84  99.236 -10.950  14.338
   36   1HB   CYS  84          2HB       CYS  84  96.451 -10.974  13.342
   37   2HB   CYS  84          1HB       CYS  84  97.682 -11.428  12.169
   38    HG   CYS  84           HG       CYS  84  97.035 -13.608  13.304
   39    H    MET  85           H        MET  85  97.245  -9.188  11.989
   40    HA   MET  85           HA       MET  85  99.616  -8.385  10.550
   41   1HB   MET  85          2HB       MET  85  96.699  -7.779  10.034
   42   2HB   MET  85          1HB       MET  85  98.022  -7.409   8.937
   43   1HG   MET  85          2HG       MET  85  97.870 -10.211   9.788
   44   2HG   MET  85          1HG       MET  85  96.503  -9.644   8.831
   45   1HE   MET  85          1HE       MET  85 100.793 -10.356   7.648
   46   2HE   MET  85          2HE       MET  85  99.687 -11.682   8.004
   47   3HE   MET  85          3HE       MET  85 100.021 -10.460   9.231
   48    H    LYS  86           H        LYS  86 100.688  -6.554  10.850
   49    HA   LYS  86           HA       LYS  86  99.382  -4.070  11.390
   50   1HB   LYS  86          2HB       LYS  86  99.805  -5.522  13.644
   51   2HB   LYS  86          1HB       LYS  86 101.320  -4.635  13.544
   52   1HG   LYS  86          2HG       LYS  86  99.591  -2.626  13.116
   53   2HG   LYS  86          1HG       LYS  86  98.597  -3.677  14.128
   54   1HD   LYS  86          2HD       LYS  86 100.243  -3.658  15.870
   55   2HD   LYS  86          1HD       LYS  86 101.395  -2.806  14.841
   56   1HE   LYS  86          2HE       LYS  86 100.037  -0.833  14.847
   57   2HE   LYS  86          1HE       LYS  86  98.725  -1.679  15.667
   58   1HZ   LYS  86          1HZ       LYS  86 100.444  -2.040  17.510
   59   2HZ   LYS  86          2HZ       LYS  86  99.762  -0.500  17.350
   60   3HZ   LYS  86          3HZ       LYS  86 101.318  -0.800  16.762
   61    H    ASP  87           H        ASP  87 101.043  -2.293  11.741
   62    HA   ASP  87           HA       ASP  87 102.942  -2.381   9.672
   63   1HB   ASP  87          2HB       ASP  87 102.144  -0.467  11.765
   64   2HB   ASP  87          1HB       ASP  87 103.810  -0.304  11.218
   65    H    ASP  88           H        ASP  88 105.276  -2.096   9.857
   66    HA   ASP  88           HA       ASP  88 106.364  -3.726  12.050
   67   1HB   ASP  88          2HB       ASP  88 106.992  -3.480   9.171
   68   2HB   ASP  88          1HB       ASP  88 108.383  -3.634  10.239
   69    H    SER  89           H        SER  89 107.900  -2.943  13.382
   70    HA   SER  89           HA       SER  89 108.591  -0.115  13.090
   71   1HB   SER  89          2HB       SER  89 109.142  -1.876  15.480
   72   2HB   SER  89          1HB       SER  89 109.091  -0.115  15.421
   73    HG   SER  89           HG       SER  89 106.993  -1.965  15.436
   74    H    LYS  90           H        LYS  90 109.877  -2.316  11.535
   75    HA   LYS  90           HA       LYS  90 112.586  -2.373  12.592
   76   1HB   LYS  90          2HB       LYS  90 111.103  -3.801  10.449
   77   2HB   LYS  90          1HB       LYS  90 112.836  -3.612  10.232
   78   1HG   LYS  90          2HG       LYS  90 112.886  -4.512  12.715
   79   2HG   LYS  90          1HG       LYS  90 111.334  -5.202  12.234
   80   1HD   LYS  90          2HD       LYS  90 113.505  -5.551  10.285
   81   2HD   LYS  90          1HD       LYS  90 113.745  -6.386  11.820
   82   1HE   LYS  90          2HE       LYS  90 111.530  -7.428  11.576
   83   2HE   LYS  90          1HE       LYS  90 111.333  -6.619  10.021
   84   1HZ   LYS  90          1HZ       LYS  90 113.438  -8.606  10.689
   85   2HZ   LYS  90          2HZ       LYS  90 113.266  -7.821   9.200
   86   3HZ   LYS  90          3HZ       LYS  90 112.071  -8.893   9.732
   87    H    GLY  91           H        GLY  91 113.784  -0.611  12.266
   88   1HA   GLY  91          2HA       GLY  91 113.337   1.114   9.988
   89   2HA   GLY  91          1HA       GLY  91 114.501   1.368  11.278
   90    H    LYS  92           H        LYS  92 116.585   0.607  11.062
   91    HA   LYS  92           HA       LYS  92 117.572   0.333   8.432
   92   1HB   LYS  92          2HB       LYS  92 118.755   0.079  11.167
   93   2HB   LYS  92          1HB       LYS  92 119.689  -0.463   9.779
   94   1HG   LYS  92          2HG       LYS  92 120.384   1.731  10.122
   95   2HG   LYS  92          1HG       LYS  92 119.228   1.850   8.794
   96   1HD   LYS  92          2HD       LYS  92 118.624   3.604  10.208
   97   2HD   LYS  92          1HD       LYS  92 117.488   2.322  10.630
   98   1HE   LYS  92          2HE       LYS  92 118.407   1.995  12.681
   99   2HE   LYS  92          1HE       LYS  92 120.032   2.410  12.139
  100   1HZ   LYS  92          1HZ       LYS  92 119.582   4.682  12.314
  101   2HZ   LYS  92          2HZ       LYS  92 118.892   4.017  13.707
  102   3HZ   LYS  92          3HZ       LYS  92 117.908   4.452  12.402
  103    H    THR  93           H        THR  93 117.400  -1.382   7.162
  104    HA   THR  93           HA       THR  93 117.392  -4.057   8.396
  105    HB   THR  93           HB       THR  93 116.364  -3.741   5.639
  106    HG1  THR  93           HG1      THR  93 114.371  -2.951   6.413
  107   1HG2  THR  93          1HG2      THR  93 115.833  -5.422   7.996
  108   2HG2  THR  93          2HG2      THR  93 115.855  -5.833   6.281
  109   3HG2  THR  93          3HG2      THR  93 114.446  -5.035   6.978
  110    H    GLU  94           H        GLU  94 117.848  -5.666   6.306
  111    HA   GLU  94           HA       GLU  94 120.638  -5.170   5.705
  112   1HB   GLU  94          2HB       GLU  94 118.871  -7.458   5.877
  113   2HB   GLU  94          1HB       GLU  94 119.834  -7.509   4.409
  114   1HG   GLU  94          2HG       GLU  94 121.874  -7.305   5.722
  115   2HG   GLU  94          1HG       GLU  94 120.920  -7.212   7.201
  116    H    GLU  95           H        GLU  95 117.889  -4.173   4.313
  117    HA   GLU  95           HA       GLU  95 118.766  -4.564   1.545
  118   1HB   GLU  95          2HB       GLU  95 116.293  -4.814   2.573
  119   2HB   GLU  95          1HB       GLU  95 116.245  -3.113   2.128
  120   1HG   GLU  95          2HG       GLU  95 117.275  -4.182  -0.125
  121   2HG   GLU  95          1HG       GLU  95 116.268  -5.514   0.437
  122    H    GLU  96           H        GLU  96 118.125  -2.064   3.935
  123    HA   GLU  96           HA       GLU  96 118.318   0.191   2.299
  124   1HB   GLU  96          2HB       GLU  96 118.791   1.440   4.323
  125   2HB   GLU  96          1HB       GLU  96 117.551   0.237   4.647
  126   1HG   GLU  96          2HG       GLU  96 118.811  -0.172   6.457
  127   2HG   GLU  96          1HG       GLU  96 119.732  -1.167   5.331
  128    H    LEU  97           H        LEU  97 120.804  -1.831   3.718
  129    HA   LEU  97           HA       LEU  97 123.005  -0.129   3.323
  130   1HB   LEU  97          2HB       LEU  97 122.636  -3.061   3.697
  131   2HB   LEU  97          1HB       LEU  97 124.194  -2.493   3.128
  132    HG   LEU  97           HG       LEU  97 123.037  -1.188   5.541
  133   1HD1  LEU  97          1HD1      LEU  97 124.436  -3.853   5.651
  134   2HD1  LEU  97          2HD1      LEU  97 122.701  -3.627   5.870
  135   3HD1  LEU  97          3HD1      LEU  97 123.834  -2.903   7.009
  136   1HD2  LEU  97          1HD2      LEU  97 125.856  -2.089   5.156
  137   2HD2  LEU  97          2HD2      LEU  97 125.231  -0.698   6.044
  138   3HD2  LEU  97          3HD2      LEU  97 125.263  -0.678   4.281
  139    H    SER  98           H        SER  98 121.177  -2.079   1.119
  140    HA   SER  98           HA       SER  98 123.156  -2.254  -0.928
  141   1HB   SER  98          2HB       SER  98 120.851  -3.564  -0.519
  142   2HB   SER  98          1HB       SER  98 120.273  -2.346  -1.654
  143    HG   SER  98           HG       SER  98 121.870  -3.034  -3.113
  144    H    ASP  99           H        ASP  99 120.523  -0.023  -0.203
  145    HA   ASP  99           HA       ASP  99 120.582   1.446  -2.595
  146   1HB   ASP  99          2HB       ASP  99 119.811   2.328   0.195
  147   2HB   ASP  99          1HB       ASP  99 119.474   3.239  -1.274
  148    H    LEU 100           H        LEU 100 122.349   1.851   0.444
  149    HA   LEU 100           HA       LEU 100 123.634   4.270  -0.273
  150   1HB   LEU 100          2HB       LEU 100 124.277   2.141   1.757
  151   2HB   LEU 100          1HB       LEU 100 125.256   3.584   1.564
  152    HG   LEU 100           HG       LEU 100 122.310   3.802   2.087
  153   1HD1  LEU 100          1HD1      LEU 100 124.452   2.997   3.967
  154   2HD1  LEU 100          2HD1      LEU 100 122.730   2.615   3.975
  155   3HD1  LEU 100          3HD1      LEU 100 123.285   4.193   4.531
  156   1HD2  LEU 100          1HD2      LEU 100 124.016   5.698   1.399
  157   2HD2  LEU 100          2HD2      LEU 100 124.389   5.657   3.122
  158   3HD2  LEU 100          3HD2      LEU 100 122.742   5.988   2.585
  159    H    PHE 101           H        PHE 101 124.222   0.973  -1.103
  160    HA   PHE 101           HA       PHE 101 126.979   1.086  -1.625
  161   1HB   PHE 101          2HB       PHE 101 125.676  -1.017  -1.503
  162   2HB   PHE 101          1HB       PHE 101 124.890  -0.600  -3.021
  163    HD1  PHE 101           HD1      PHE 101 125.700  -2.851  -3.771
  164    HD2  PHE 101           HD2      PHE 101 128.360   0.329  -2.804
  165    HE1  PHE 101           HE1      PHE 101 127.501  -3.982  -5.009
  166    HE2  PHE 101           HE2      PHE 101 130.163  -0.797  -4.040
  167    HZ   PHE 101           HZ       PHE 101 129.734  -2.956  -5.145
  168    H    ARG 102           H        ARG 102 124.182   1.699  -3.730
  169    HA   ARG 102           HA       ARG 102 125.634   2.186  -6.083
  170   1HB   ARG 102          2HB       ARG 102 122.954   3.301  -5.236
  171   2HB   ARG 102          1HB       ARG 102 123.593   3.321  -6.875
  172   1HG   ARG 102          2HG       ARG 102 123.769   0.689  -6.325
  173   2HG   ARG 102          1HG       ARG 102 122.372   1.128  -5.342
  174   1HD   ARG 102          2HD       ARG 102 122.096   2.396  -7.865
  175   2HD   ARG 102          1HD       ARG 102 122.514   0.707  -8.152
  176    HE   ARG 102           HE       ARG 102 120.054   1.726  -7.077
  177   1HH1  ARG 102          1HH1      ARG 102 122.174  -1.043  -7.226
  178   2HH1  ARG 102          2HH1      ARG 102 120.917  -2.182  -6.882
  179   1HH2  ARG 102          1HH2      ARG 102 118.398   0.229  -6.626
  180   2HH2  ARG 102          2HH2      ARG 102 118.772  -1.460  -6.541
  181    H    MET 103           H        MET 103 124.862   4.220  -3.347
  182    HA   MET 103           HA       MET 103 125.370   6.730  -4.481
  183   1HB   MET 103          2HB       MET 103 125.438   5.637  -1.698
  184   2HB   MET 103          1HB       MET 103 126.083   7.245  -1.997
  185   1HG   MET 103          2HG       MET 103 123.427   6.704  -3.140
  186   2HG   MET 103          1HG       MET 103 123.518   6.735  -1.379
  187   1HE   MET 103          1HE       MET 103 121.711   9.143  -1.641
  188   2HE   MET 103          2HE       MET 103 121.826   8.451  -3.259
  189   3HE   MET 103          3HE       MET 103 122.106  10.175  -3.016
  190    H    PHE 104           H        PHE 104 127.533   4.291  -3.169
  191    HA   PHE 104           HA       PHE 104 129.854   5.971  -3.238
  192   1HB   PHE 104          2HB       PHE 104 129.259   3.152  -2.570
  193   2HB   PHE 104          1HB       PHE 104 130.887   3.472  -3.158
  194    HD1  PHE 104           HD1      PHE 104 132.512   4.314  -1.729
  195    HD2  PHE 104           HD2      PHE 104 128.413   4.563  -0.615
  196    HE1  PHE 104           HE1      PHE 104 133.173   5.091   0.509
  197    HE2  PHE 104           HE2      PHE 104 129.065   5.344   1.625
  198    HZ   PHE 104           HZ       PHE 104 131.447   5.609   2.190
  199    H    ASP 105           H        ASP 105 128.133   4.145  -5.567
  200    HA   ASP 105           HA       ASP 105 130.413   3.816  -7.335
  201   1HB   ASP 105          2HB       ASP 105 127.567   2.938  -7.332
  202   2HB   ASP 105          1HB       ASP 105 128.364   3.102  -8.893
  203    H    LYS 106           H        LYS 106 130.769   4.944  -9.218
  204    HA   LYS 106           HA       LYS 106 129.267   7.453  -9.473
  205   1HB   LYS 106          2HB       LYS 106 132.071   6.643 -10.033
  206   2HB   LYS 106          1HB       LYS 106 131.365   7.860 -11.087
  207   1HG   LYS 106          2HG       LYS 106 131.005   8.280  -8.190
  208   2HG   LYS 106          1HG       LYS 106 132.651   8.434  -8.810
  209   1HD   LYS 106          2HD       LYS 106 132.118  10.235 -10.151
  210   2HD   LYS 106          1HD       LYS 106 130.409   9.802 -10.233
  211   1HE   LYS 106          2HE       LYS 106 131.880  10.978  -7.879
  212   2HE   LYS 106          1HE       LYS 106 130.656  11.770  -8.871
  213   1HZ   LYS 106          1HZ       LYS 106 129.195   9.797  -8.102
  214   2HZ   LYS 106          2HZ       LYS 106 129.452  11.097  -7.050
  215   3HZ   LYS 106          3HZ       LYS 106 130.323   9.660  -6.849
  216    H    ASN 107           H        ASN 107 130.468   4.706 -11.349
  217    HA   ASN 107           HA       ASN 107 128.866   5.609 -13.639
  218   1HB   ASN 107          2HB       ASN 107 130.176   3.870 -14.905
  219   2HB   ASN 107          1HB       ASN 107 131.139   5.194 -14.256
  220   1HD2  ASN 107          1HD2      ASN 107 132.490   3.039 -14.932
  221   2HD2  ASN 107          2HD2      ASN 107 132.985   2.127 -13.551
  222    H    ALA 108           H        ALA 108 128.184   3.948 -11.040
  223    HA   ALA 108           HA       ALA 108 126.843   2.193 -10.464
  224   1HB   ALA 108          1HB       ALA 108 124.987   3.207 -11.277
  225   2HB   ALA 108          2HB       ALA 108 125.017   1.831 -12.380
  226   3HB   ALA 108          3HB       ALA 108 125.661   3.390 -12.898
  227    H    ASP 109           H        ASP 109 129.101   1.091 -11.155
  228    HA   ASP 109           HA       ASP 109 128.631  -0.885 -13.257
  229   1HB   ASP 109          2HB       ASP 109 131.011  -1.442 -12.988
  230   2HB   ASP 109          1HB       ASP 109 130.781   0.277 -13.293
  231    H    GLY 110           H        GLY 110 128.206  -0.611  -9.940
  232   1HA   GLY 110          2HA       GLY 110 127.264  -2.313  -8.611
  233   2HA   GLY 110          1HA       GLY 110 127.918  -3.510  -9.718
  234    H    TYR 111           H        TYR 111 130.500  -1.704  -9.402
  235    HA   TYR 111           HA       TYR 111 131.334  -2.704  -6.778
  236   1HB   TYR 111          2HB       TYR 111 133.065  -3.051  -9.226
  237   2HB   TYR 111          1HB       TYR 111 133.314  -3.726  -7.620
  238    HD1  TYR 111           HD1      TYR 111 131.349  -3.990 -10.718
  239    HD2  TYR 111           HD2      TYR 111 132.191  -5.733  -6.929
  240    HE1  TYR 111           HE1      TYR 111 130.179  -6.041 -11.409
  241    HE2  TYR 111           HE2      TYR 111 131.024  -7.788  -7.609
  242    HH   TYR 111           HH       TYR 111 129.104  -8.317  -9.379
  243    H    ILE 112           H        ILE 112 133.115  -1.586  -5.858
  244    HA   ILE 112           HA       ILE 112 133.559   1.064  -7.062
  245    HB   ILE 112           HB       ILE 112 133.920   0.277  -4.169
  246   1HG1  ILE 112          2HG1      ILE 112 131.713   2.039  -5.178
  247   2HG1  ILE 112          1HG1      ILE 112 131.526   0.288  -5.240
  248   1HG2  ILE 112          1HG2      ILE 112 135.269   2.128  -4.479
  249   2HG2  ILE 112          2HG2      ILE 112 133.743   2.862  -3.984
  250   3HG2  ILE 112          3HG2      ILE 112 134.198   2.836  -5.689
  251   1HD1  ILE 112          1HD1      ILE 112 130.538   1.318  -3.231
  252   2HD1  ILE 112          2HD1      ILE 112 132.146   1.856  -2.747
  253   3HD1  ILE 112          3HD1      ILE 112 131.787   0.132  -2.857
  254    H    ASP 113           H        ASP 113 135.557   1.713  -7.581
  255    HA   ASP 113           HA       ASP 113 137.779  -0.113  -6.967
  256   1HB   ASP 113          2HB       ASP 113 138.898   1.044  -8.932
  257   2HB   ASP 113          1HB       ASP 113 137.505   0.039  -9.322
  258    H    LEU 114           H        LEU 114 139.970   1.056  -6.949
  259    HA   LEU 114           HA       LEU 114 140.012   2.826  -4.770
  260   1HB   LEU 114          2HB       LEU 114 142.130   2.167  -6.814
  261   2HB   LEU 114          1HB       LEU 114 142.426   3.135  -5.383
  262    HG   LEU 114           HG       LEU 114 141.312   0.897  -4.287
  263   1HD1  LEU 114          1HD1      LEU 114 141.697   0.079  -6.841
  264   2HD1  LEU 114          2HD1      LEU 114 141.711  -0.989  -5.437
  265   3HD1  LEU 114          3HD1      LEU 114 143.229  -0.386  -6.103
  266   1HD2  LEU 114          1HD2      LEU 114 143.313   0.700  -3.250
  267   2HD2  LEU 114          2HD2      LEU 114 143.600   2.261  -4.018
  268   3HD2  LEU 114          3HD2      LEU 114 144.226   0.788  -4.757
  269    H    GLU 115           H        GLU 115 139.956   3.367  -8.222
  270    HA   GLU 115           HA       GLU 115 140.680   6.128  -8.101
  271   1HB   GLU 115          2HB       GLU 115 140.766   4.461 -10.110
  272   2HB   GLU 115          1HB       GLU 115 139.091   4.939 -10.350
  273   1HG   GLU 115          2HG       GLU 115 140.024   7.350 -10.276
  274   2HG   GLU 115          1HG       GLU 115 141.577   6.578 -10.591
  275    H    GLU 116           H        GLU 116 137.598   4.397  -8.476
  276    HA   GLU 116           HA       GLU 116 135.963   6.681  -8.633
  277   1HB   GLU 116          2HB       GLU 116 135.568   3.971  -8.841
  278   2HB   GLU 116          1HB       GLU 116 134.747   4.346  -7.333
  279   1HG   GLU 116          2HG       GLU 116 132.995   4.991  -8.512
  280   2HG   GLU 116          1HG       GLU 116 133.955   6.337  -9.123
  281    H    LEU 117           H        LEU 117 136.600   4.533  -5.859
  282    HA   LEU 117           HA       LEU 117 135.179   5.889  -3.925
  283   1HB   LEU 117          2HB       LEU 117 136.312   3.684  -3.654
  284   2HB   LEU 117          1HB       LEU 117 137.842   4.530  -3.516
  285    HG   LEU 117           HG       LEU 117 136.911   5.715  -1.503
  286   1HD1  LEU 117          1HD1      LEU 117 134.857   5.311  -0.674
  287   2HD1  LEU 117          2HD1      LEU 117 134.875   3.615  -1.159
  288   3HD1  LEU 117          3HD1      LEU 117 134.500   4.867  -2.344
  289   1HD2  LEU 117          1HD2      LEU 117 138.431   3.860  -1.239
  290   2HD2  LEU 117          2HD2      LEU 117 137.109   2.709  -1.428
  291   3HD2  LEU 117          3HD2      LEU 117 137.166   3.760  -0.014
  292    H    LYS 118           H        LYS 118 138.220   6.738  -5.383
  293    HA   LYS 118           HA       LYS 118 139.005   8.630  -3.389
  294   1HB   LYS 118          2HB       LYS 118 140.307   7.403  -5.429
  295   2HB   LYS 118          1HB       LYS 118 140.021   8.988  -6.138
  296   1HG   LYS 118          2HG       LYS 118 140.987   9.866  -3.886
  297   2HG   LYS 118          1HG       LYS 118 141.668   8.243  -3.766
  298   1HD   LYS 118          2HD       LYS 118 143.372   9.117  -4.946
  299   2HD   LYS 118          1HD       LYS 118 142.299   8.894  -6.329
  300   1HE   LYS 118          2HE       LYS 118 141.463  11.303  -5.390
  301   2HE   LYS 118          1HE       LYS 118 143.179  11.358  -4.987
  302   1HZ   LYS 118          1HZ       LYS 118 143.590  10.693  -7.360
  303   2HZ   LYS 118          2HZ       LYS 118 142.966  12.248  -7.140
  304   3HZ   LYS 118          3HZ       LYS 118 141.953  10.997  -7.660
  305    H    ILE 119           H        ILE 119 136.981   8.710  -6.211
  306    HA   ILE 119           HA       ILE 119 136.998  11.475  -6.719
  307    HB   ILE 119           HB       ILE 119 134.685   9.583  -7.153
  308   1HG1  ILE 119          2HG1      ILE 119 137.032  10.226  -8.955
  309   2HG1  ILE 119          1HG1      ILE 119 136.730   8.685  -8.158
  310   1HG2  ILE 119          1HG2      ILE 119 134.273  12.059  -7.347
  311   2HG2  ILE 119          2HG2      ILE 119 133.921  11.116  -8.795
  312   3HG2  ILE 119          3HG2      ILE 119 135.406  12.063  -8.699
  313   1HD1  ILE 119          1HD1      ILE 119 134.716   8.381  -9.476
  314   2HD1  ILE 119          2HD1      ILE 119 136.119   8.632 -10.516
  315   3HD1  ILE 119          3HD1      ILE 119 134.972   9.945 -10.248
  316    H    MET 120           H        MET 120 134.711   9.505  -4.825
  317    HA   MET 120           HA       MET 120 133.072  11.586  -3.958
  318   1HB   MET 120          2HB       MET 120 132.497   9.203  -3.742
  319   2HB   MET 120          1HB       MET 120 133.738   9.018  -2.512
  320   1HG   MET 120          2HG       MET 120 132.380  10.965  -1.356
  321   2HG   MET 120          1HG       MET 120 131.076  10.312  -2.347
  322   1HE   MET 120          1HE       MET 120 133.532   7.857   0.636
  323   2HE   MET 120          2HE       MET 120 133.218   9.542   1.054
  324   3HE   MET 120          3HE       MET 120 134.098   9.149  -0.422
  325    H    LEU 121           H        LEU 121 136.208  10.571  -2.836
  326    HA   LEU 121           HA       LEU 121 136.057  11.969  -0.333
  327   1HB   LEU 121          2HB       LEU 121 138.116  10.436  -1.817
  328   2HB   LEU 121          1HB       LEU 121 138.695  11.619  -0.658
  329    HG   LEU 121           HG       LEU 121 136.894  10.354   0.886
  330   1HD1  LEU 121          1HD1      LEU 121 137.942   8.210  -0.954
  331   2HD1  LEU 121          2HD1      LEU 121 136.283   8.801  -0.929
  332   3HD1  LEU 121          3HD1      LEU 121 136.946   7.977   0.482
  333   1HD2  LEU 121          1HD2      LEU 121 139.784  10.067   0.394
  334   2HD2  LEU 121          2HD2      LEU 121 139.030   8.764   1.314
  335   3HD2  LEU 121          3HD2      LEU 121 138.913  10.429   1.884
  336    H    GLN 122           H        GLN 122 137.617  12.588  -3.465
  337    HA   GLN 122           HA       GLN 122 138.782  15.051  -2.700
  338   1HB   GLN 122          2HB       GLN 122 139.016  15.436  -5.148
  339   2HB   GLN 122          1HB       GLN 122 139.643  13.881  -4.617
  340   1HG   GLN 122          2HG       GLN 122 137.631  12.781  -5.413
  341   2HG   GLN 122          1HG       GLN 122 136.968  14.336  -5.913
  342   1HE2  GLN 122          1HE2      GLN 122 136.795  13.475  -8.035
  343   2HE2  GLN 122          2HE2      GLN 122 138.179  13.386  -9.064
  344    H    ALA 123           H        ALA 123 135.764  14.216  -4.336
  345    HA   ALA 123           HA       ALA 123 134.869  16.795  -4.914
  346   1HB   ALA 123          1HB       ALA 123 132.967  15.798  -5.603
  347   2HB   ALA 123          2HB       ALA 123 132.806  14.837  -4.134
  348   3HB   ALA 123          3HB       ALA 123 133.917  14.326  -5.406
  349    H    THR 124           H        THR 124 134.886  15.016  -1.915
  350    HA   THR 124           HA       THR 124 133.047  16.813  -0.599
  351    HB   THR 124           HB       THR 124 134.087  15.488   1.462
  352    HG1  THR 124           HG1      THR 124 134.469  13.618  -0.616
  353   1HG2  THR 124          1HG2      THR 124 132.034  14.680   1.435
  354   2HG2  THR 124          2HG2      THR 124 132.560  13.477   0.259
  355   3HG2  THR 124          3HG2      THR 124 131.880  15.008  -0.290
  356    H    GLY 125           H        GLY 125 133.624  18.103   1.268
  357   1HA   GLY 125          2HA       GLY 125 136.125  19.511   0.814
  358   2HA   GLY 125          1HA       GLY 125 134.829  20.003   1.895
  359    H    GLU 126           H        GLU 126 135.593  16.770   2.399
  360    HA   GLU 126           HA       GLU 126 136.736  17.346   4.962
  361   1HB   GLU 126          2HB       GLU 126 136.321  14.724   3.515
  362   2HB   GLU 126          1HB       GLU 126 136.850  14.871   5.185
  363   1HG   GLU 126          2HG       GLU 126 134.653  16.297   5.407
  364   2HG   GLU 126          1HG       GLU 126 134.178  15.369   3.985
  365    H    THR 127           H        THR 127 138.782  16.543   5.732
  366    HA   THR 127           HA       THR 127 140.848  16.692   3.659
  367    HB   THR 127           HB       THR 127 142.279  16.839   5.910
  368    HG1  THR 127           HG1      THR 127 141.079  17.960   7.478
  369   1HG2  THR 127          1HG2      THR 127 140.992  18.848   4.239
  370   2HG2  THR 127          2HG2      THR 127 142.650  18.751   4.832
  371   3HG2  THR 127          3HG2      THR 127 141.381  19.412   5.863
  372    H    ILE 128           H        ILE 128 140.888  14.595   2.894
  373    HA   ILE 128           HA       ILE 128 141.869  12.583   4.808
  374    HB   ILE 128           HB       ILE 128 140.127  11.941   2.432
  375   1HG1  ILE 128          2HG1      ILE 128 139.285  12.003   5.334
  376   2HG1  ILE 128          1HG1      ILE 128 138.953  13.307   4.199
  377   1HG2  ILE 128          1HG2      ILE 128 141.528  10.383   4.502
  378   2HG2  ILE 128          2HG2      ILE 128 141.089   9.945   2.851
  379   3HG2  ILE 128          3HG2      ILE 128 139.881   9.871   4.134
  380   1HD1  ILE 128          1HD1      ILE 128 137.690  11.717   2.802
  381   2HD1  ILE 128          2HD1      ILE 128 137.014  11.912   4.420
  382   3HD1  ILE 128          3HD1      ILE 128 137.958  10.475   4.025
  383    H    THR 129           H        THR 129 143.690  11.557   4.246
  384    HA   THR 129           HA       THR 129 145.005  12.334   1.788
  385    HB   THR 129           HB       THR 129 146.252  12.267   3.911
  386    HG1  THR 129           HG1      THR 129 147.257  10.238   2.222
  387   1HG2  THR 129          1HG2      THR 129 145.105   9.649   4.140
  388   2HG2  THR 129          2HG2      THR 129 145.983  10.602   5.336
  389   3HG2  THR 129          3HG2      THR 129 146.865   9.566   4.214
  390    H    GLU 130           H        GLU 130 146.231  10.573   0.569
  391    HA   GLU 130           HA       GLU 130 144.384   8.816  -0.601
  392   1HB   GLU 130          2HB       GLU 130 146.783   9.774  -1.351
  393   2HB   GLU 130          1HB       GLU 130 147.266   8.163  -0.841
  394   1HG   GLU 130          2HG       GLU 130 145.066   7.639  -2.367
  395   2HG   GLU 130          1HG       GLU 130 145.777   9.023  -3.197
  396    H    ASP 131           H        ASP 131 146.763   8.352   1.942
  397    HA   ASP 131           HA       ASP 131 146.840   5.578   2.051
  398   1HB   ASP 131          2HB       ASP 131 147.037   7.600   4.289
  399   2HB   ASP 131          1HB       ASP 131 147.420   5.891   4.469
  400    H    ASP 132           H        ASP 132 144.567   7.822   3.586
  401    HA   ASP 132           HA       ASP 132 143.115   5.932   5.059
  402   1HB   ASP 132          2HB       ASP 132 142.516   8.672   4.005
  403   2HB   ASP 132          1HB       ASP 132 141.219   7.718   4.721
  404    H    ILE 133           H        ILE 133 142.929   6.914   1.704
  405    HA   ILE 133           HA       ILE 133 140.437   5.646   1.145
  406    HB   ILE 133           HB       ILE 133 142.628   6.312  -0.823
  407   1HG1  ILE 133          2HG1      ILE 133 140.276   8.079  -0.214
  408   2HG1  ILE 133          1HG1      ILE 133 141.749   8.195   0.743
  409   1HG2  ILE 133          1HG2      ILE 133 140.833   6.401  -2.454
  410   2HG2  ILE 133          2HG2      ILE 133 139.651   6.022  -1.202
  411   3HG2  ILE 133          3HG2      ILE 133 140.863   4.826  -1.662
  412   1HD1  ILE 133          1HD1      ILE 133 142.696   8.279  -1.824
  413   2HD1  ILE 133          2HD1      ILE 133 142.410   9.672  -0.780
  414   3HD1  ILE 133          3HD1      ILE 133 141.176   9.166  -1.936
  415    H    GLU 134           H        GLU 134 143.827   4.726   0.553
  416    HA   GLU 134           HA       GLU 134 143.313   2.268  -0.682
  417   1HB   GLU 134          2HB       GLU 134 145.678   3.197   0.950
  418   2HB   GLU 134          1HB       GLU 134 145.647   1.682   0.057
  419   1HG   GLU 134          2HG       GLU 134 145.022   3.226  -1.956
  420   2HG   GLU 134          1HG       GLU 134 145.755   4.479  -0.956
  421    H    GLU 135           H        GLU 135 144.077   2.967   2.727
  422    HA   GLU 135           HA       GLU 135 143.888   0.351   3.679
  423   1HB   GLU 135          2HB       GLU 135 143.399   1.446   5.901
  424   2HB   GLU 135          1HB       GLU 135 144.860   1.995   5.092
  425   1HG   GLU 135          2HG       GLU 135 144.117   4.051   5.469
  426   2HG   GLU 135          1HG       GLU 135 142.966   3.748   4.169
  427    H    LEU 136           H        LEU 136 141.408   2.660   2.884
  428    HA   LEU 136           HA       LEU 136 139.276   1.465   4.309
  429   1HB   LEU 136          2HB       LEU 136 139.610   3.735   2.778
  430   2HB   LEU 136          1HB       LEU 136 138.530   2.763   1.796
  431    HG   LEU 136           HG       LEU 136 137.836   3.044   4.667
  432   1HD1  LEU 136          1HD1      LEU 136 138.043   5.311   2.779
  433   2HD1  LEU 136          2HD1      LEU 136 138.143   5.284   4.540
  434   3HD1  LEU 136          3HD1      LEU 136 136.571   5.206   3.744
  435   1HD2  LEU 136          1HD2      LEU 136 136.095   3.319   2.237
  436   2HD2  LEU 136          2HD2      LEU 136 135.634   2.869   3.879
  437   3HD2  LEU 136          3HD2      LEU 136 136.561   1.746   2.885
  438    H    MET 137           H        MET 137 140.653   0.914   1.123
  439    HA   MET 137           HA       MET 137 138.580  -0.841   0.233
  440   1HB   MET 137          2HB       MET 137 140.698   0.466  -0.969
  441   2HB   MET 137          1HB       MET 137 141.195  -1.219  -1.020
  442   1HG   MET 137          2HG       MET 137 140.070  -1.046  -2.994
  443   2HG   MET 137          1HG       MET 137 138.776  -1.596  -1.930
  444   1HE   MET 137          1HE       MET 137 137.286  -1.121  -3.581
  445   2HE   MET 137          2HE       MET 137 136.878   0.430  -4.317
  446   3HE   MET 137          3HE       MET 137 136.207  -0.004  -2.746
  447    H    LYS 138           H        LYS 138 141.853  -1.328   1.522
  448    HA   LYS 138           HA       LYS 138 141.923  -4.112   1.358
  449   1HB   LYS 138          2HB       LYS 138 143.673  -2.206   2.171
  450   2HB   LYS 138          1HB       LYS 138 143.222  -2.905   3.721
  451   1HG   LYS 138          2HG       LYS 138 143.728  -5.033   1.914
  452   2HG   LYS 138          1HG       LYS 138 145.062  -3.885   1.802
  453   1HD   LYS 138          2HD       LYS 138 145.831  -5.094   3.561
  454   2HD   LYS 138          1HD       LYS 138 144.803  -3.980   4.463
  455   1HE   LYS 138          2HE       LYS 138 143.026  -5.922   3.789
  456   2HE   LYS 138          1HE       LYS 138 144.505  -6.861   3.977
  457   1HZ   LYS 138          1HZ       LYS 138 143.652  -4.923   6.036
  458   2HZ   LYS 138          2HZ       LYS 138 144.711  -6.232   6.192
  459   3HZ   LYS 138          3HZ       LYS 138 143.051  -6.504   6.021
  460    H    ASP 139           H        ASP 139 140.279  -2.016   3.577
  461    HA   ASP 139           HA       ASP 139 139.812  -4.077   5.543
  462   1HB   ASP 139          2HB       ASP 139 139.304  -1.193   5.302
  463   2HB   ASP 139          1HB       ASP 139 138.036  -2.076   6.145
  464    H    GLY 140           H        GLY 140 138.377  -3.140   2.593
  465   1HA   GLY 140          2HA       GLY 140 135.943  -4.659   3.302
  466   2HA   GLY 140          1HA       GLY 140 135.912  -3.267   2.232
  467    H    ASP 141           H        ASP 141 138.684  -5.173   1.804
  468    HA   ASP 141           HA       ASP 141 137.439  -6.513  -0.506
  469   1HB   ASP 141          2HB       ASP 141 139.327  -4.604  -0.702
  470   2HB   ASP 141          1HB       ASP 141 140.363  -6.019  -0.537
  471    H    LYS 142           H        LYS 142 137.018  -8.447   0.533
  472    HA   LYS 142           HA       LYS 142 139.061  -9.828   2.014
  473   1HB   LYS 142          2HB       LYS 142 136.477 -11.006   1.007
  474   2HB   LYS 142          1HB       LYS 142 137.435 -11.525   2.384
  475   1HG   LYS 142          2HG       LYS 142 136.002  -8.885   2.201
  476   2HG   LYS 142          1HG       LYS 142 135.369 -10.322   3.006
  477   1HD   LYS 142          2HD       LYS 142 138.080  -9.583   3.834
  478   2HD   LYS 142          1HD       LYS 142 136.857  -8.366   4.206
  479   1HE   LYS 142          2HE       LYS 142 135.541  -9.993   5.405
  480   2HE   LYS 142          1HE       LYS 142 136.644 -11.285   4.932
  481   1HZ   LYS 142          1HZ       LYS 142 138.409 -10.014   6.152
  482   2HZ   LYS 142          2HZ       LYS 142 137.199 -10.683   7.127
  483   3HZ   LYS 142          3HZ       LYS 142 137.182  -9.029   6.776
  484    H    ASN 143           H        ASN 143 137.759  -9.919  -1.237
  485    HA   ASN 143           HA       ASN 143 139.241 -12.319  -1.915
  486   1HB   ASN 143          2HB       ASN 143 138.280 -11.900  -4.209
  487   2HB   ASN 143          1HB       ASN 143 137.088 -12.132  -2.933
  488   1HD2  ASN 143          1HD2      ASN 143 135.653 -11.075  -4.453
  489   2HD2  ASN 143          2HD2      ASN 143 135.608  -9.349  -4.508
  490    H    ASN 144           H        ASN 144 140.056  -9.137  -1.573
  491    HA   ASN 144           HA       ASN 144 141.678  -7.769  -2.402
  492   1HB   ASN 144          2HB       ASN 144 142.843 -10.501  -2.285
  493   2HB   ASN 144          1HB       ASN 144 143.779  -9.263  -3.118
  494   1HD2  ASN 144          1HD2      ASN 144 144.217 -10.713  -0.573
  495   2HD2  ASN 144          2HD2      ASN 144 144.448  -9.481   0.616
  496    H    ASP 145           H        ASP 145 139.696  -8.709  -4.359
  497    HA   ASP 145           HA       ASP 145 141.039  -9.212  -6.827
  498   1HB   ASP 145          2HB       ASP 145 138.833  -8.846  -7.854
  499   2HB   ASP 145          1HB       ASP 145 138.725  -9.930  -6.470
  500    H    GLY 146           H        GLY 146 139.854  -6.350  -5.173
  501   1HA   GLY 146          2HA       GLY 146 141.264  -4.334  -5.675
  502   2HA   GLY 146          1HA       GLY 146 140.959  -4.702  -7.365
  503    H    ARG 147           H        ARG 147 138.152  -5.498  -5.963
  504    HA   ARG 147           HA       ARG 147 137.079  -2.788  -5.774
  505   1HB   ARG 147          2HB       ARG 147 135.940  -4.885  -7.631
  506   2HB   ARG 147          1HB       ARG 147 135.245  -3.300  -7.320
  507   1HG   ARG 147          2HG       ARG 147 137.807  -2.699  -8.102
  508   2HG   ARG 147          1HG       ARG 147 137.395  -4.081  -9.117
  509   1HD   ARG 147          2HD       ARG 147 135.201  -2.828  -9.578
  510   2HD   ARG 147          1HD       ARG 147 136.026  -1.418  -8.914
  511    HE   ARG 147           HE       ARG 147 137.286  -1.287 -10.825
  512   1HH1  ARG 147          1HH1      ARG 147 135.661  -4.375 -10.738
  513   2HH1  ARG 147          2HH1      ARG 147 136.098  -4.791 -12.360
  514   1HH2  ARG 147          1HH2      ARG 147 137.861  -1.833 -12.962
  515   2HH2  ARG 147          2HH2      ARG 147 137.346  -3.349 -13.623
  516    H    ILE 148           H        ILE 148 135.031  -2.669  -4.718
  517    HA   ILE 148           HA       ILE 148 134.473  -5.036  -3.058
  518    HB   ILE 148           HB       ILE 148 133.786  -2.155  -2.461
  519   1HG1  ILE 148          2HG1      ILE 148 135.907  -3.833  -1.121
  520   2HG1  ILE 148          1HG1      ILE 148 136.263  -2.776  -2.483
  521   1HG2  ILE 148          1HG2      ILE 148 133.824  -4.381  -0.465
  522   2HG2  ILE 148          2HG2      ILE 148 132.409  -4.128  -1.486
  523   3HG2  ILE 148          3HG2      ILE 148 132.963  -2.844  -0.412
  524   1HD1  ILE 148          1HD1      ILE 148 136.094  -2.132   0.269
  525   2HD1  ILE 148          2HD1      ILE 148 134.818  -1.263  -0.584
  526   3HD1  ILE 148          3HD1      ILE 148 136.498  -1.083  -1.090
  527    H    ASP 149           H        ASP 149 132.568  -6.006  -3.190
  528    HA   ASP 149           HA       ASP 149 130.486  -4.764  -4.849
  529   1HB   ASP 149          2HB       ASP 149 129.577  -7.055  -5.083
  530   2HB   ASP 149          1HB       ASP 149 131.239  -6.934  -5.655
  531    H    TYR 150           H        TYR 150 128.204  -5.778  -4.157
  532    HA   TYR 150           HA       TYR 150 127.461  -4.500  -1.800
  533   1HB   TYR 150          2HB       TYR 150 125.858  -5.065  -3.563
  534   2HB   TYR 150          1HB       TYR 150 126.055  -6.779  -3.207
  535    HD1  TYR 150           HD1      TYR 150 125.692  -3.928  -0.841
  536    HD2  TYR 150           HD2      TYR 150 123.946  -7.454  -2.459
  537    HE1  TYR 150           HE1      TYR 150 123.882  -3.787   0.820
  538    HE2  TYR 150           HE2      TYR 150 122.132  -7.322  -0.804
  539    HH   TYR 150           HH       TYR 150 121.588  -4.559   1.111
  540    H    ASP 151           H        ASP 151 128.777  -7.666  -2.287
  541    HA   ASP 151           HA       ASP 151 127.910  -8.760   0.211
  542   1HB   ASP 151          2HB       ASP 151 130.210  -9.676  -1.525
  543   2HB   ASP 151          1HB       ASP 151 129.368 -10.620  -0.299
  544    H    GLU 152           H        GLU 152 131.078  -7.631  -0.977
  545    HA   GLU 152           HA       GLU 152 132.250  -7.767   1.634
  546   1HB   GLU 152          2HB       GLU 152 133.365  -6.294  -0.748
  547   2HB   GLU 152          1HB       GLU 152 134.248  -6.972   0.613
  548   1HG   GLU 152          2HG       GLU 152 132.705  -8.980  -0.796
  549   2HG   GLU 152          1HG       GLU 152 133.850  -8.152  -1.848
  550    H    PHE 153           H        PHE 153 130.527  -5.364  -0.157
  551    HA   PHE 153           HA       PHE 153 131.531  -3.143   1.377
  552   1HB   PHE 153          2HB       PHE 153 130.583  -3.151  -1.057
  553   2HB   PHE 153          1HB       PHE 153 129.020  -3.022  -0.258
  554    HD1  PHE 153           HD1      PHE 153 128.340  -0.872  -0.834
  555    HD2  PHE 153           HD2      PHE 153 132.231  -1.471   0.778
  556    HE1  PHE 153           HE1      PHE 153 128.637   1.564  -0.651
  557    HE2  PHE 153           HE2      PHE 153 132.533   0.961   0.968
  558    HZ   PHE 153           HZ       PHE 153 130.736   2.482   0.253
  559    H    LEU 154           H        LEU 154 128.531  -5.047   1.292
  560    HA   LEU 154           HA       LEU 154 127.139  -3.551   3.221
  561   1HB   LEU 154          2HB       LEU 154 125.617  -5.354   3.364
  562   2HB   LEU 154          1HB       LEU 154 126.160  -5.289   1.702
  563    HG   LEU 154           HG       LEU 154 127.837  -7.132   2.417
  564   1HD1  LEU 154          1HD1      LEU 154 126.428  -6.723   4.860
  565   2HD1  LEU 154          2HD1      LEU 154 127.746  -7.844   4.515
  566   3HD1  LEU 154          3HD1      LEU 154 126.073  -8.344   4.265
  567   1HD2  LEU 154          1HD2      LEU 154 126.435  -8.666   1.487
  568   2HD2  LEU 154          2HD2      LEU 154 125.558  -7.197   1.061
  569   3HD2  LEU 154          3HD2      LEU 154 125.052  -8.152   2.453
  570    H    GLU 155           H        GLU 155 129.297  -6.320   3.522
  571    HA   GLU 155           HA       GLU 155 128.995  -6.751   6.278
  572   1HB   GLU 155          2HB       GLU 155 130.884  -7.557   4.181
  573   2HB   GLU 155          1HB       GLU 155 131.604  -7.464   5.783
  574   1HG   GLU 155          2HG       GLU 155 129.200  -8.795   6.177
  575   2HG   GLU 155          1HG       GLU 155 129.830  -9.446   4.664
  576    H    PHE 156           H        PHE 156 130.978  -4.509   4.462
  577    HA   PHE 156           HA       PHE 156 132.819  -3.677   6.321
  578   1HB   PHE 156          2HB       PHE 156 132.057  -2.837   3.829
  579   2HB   PHE 156          1HB       PHE 156 131.594  -1.462   4.825
  580    HD1  PHE 156           HD1      PHE 156 133.823  -1.786   6.893
  581    HD2  PHE 156           HD2      PHE 156 133.819  -1.810   2.636
  582    HE1  PHE 156           HE1      PHE 156 136.153  -0.995   6.891
  583    HE2  PHE 156           HE2      PHE 156 136.149  -1.021   2.628
  584    HZ   PHE 156           HZ       PHE 156 137.319  -0.614   4.756
  585    H    MET 157           H        MET 157 129.393  -3.114   6.335
  586    HA   MET 157           HA       MET 157 129.719  -1.284   8.624
  587   1HB   MET 157          2HB       MET 157 128.074  -1.121   6.290
  588   2HB   MET 157          1HB       MET 157 127.028  -1.247   7.696
  589   1HG   MET 157          2HG       MET 157 127.410   0.858   8.251
  590   2HG   MET 157          1HG       MET 157 129.154   0.610   8.209
  591   1HE   MET 157          1HE       MET 157 129.831  -0.139   5.297
  592   2HE   MET 157          2HE       MET 157 130.691   1.135   6.163
  593   3HE   MET 157          3HE       MET 157 130.080   1.433   4.536
  594    H    LYS 158           H        LYS 158 129.128  -4.433   8.007
  595    HA   LYS 158           HA       LYS 158 127.101  -4.770  10.102
  596   1HB   LYS 158          2HB       LYS 158 128.266  -6.731   8.115
  597   2HB   LYS 158          1HB       LYS 158 127.092  -7.155   9.354
  598   1HG   LYS 158          2HG       LYS 158 126.358  -4.918   7.579
  599   2HG   LYS 158          1HG       LYS 158 126.431  -6.519   6.840
  600   1HD   LYS 158          2HD       LYS 158 125.094  -6.935   9.236
  601   2HD   LYS 158          1HD       LYS 158 124.460  -5.396   8.649
  602   1HE   LYS 158          2HE       LYS 158 123.059  -6.705   7.470
  603   2HE   LYS 158          1HE       LYS 158 124.430  -6.853   6.371
  604   1HZ   LYS 158          1HZ       LYS 158 124.972  -8.798   8.097
  605   2HZ   LYS 158          2HZ       LYS 158 124.059  -9.034   6.694
  606   3HZ   LYS 158          3HZ       LYS 158 123.282  -8.815   8.178
  607    H    GLY 159           H        GLY 159 129.684  -3.858  10.766
  608   1HA   GLY 159          2HA       GLY 159 130.747  -4.510  12.878
  609   2HA   GLY 159          1HA       GLY 159 130.748  -6.165  12.273
  610    H    VAL 160           H        VAL 160 132.447  -3.203  12.395
  611    HA   VAL 160           HA       VAL 160 134.198  -3.913  10.183
  612    HB   VAL 160           HB       VAL 160 134.770  -1.563  11.926
  613   1HG1  VAL 160          1HG1      VAL 160 136.088  -2.318   9.870
  614   2HG1  VAL 160          2HG1      VAL 160 135.623  -0.619   9.961
  615   3HG1  VAL 160          3HG1      VAL 160 134.718  -1.728   8.930
  616   1HG2  VAL 160          1HG2      VAL 160 132.299  -1.941  10.326
  617   2HG2  VAL 160          2HG2      VAL 160 133.108  -0.378  10.213
  618   3HG2  VAL 160          3HG2      VAL 160 132.570  -0.981  11.780
  619    H    GLU 161           H        GLU 161 134.949  -2.718  13.478
  620    HA   GLU 161           HA       GLU 161 137.496  -3.913  13.514
  621   1HB   GLU 161          2HB       GLU 161 135.710  -2.724  15.607
  622   2HB   GLU 161          1HB       GLU 161 137.184  -3.555  16.083
  623   1HG   GLU 161          2HG       GLU 161 138.550  -1.978  15.107
  624   2HG   GLU 161          1HG       GLU 161 137.294  -1.424  14.000
  Start of MODEL   17
    1   1H    MET  81          1HT       MET  81  89.603 -10.855   3.279
    2   2H    MET  81          2HT       MET  81  89.990 -11.556   1.761
    3   3H    MET  81          3HT       MET  81  90.718 -10.077   2.237
    4    HA   MET  81           HA       MET  81  91.041 -12.580   3.735
    5   1HB   MET  81          2HB       MET  81  92.358 -11.572   1.261
    6   2HB   MET  81          1HB       MET  81  93.385 -12.321   2.476
    7   1HG   MET  81          2HG       MET  81  90.946 -13.810   1.791
    8   2HG   MET  81          1HG       MET  81  92.138 -13.660   0.501
    9   1HE   MET  81          1HE       MET  81  93.823 -15.487   0.162
   10   2HE   MET  81          2HE       MET  81  94.964 -15.902   1.442
   11   3HE   MET  81          3HE       MET  81  94.762 -14.219   0.953
   12    H    VAL  82           H        VAL  82  92.579  -9.523   2.715
   13    HA   VAL  82           HA       VAL  82  93.769  -7.960   3.862
   14    HB   VAL  82           HB       VAL  82  92.559  -9.095   6.381
   15   1HG1  VAL  82          1HG1      VAL  82  94.032  -7.535   7.138
   16   2HG1  VAL  82          2HG1      VAL  82  92.663  -6.475   6.804
   17   3HG1  VAL  82          3HG1      VAL  82  93.984  -6.600   5.644
   18   1HG2  VAL  82          1HG2      VAL  82  90.941  -7.040   5.826
   19   2HG2  VAL  82          2HG2      VAL  82  90.602  -8.691   5.305
   20   3HG2  VAL  82          3HG2      VAL  82  91.328  -7.544   4.181
   21    H    ARG  83           H        ARG  83  94.896 -10.605   3.372
   22    HA   ARG  83           HA       ARG  83  96.974 -10.556   5.451
   23   1HB   ARG  83          2HB       ARG  83  95.354 -12.498   5.700
   24   2HB   ARG  83          1HB       ARG  83  95.981 -13.101   4.171
   25   1HG   ARG  83          2HG       ARG  83  97.371 -14.247   5.514
   26   2HG   ARG  83          1HG       ARG  83  98.289 -12.740   5.496
   27   1HD   ARG  83          2HD       ARG  83  96.141 -13.103   7.531
   28   2HD   ARG  83          1HD       ARG  83  97.683 -13.929   7.759
   29    HE   ARG  83           HE       ARG  83  98.067 -11.179   7.161
   30   1HH1  ARG  83          1HH1      ARG  83  97.145 -13.349   9.734
   31   2HH1  ARG  83          2HH1      ARG  83  97.672 -12.283  10.991
   32   1HH2  ARG  83          1HH2      ARG  83  98.761  -9.774   8.816
   33   2HH2  ARG  83          2HH2      ARG  83  98.590 -10.253  10.471
   34    H    CYS  84           H        CYS  84  97.807  -9.125   3.633
   35    HA   CYS  84           HA       CYS  84  99.155 -10.775   1.596
   36   1HB   CYS  84          2HB       CYS  84  97.491  -8.719   1.079
   37   2HB   CYS  84          1HB       CYS  84  99.006  -7.836   1.223
   38    HG   CYS  84           HG       CYS  84  99.278 -10.160  -0.690
   39    H    MET  85           H        MET  85 101.151 -11.205   2.286
   40    HA   MET  85           HA       MET  85 103.042  -9.113   2.639
   41   1HB   MET  85          2HB       MET  85 101.661  -9.625   4.936
   42   2HB   MET  85          1HB       MET  85 103.024 -10.722   5.107
   43   1HG   MET  85          2HG       MET  85 104.540  -9.039   5.299
   44   2HG   MET  85          1HG       MET  85 103.595  -7.922   4.315
   45   1HE   MET  85          1HE       MET  85 104.236  -6.086   7.420
   46   2HE   MET  85          2HE       MET  85 102.950  -5.517   6.356
   47   3HE   MET  85          3HE       MET  85 104.393  -6.267   5.672
   48    H    LYS  86           H        LYS  86 104.329 -10.125   1.171
   49    HA   LYS  86           HA       LYS  86 104.856 -12.908   1.155
   50   1HB   LYS  86          2HB       LYS  86 105.280 -10.845  -0.596
   51   2HB   LYS  86          1HB       LYS  86 106.914 -11.184  -0.041
   52   1HG   LYS  86          2HG       LYS  86 106.035 -13.688  -0.538
   53   2HG   LYS  86          1HG       LYS  86 105.126 -12.774  -1.742
   54   1HD   LYS  86          2HD       LYS  86 107.193 -11.802  -2.589
   55   2HD   LYS  86          1HD       LYS  86 108.116 -12.663  -1.356
   56   1HE   LYS  86          2HE       LYS  86 108.007 -14.629  -2.460
   57   2HE   LYS  86          1HE       LYS  86 106.363 -14.337  -3.027
   58   1HZ   LYS  86          1HZ       LYS  86 107.639 -14.270  -4.946
   59   2HZ   LYS  86          2HZ       LYS  86 108.908 -13.428  -4.213
   60   3HZ   LYS  86          3HZ       LYS  86 107.458 -12.632  -4.564
   61    H    ASP  87           H        ASP  87 107.581 -13.169   0.898
   62    HA   ASP  87           HA       ASP  87 108.383 -13.308   3.633
   63   1HB   ASP  87          2HB       ASP  87 109.015 -14.782   1.494
   64   2HB   ASP  87          1HB       ASP  87 110.389 -13.681   1.468
   65    H    ASP  88           H        ASP  88 108.333 -11.081   4.255
   66    HA   ASP  88           HA       ASP  88 110.624  -9.519   3.255
   67   1HB   ASP  88          2HB       ASP  88 109.382  -7.504   3.998
   68   2HB   ASP  88          1HB       ASP  88 108.520  -8.407   2.755
   69    H    SER  89           H        SER  89 111.504  -7.961   4.929
   70    HA   SER  89           HA       SER  89 111.443  -9.191   7.601
   71   1HB   SER  89          2HB       SER  89 113.933  -8.275   7.633
   72   2HB   SER  89          1HB       SER  89 113.551  -9.854   6.951
   73    HG   SER  89           HG       SER  89 113.523  -7.554   5.327
   74    H    LYS  90           H        LYS  90 113.519  -6.472   6.977
   75    HA   LYS  90           HA       LYS  90 111.559  -4.692   8.262
   76   1HB   LYS  90          2HB       LYS  90 114.008  -5.598   9.333
   77   2HB   LYS  90          1HB       LYS  90 114.261  -3.916   8.884
   78   1HG   LYS  90          2HG       LYS  90 113.457  -3.558  10.956
   79   2HG   LYS  90          1HG       LYS  90 111.903  -3.679  10.126
   80   1HD   LYS  90          2HD       LYS  90 111.712  -6.009  10.746
   81   2HD   LYS  90          1HD       LYS  90 113.319  -5.976  11.477
   82   1HE   LYS  90          2HE       LYS  90 112.244  -5.536  13.389
   83   2HE   LYS  90          1HE       LYS  90 112.056  -3.904  12.747
   84   1HZ   LYS  90          1HZ       LYS  90 109.972  -5.120  11.630
   85   2HZ   LYS  90          2HZ       LYS  90 109.894  -4.332  13.125
   86   3HZ   LYS  90          3HZ       LYS  90 110.085  -6.011  13.064
   87    H    GLY  91           H        GLY  91 111.232  -2.791   7.272
   88   1HA   GLY  91          2HA       GLY  91 112.128  -2.224   4.721
   89   2HA   GLY  91          1HA       GLY  91 111.495  -1.018   5.833
   90    H    LYS  92           H        LYS  92 113.630  -1.400   7.785
   91    HA   LYS  92           HA       LYS  92 115.831  -0.131   6.292
   92   1HB   LYS  92          2HB       LYS  92 114.912   0.368   9.128
   93   2HB   LYS  92          1HB       LYS  92 116.355   1.070   8.409
   94   1HG   LYS  92          2HG       LYS  92 114.926   2.154   6.704
   95   2HG   LYS  92          1HG       LYS  92 113.508   1.529   7.549
   96   1HD   LYS  92          2HD       LYS  92 113.823   2.913   9.375
   97   2HD   LYS  92          1HD       LYS  92 115.544   3.123   9.047
   98   1HE   LYS  92          2HE       LYS  92 113.716   4.115   6.960
   99   2HE   LYS  92          1HE       LYS  92 113.658   4.977   8.496
  100   1HZ   LYS  92          1HZ       LYS  92 116.317   4.428   7.489
  101   2HZ   LYS  92          2HZ       LYS  92 115.692   5.837   8.185
  102   3HZ   LYS  92          3HZ       LYS  92 115.408   5.505   6.552
  103    H    THR  93           H        THR  93 116.167  -2.657   6.169
  104    HA   THR  93           HA       THR  93 117.860  -3.461   8.442
  105    HB   THR  93           HB       THR  93 115.911  -4.923   8.039
  106    HG1  THR  93           HG1      THR  93 117.702  -5.939   8.868
  107   1HG2  THR  93          1HG2      THR  93 116.980  -6.183   5.647
  108   2HG2  THR  93          2HG2      THR  93 116.364  -4.553   5.371
  109   3HG2  THR  93          3HG2      THR  93 115.317  -5.784   6.080
  110    H    GLU  94           H        GLU  94 119.000  -5.674   6.871
  111    HA   GLU  94           HA       GLU  94 121.240  -4.308   5.789
  112   1HB   GLU  94          2HB       GLU  94 120.410  -7.110   6.192
  113   2HB   GLU  94          1HB       GLU  94 121.537  -6.843   4.868
  114   1HG   GLU  94          2HG       GLU  94 123.245  -6.317   6.243
  115   2HG   GLU  94          1HG       GLU  94 122.199  -5.527   7.422
  116    H    GLU  95           H        GLU  95 118.228  -4.852   4.482
  117    HA   GLU  95           HA       GLU  95 119.113  -5.247   1.741
  118   1HB   GLU  95          2HB       GLU  95 116.611  -5.501   3.201
  119   2HB   GLU  95          1HB       GLU  95 116.392  -4.613   1.700
  120   1HG   GLU  95          2HG       GLU  95 117.773  -6.587   0.682
  121   2HG   GLU  95          1HG       GLU  95 117.233  -7.435   2.130
  122    H    GLU  96           H        GLU  96 117.743  -2.703   3.768
  123    HA   GLU  96           HA       GLU  96 117.359  -0.795   1.726
  124   1HB   GLU  96          2HB       GLU  96 117.129   0.826   3.485
  125   2HB   GLU  96          1HB       GLU  96 116.357  -0.664   4.009
  126   1HG   GLU  96          2HG       GLU  96 117.634  -0.759   5.810
  127   2HG   GLU  96          1HG       GLU  96 119.099  -0.644   4.840
  128    H    LEU  97           H        LEU  97 120.150  -1.834   3.509
  129    HA   LEU  97           HA       LEU  97 121.841   0.360   3.146
  130   1HB   LEU  97          2HB       LEU  97 122.409  -2.593   3.365
  131   2HB   LEU  97          1HB       LEU  97 123.682  -1.393   3.273
  132    HG   LEU  97           HG       LEU  97 121.566  -1.288   5.407
  133   1HD1  LEU  97          1HD1      LEU  97 124.244  -2.396   6.022
  134   2HD1  LEU  97          2HD1      LEU  97 123.098  -3.455   5.199
  135   3HD1  LEU  97          3HD1      LEU  97 122.676  -2.738   6.754
  136   1HD2  LEU  97          1HD2      LEU  97 123.785  -0.241   6.479
  137   2HD2  LEU  97          2HD2      LEU  97 122.610   0.712   5.574
  138   3HD2  LEU  97          3HD2      LEU  97 124.077   0.137   4.781
  139    H    SER  98           H        SER  98 120.621  -1.928   0.894
  140    HA   SER  98           HA       SER  98 122.571  -2.071  -1.057
  141   1HB   SER  98          2HB       SER  98 120.608  -3.397  -1.305
  142   2HB   SER  98          1HB       SER  98 119.558  -1.981  -1.264
  143    HG   SER  98           HG       SER  98 120.395  -3.121  -3.390
  144    H    ASP  99           H        ASP  99 120.134   0.443  -0.524
  145    HA   ASP  99           HA       ASP  99 120.643   1.990  -2.798
  146   1HB   ASP  99          2HB       ASP  99 118.700   2.260  -1.235
  147   2HB   ASP  99          1HB       ASP  99 119.794   3.031  -0.089
  148    H    LEU 100           H        LEU 100 122.199   1.949   0.363
  149    HA   LEU 100           HA       LEU 100 123.773   4.266   0.016
  150   1HB   LEU 100          2HB       LEU 100 124.009   1.842   1.774
  151   2HB   LEU 100          1HB       LEU 100 125.252   3.080   1.771
  152    HG   LEU 100           HG       LEU 100 122.362   3.721   2.313
  153   1HD1  LEU 100          1HD1      LEU 100 124.472   2.682   4.158
  154   2HD1  LEU 100          2HD1      LEU 100 122.767   2.249   4.050
  155   3HD1  LEU 100          3HD1      LEU 100 123.240   3.799   4.747
  156   1HD2  LEU 100          1HD2      LEU 100 123.743   5.610   1.707
  157   2HD2  LEU 100          2HD2      LEU 100 124.957   5.143   2.898
  158   3HD2  LEU 100          3HD2      LEU 100 123.363   5.683   3.427
  159    H    PHE 101           H        PHE 101 124.193   0.932  -0.959
  160    HA   PHE 101           HA       PHE 101 126.932   0.956  -1.520
  161   1HB   PHE 101          2HB       PHE 101 125.510  -1.083  -1.474
  162   2HB   PHE 101          1HB       PHE 101 124.784  -0.577  -2.997
  163    HD1  PHE 101           HD1      PHE 101 125.959  -0.805  -5.069
  164    HD2  PHE 101           HD2      PHE 101 127.833  -1.829  -1.388
  165    HE1  PHE 101           HE1      PHE 101 127.754  -1.947  -6.305
  166    HE2  PHE 101           HE2      PHE 101 129.631  -2.973  -2.616
  167    HZ   PHE 101           HZ       PHE 101 129.594  -3.032  -5.078
  168    H    ARG 102           H        ARG 102 124.186   1.570  -3.716
  169    HA   ARG 102           HA       ARG 102 125.640   2.134  -6.009
  170   1HB   ARG 102          2HB       ARG 102 122.928   2.423  -5.116
  171   2HB   ARG 102          1HB       ARG 102 123.401   3.864  -6.003
  172   1HG   ARG 102          2HG       ARG 102 124.168   2.375  -7.854
  173   2HG   ARG 102          1HG       ARG 102 123.458   1.020  -6.975
  174   1HD   ARG 102          2HD       ARG 102 121.281   1.869  -7.208
  175   2HD   ARG 102          1HD       ARG 102 121.864   3.470  -7.660
  176    HE   ARG 102           HE       ARG 102 122.624   1.401  -9.505
  177   1HH1  ARG 102          1HH1      ARG 102 120.130   3.679  -8.630
  178   2HH1  ARG 102          2HH1      ARG 102 119.450   3.739 -10.221
  179   1HH2  ARG 102          1HH2      ARG 102 121.732   1.479 -11.600
  180   2HH2  ARG 102          2HH2      ARG 102 120.359   2.488 -11.907
  181    H    MET 103           H        MET 103 124.752   4.254  -3.330
  182    HA   MET 103           HA       MET 103 125.503   6.703  -4.407
  183   1HB   MET 103          2HB       MET 103 125.279   5.604  -1.650
  184   2HB   MET 103          1HB       MET 103 126.134   7.127  -1.853
  185   1HG   MET 103          2HG       MET 103 123.921   7.621  -3.307
  186   2HG   MET 103          1HG       MET 103 123.271   6.513  -2.100
  187   1HE   MET 103          1HE       MET 103 122.192   9.029  -2.608
  188   2HE   MET 103          2HE       MET 103 123.178  10.460  -2.307
  189   3HE   MET 103          3HE       MET 103 122.030   9.909  -1.087
  190    H    PHE 104           H        PHE 104 127.454   4.080  -3.235
  191    HA   PHE 104           HA       PHE 104 129.867   5.645  -3.036
  192   1HB   PHE 104          2HB       PHE 104 129.028   2.930  -2.385
  193   2HB   PHE 104          1HB       PHE 104 130.627   2.975  -3.121
  194    HD1  PHE 104           HD1      PHE 104 132.436   3.245  -1.741
  195    HD2  PHE 104           HD2      PHE 104 128.658   4.767  -0.507
  196    HE1  PHE 104           HE1      PHE 104 133.414   3.909   0.417
  197    HE2  PHE 104           HE2      PHE 104 129.630   5.437   1.653
  198    HZ   PHE 104           HZ       PHE 104 132.011   5.008   2.116
  199    H    ASP 105           H        ASP 105 128.183   3.960  -5.518
  200    HA   ASP 105           HA       ASP 105 130.536   3.668  -7.196
  201   1HB   ASP 105          2HB       ASP 105 127.690   2.797  -7.345
  202   2HB   ASP 105          1HB       ASP 105 128.566   2.993  -8.859
  203    H    LYS 106           H        LYS 106 131.096   4.987  -8.840
  204    HA   LYS 106           HA       LYS 106 129.461   7.394  -9.225
  205   1HB   LYS 106          2HB       LYS 106 132.387   6.814  -9.568
  206   2HB   LYS 106          1HB       LYS 106 131.650   8.191 -10.374
  207   1HG   LYS 106          2HG       LYS 106 131.413   7.750  -7.415
  208   2HG   LYS 106          1HG       LYS 106 132.762   8.627  -8.142
  209   1HD   LYS 106          2HD       LYS 106 131.513  10.451  -8.535
  210   2HD   LYS 106          1HD       LYS 106 130.132   9.500  -9.085
  211   1HE   LYS 106          2HE       LYS 106 129.336   9.188  -6.901
  212   2HE   LYS 106          1HE       LYS 106 130.871   9.672  -6.181
  213   1HZ   LYS 106          1HZ       LYS 106 129.345  11.597  -7.803
  214   2HZ   LYS 106          2HZ       LYS 106 130.447  11.890  -6.554
  215   3HZ   LYS 106          3HZ       LYS 106 128.897  11.315  -6.196
  216    H    ASN 107           H        ASN 107 131.211   4.887 -11.016
  217    HA   ASN 107           HA       ASN 107 130.010   5.813 -13.515
  218   1HB   ASN 107          2HB       ASN 107 131.502   4.098 -14.561
  219   2HB   ASN 107          1HB       ASN 107 132.362   5.337 -13.652
  220   1HD2  ASN 107          1HD2      ASN 107 133.540   2.941 -14.279
  221   2HD2  ASN 107          2HD2      ASN 107 133.778   2.021 -12.837
  222    H    ALA 108           H        ALA 108 128.786   4.126 -11.146
  223    HA   ALA 108           HA       ALA 108 127.351   2.367 -10.879
  224   1HB   ALA 108          1HB       ALA 108 125.758   2.174 -12.938
  225   2HB   ALA 108          2HB       ALA 108 126.611   3.617 -13.486
  226   3HB   ALA 108          3HB       ALA 108 125.752   3.632 -11.946
  227    H    ASP 109           H        ASP 109 129.315   0.934 -10.983
  228    HA   ASP 109           HA       ASP 109 129.106  -0.899 -13.282
  229   1HB   ASP 109          2HB       ASP 109 131.482  -1.482 -12.877
  230   2HB   ASP 109          1HB       ASP 109 131.261   0.213 -13.303
  231    H    GLY 110           H        GLY 110 128.432  -0.589 -10.049
  232   1HA   GLY 110          2HA       GLY 110 127.491  -2.251  -8.698
  233   2HA   GLY 110          1HA       GLY 110 128.161  -3.471  -9.771
  234    H    TYR 111           H        TYR 111 130.753  -1.676  -9.375
  235    HA   TYR 111           HA       TYR 111 131.495  -2.755  -6.746
  236   1HB   TYR 111          2HB       TYR 111 133.347  -2.884  -9.124
  237   2HB   TYR 111          1HB       TYR 111 133.541  -3.658  -7.555
  238    HD1  TYR 111           HD1      TYR 111 131.589  -3.725 -10.697
  239    HD2  TYR 111           HD2      TYR 111 132.609  -5.794  -7.121
  240    HE1  TYR 111           HE1      TYR 111 130.528  -5.762 -11.578
  241    HE2  TYR 111           HE2      TYR 111 131.554  -7.836  -7.994
  242    HH   TYR 111           HH       TYR 111 130.972  -8.483 -10.961
  243    H    ILE 112           H        ILE 112 133.195  -1.637  -5.685
  244    HA   ILE 112           HA       ILE 112 133.586   1.098  -6.702
  245    HB   ILE 112           HB       ILE 112 133.882   0.154  -3.850
  246   1HG1  ILE 112          2HG1      ILE 112 131.633   1.924  -4.556
  247   2HG1  ILE 112          1HG1      ILE 112 131.510   0.291  -5.201
  248   1HG2  ILE 112          1HG2      ILE 112 133.676   2.937  -4.994
  249   2HG2  ILE 112          2HG2      ILE 112 135.167   2.163  -4.459
  250   3HG2  ILE 112          3HG2      ILE 112 133.888   2.512  -3.295
  251   1HD1  ILE 112          1HD1      ILE 112 132.252   0.501  -2.360
  252   2HD1  ILE 112          2HD1      ILE 112 131.164  -0.621  -3.176
  253   3HD1  ILE 112          3HD1      ILE 112 130.617   1.009  -2.783
  254    H    ASP 113           H        ASP 113 135.531   1.533  -7.485
  255    HA   ASP 113           HA       ASP 113 137.825  -0.044  -6.536
  256   1HB   ASP 113          2HB       ASP 113 138.914   0.799  -8.679
  257   2HB   ASP 113          1HB       ASP 113 137.587  -0.342  -8.877
  258    H    LEU 114           H        LEU 114 139.968   1.262  -6.847
  259    HA   LEU 114           HA       LEU 114 140.059   3.255  -4.925
  260   1HB   LEU 114          2HB       LEU 114 141.934   2.608  -7.191
  261   2HB   LEU 114          1HB       LEU 114 142.296   3.832  -5.988
  262    HG   LEU 114           HG       LEU 114 141.573   1.158  -4.946
  263   1HD1  LEU 114          1HD1      LEU 114 143.850   1.633  -6.766
  264   2HD1  LEU 114          2HD1      LEU 114 142.967   0.149  -6.413
  265   3HD1  LEU 114          3HD1      LEU 114 144.190   0.735  -5.287
  266   1HD2  LEU 114          1HD2      LEU 114 142.192   2.486  -3.217
  267   2HD2  LEU 114          2HD2      LEU 114 143.250   3.483  -4.215
  268   3HD2  LEU 114          3HD2      LEU 114 143.794   1.898  -3.663
  269    H    GLU 115           H        GLU 115 139.825   3.563  -8.446
  270    HA   GLU 115           HA       GLU 115 140.086   6.353  -8.587
  271   1HB   GLU 115          2HB       GLU 115 139.594   4.232 -10.382
  272   2HB   GLU 115          1HB       GLU 115 138.279   5.378 -10.607
  273   1HG   GLU 115          2HG       GLU 115 139.674   6.416 -11.995
  274   2HG   GLU 115          1HG       GLU 115 140.444   7.027 -10.532
  275    H    GLU 116           H        GLU 116 137.187   4.308  -8.360
  276    HA   GLU 116           HA       GLU 116 135.298   6.377  -8.445
  277   1HB   GLU 116          2HB       GLU 116 135.310   3.541  -7.575
  278   2HB   GLU 116          1HB       GLU 116 134.002   4.545  -6.967
  279   1HG   GLU 116          2HG       GLU 116 133.425   3.330  -9.031
  280   2HG   GLU 116          1HG       GLU 116 133.298   5.081  -9.196
  281    H    LEU 117           H        LEU 117 136.667   4.673  -5.631
  282    HA   LEU 117           HA       LEU 117 135.377   6.173  -3.659
  283   1HB   LEU 117          2HB       LEU 117 136.773   4.008  -3.467
  284   2HB   LEU 117          1HB       LEU 117 138.152   5.080  -3.312
  285    HG   LEU 117           HG       LEU 117 137.162   6.092  -1.314
  286   1HD1  LEU 117          1HD1      LEU 117 135.170   4.935  -0.302
  287   2HD1  LEU 117          2HD1      LEU 117 134.918   4.169  -1.869
  288   3HD1  LEU 117          3HD1      LEU 117 134.837   5.923  -1.723
  289   1HD2  LEU 117          1HD2      LEU 117 138.395   3.687  -1.480
  290   2HD2  LEU 117          2HD2      LEU 117 136.912   3.244  -0.635
  291   3HD2  LEU 117          3HD2      LEU 117 137.971   4.485   0.034
  292    H    LYS 118           H        LYS 118 138.234   6.844  -5.549
  293    HA   LYS 118           HA       LYS 118 139.325   8.903  -3.977
  294   1HB   LYS 118          2HB       LYS 118 140.377   7.696  -5.968
  295   2HB   LYS 118          1HB       LYS 118 139.460   8.797  -6.986
  296   1HG   LYS 118          2HG       LYS 118 140.884  10.252  -4.954
  297   2HG   LYS 118          1HG       LYS 118 141.980   9.214  -5.866
  298   1HD   LYS 118          2HD       LYS 118 141.305  10.200  -7.936
  299   2HD   LYS 118          1HD       LYS 118 140.000  11.089  -7.149
  300   1HE   LYS 118          2HE       LYS 118 141.969  12.081  -5.723
  301   2HE   LYS 118          1HE       LYS 118 142.940  11.590  -7.111
  302   1HZ   LYS 118          1HZ       LYS 118 140.761  12.877  -8.178
  303   2HZ   LYS 118          2HZ       LYS 118 142.330  13.493  -8.045
  304   3HZ   LYS 118          3HZ       LYS 118 141.192  13.818  -6.838
  305    H    ILE 119           H        ILE 119 136.703   8.851  -6.281
  306    HA   ILE 119           HA       ILE 119 136.509  11.702  -6.540
  307    HB   ILE 119           HB       ILE 119 134.392   9.647  -7.177
  308   1HG1  ILE 119          2HG1      ILE 119 136.212  10.803  -9.248
  309   2HG1  ILE 119          1HG1      ILE 119 136.805   9.478  -8.252
  310   1HG2  ILE 119          1HG2      ILE 119 134.086  11.620  -8.985
  311   2HG2  ILE 119          2HG2      ILE 119 134.681  12.547  -7.608
  312   3HG2  ILE 119          3HG2      ILE 119 133.229  11.559  -7.445
  313   1HD1  ILE 119          1HD1      ILE 119 134.577   8.329  -8.956
  314   2HD1  ILE 119          2HD1      ILE 119 135.951   8.363 -10.062
  315   3HD1  ILE 119          3HD1      ILE 119 134.620   9.500 -10.273
  316    H    MET 120           H        MET 120 134.838   9.212  -4.664
  317    HA   MET 120           HA       MET 120 132.808  10.772  -3.570
  318   1HB   MET 120          2HB       MET 120 133.405   8.187  -3.389
  319   2HB   MET 120          1HB       MET 120 134.104   8.703  -1.861
  320   1HG   MET 120          2HG       MET 120 131.767   9.875  -1.575
  321   2HG   MET 120          1HG       MET 120 131.266   8.641  -2.729
  322   1HE   MET 120          1HE       MET 120 133.441   9.297   0.189
  323   2HE   MET 120          2HE       MET 120 134.056   7.652   0.349
  324   3HE   MET 120          3HE       MET 120 132.838   8.252   1.474
  325    H    LEU 121           H        LEU 121 136.096  10.183  -2.365
  326    HA   LEU 121           HA       LEU 121 135.805  11.740  -0.014
  327   1HB   LEU 121          2HB       LEU 121 138.121  10.618  -1.535
  328   2HB   LEU 121          1HB       LEU 121 138.418  11.792  -0.266
  329    HG   LEU 121           HG       LEU 121 138.649   9.444   0.492
  330   1HD1  LEU 121          1HD1      LEU 121 136.725   9.791   2.340
  331   2HD1  LEU 121          2HD1      LEU 121 136.822  11.426   1.684
  332   3HD1  LEU 121          3HD1      LEU 121 138.262  10.656   2.352
  333   1HD2  LEU 121          1HD2      LEU 121 135.706   9.333  -0.151
  334   2HD2  LEU 121          2HD2      LEU 121 136.561   8.139   0.824
  335   3HD2  LEU 121          3HD2      LEU 121 136.993   8.366  -0.870
  336    H    GLN 122           H        GLN 122 137.041  12.456  -3.252
  337    HA   GLN 122           HA       GLN 122 137.932  15.075  -2.686
  338   1HB   GLN 122          2HB       GLN 122 137.213  13.603  -5.198
  339   2HB   GLN 122          1HB       GLN 122 137.553  15.327  -5.255
  340   1HG   GLN 122          2HG       GLN 122 139.487  13.487  -3.927
  341   2HG   GLN 122          1HG       GLN 122 139.443  13.593  -5.686
  342   1HE2  GLN 122          1HE2      GLN 122 139.083  16.136  -6.257
  343   2HE2  GLN 122          2HE2      GLN 122 140.335  17.131  -5.602
  344    H    ALA 123           H        ALA 123 134.807  13.733  -3.405
  345    HA   ALA 123           HA       ALA 123 133.483  16.078  -4.220
  346   1HB   ALA 123          1HB       ALA 123 131.622  14.805  -4.276
  347   2HB   ALA 123          2HB       ALA 123 131.918  14.108  -2.682
  348   3HB   ALA 123          3HB       ALA 123 132.778  13.487  -4.092
  349    H    THR 124           H        THR 124 134.453  14.920  -1.089
  350    HA   THR 124           HA       THR 124 132.658  16.471   0.470
  351    HB   THR 124           HB       THR 124 133.992  15.863   2.342
  352    HG1  THR 124           HG1      THR 124 136.068  15.249   0.511
  353   1HG2  THR 124          1HG2      THR 124 133.654  13.676   2.256
  354   2HG2  THR 124          2HG2      THR 124 134.807  13.468   0.939
  355   3HG2  THR 124          3HG2      THR 124 133.138  13.920   0.588
  356    H    GLY 125           H        GLY 125 133.868  18.018   2.189
  357   1HA   GLY 125          2HA       GLY 125 134.996  20.156   0.522
  358   2HA   GLY 125          1HA       GLY 125 134.234  20.372   2.090
  359    H    GLU 126           H        GLU 126 136.497  17.790   1.737
  360    HA   GLU 126           HA       GLU 126 138.569  19.409   3.061
  361   1HB   GLU 126          2HB       GLU 126 137.787  16.564   3.727
  362   2HB   GLU 126          1HB       GLU 126 139.139  17.438   4.436
  363   1HG   GLU 126          2HG       GLU 126 136.802  19.017   4.748
  364   2HG   GLU 126          1HG       GLU 126 136.436  17.374   5.272
  365    H    THR 127           H        THR 127 140.718  18.069   3.088
  366    HA   THR 127           HA       THR 127 141.111  17.043   0.355
  367    HB   THR 127           HB       THR 127 143.409  17.818   0.501
  368    HG1  THR 127           HG1      THR 127 142.737  18.737   3.098
  369   1HG2  THR 127          1HG2      THR 127 142.814  19.841  -0.144
  370   2HG2  THR 127          2HG2      THR 127 142.455  20.298   1.521
  371   3HG2  THR 127          3HG2      THR 127 141.205  19.560   0.519
  372    H    ILE 128           H        ILE 128 141.607  14.968   0.156
  373    HA   ILE 128           HA       ILE 128 142.815  13.583   2.463
  374    HB   ILE 128           HB       ILE 128 141.018  12.274   0.427
  375   1HG1  ILE 128          2HG1      ILE 128 139.773  14.011   1.677
  376   2HG1  ILE 128          1HG1      ILE 128 139.221  12.385   2.067
  377   1HG2  ILE 128          1HG2      ILE 128 142.480  11.408   2.841
  378   2HG2  ILE 128          2HG2      ILE 128 142.076  10.515   1.375
  379   3HG2  ILE 128          3HG2      ILE 128 140.857  10.756   2.626
  380   1HD1  ILE 128          1HD1      ILE 128 139.401  13.029   4.186
  381   2HD1  ILE 128          2HD1      ILE 128 140.403  14.420   3.774
  382   3HD1  ILE 128          3HD1      ILE 128 141.140  12.829   3.964
  383    H    THR 129           H        THR 129 144.230  11.809   1.972
  384    HA   THR 129           HA       THR 129 145.695  12.250  -0.518
  385    HB   THR 129           HB       THR 129 147.441  10.817   0.592
  386    HG1  THR 129           HG1      THR 129 145.844   9.835   2.052
  387   1HG2  THR 129          1HG2      THR 129 148.286  12.771   1.178
  388   2HG2  THR 129          2HG2      THR 129 147.389  12.654   2.692
  389   3HG2  THR 129          3HG2      THR 129 146.677  13.482   1.307
  390    H    GLU 130           H        GLU 130 146.526  10.378  -1.705
  391    HA   GLU 130           HA       GLU 130 144.434   8.496  -2.230
  392   1HB   GLU 130          2HB       GLU 130 145.950   7.622  -3.956
  393   2HB   GLU 130          1HB       GLU 130 145.801   9.372  -4.048
  394   1HG   GLU 130          2HG       GLU 130 148.026   8.374  -2.407
  395   2HG   GLU 130          1HG       GLU 130 148.139   8.043  -4.135
  396    H    ASP 131           H        ASP 131 147.213   8.522  -0.210
  397    HA   ASP 131           HA       ASP 131 147.743   5.746  -0.122
  398   1HB   ASP 131          2HB       ASP 131 148.275   7.920   1.913
  399   2HB   ASP 131          1HB       ASP 131 148.912   6.281   2.018
  400    H    ASP 132           H        ASP 132 145.972   7.843   2.160
  401    HA   ASP 132           HA       ASP 132 145.092   5.862   3.892
  402   1HB   ASP 132          2HB       ASP 132 144.140   8.595   3.181
  403   2HB   ASP 132          1HB       ASP 132 143.059   7.569   4.120
  404    H    ILE 133           H        ILE 133 143.571   7.088   0.935
  405    HA   ILE 133           HA       ILE 133 141.221   5.524   1.133
  406    HB   ILE 133           HB       ILE 133 142.494   6.593  -1.390
  407   1HG1  ILE 133          2HG1      ILE 133 140.335   7.950   0.214
  408   2HG1  ILE 133          1HG1      ILE 133 142.040   8.253   0.530
  409   1HG2  ILE 133          1HG2      ILE 133 139.801   5.486  -0.718
  410   2HG2  ILE 133          2HG2      ILE 133 140.830   5.166  -2.114
  411   3HG2  ILE 133          3HG2      ILE 133 139.964   6.696  -1.991
  412   1HD1  ILE 133          1HD1      ILE 133 142.263   9.553  -1.270
  413   2HD1  ILE 133          2HD1      ILE 133 140.504   9.657  -1.204
  414   3HD1  ILE 133          3HD1      ILE 133 141.278   8.494  -2.281
  415    H    GLU 134           H        GLU 134 144.429   4.866  -0.040
  416    HA   GLU 134           HA       GLU 134 143.801   2.584  -1.606
  417   1HB   GLU 134          2HB       GLU 134 146.044   4.088  -1.228
  418   2HB   GLU 134          1HB       GLU 134 146.450   2.641  -0.314
  419   1HG   GLU 134          2HG       GLU 134 145.632   1.418  -2.481
  420   2HG   GLU 134          1HG       GLU 134 145.983   2.974  -3.233
  421    H    GLU 135           H        GLU 135 144.399   3.098   1.797
  422    HA   GLU 135           HA       GLU 135 144.393   0.214   2.297
  423   1HB   GLU 135          2HB       GLU 135 145.020   0.819   4.602
  424   2HB   GLU 135          1HB       GLU 135 146.137   1.484   3.418
  425   1HG   GLU 135          2HG       GLU 135 145.504   3.636   3.817
  426   2HG   GLU 135          1HG       GLU 135 143.874   3.183   4.311
  427    H    LEU 136           H        LEU 136 142.003   1.828   1.486
  428    HA   LEU 136           HA       LEU 136 140.330   1.530   3.877
  429   1HB   LEU 136          2HB       LEU 136 140.445   3.490   1.885
  430   2HB   LEU 136          1HB       LEU 136 138.971   2.601   1.555
  431    HG   LEU 136           HG       LEU 136 139.390   3.395   4.373
  432   1HD1  LEU 136          1HD1      LEU 136 139.231   5.344   2.139
  433   2HD1  LEU 136          2HD1      LEU 136 140.036   5.474   3.703
  434   3HD1  LEU 136          3HD1      LEU 136 138.287   5.668   3.593
  435   1HD2  LEU 136          1HD2      LEU 136 137.034   3.691   4.332
  436   2HD2  LEU 136          2HD2      LEU 136 137.381   2.208   3.444
  437   3HD2  LEU 136          3HD2      LEU 136 136.998   3.690   2.569
  438    H    MET 137           H        MET 137 140.657   0.470   0.536
  439    HA   MET 137           HA       MET 137 138.272  -1.098   0.510
  440   1HB   MET 137          2HB       MET 137 140.663  -1.514  -1.277
  441   2HB   MET 137          1HB       MET 137 138.976  -1.864  -1.622
  442   1HG   MET 137          2HG       MET 137 140.241   0.854  -1.363
  443   2HG   MET 137          1HG       MET 137 139.667   0.084  -2.843
  444   1HE   MET 137          1HE       MET 137 136.768   1.016  -3.629
  445   2HE   MET 137          2HE       MET 137 136.042  -0.197  -2.576
  446   3HE   MET 137          3HE       MET 137 137.569  -0.537  -3.388
  447    H    LYS 138           H        LYS 138 141.495  -1.603   1.644
  448    HA   LYS 138           HA       LYS 138 141.659  -4.398   1.501
  449   1HB   LYS 138          2HB       LYS 138 143.481  -2.692   2.116
  450   2HB   LYS 138          1HB       LYS 138 142.832  -2.774   3.747
  451   1HG   LYS 138          2HG       LYS 138 143.508  -5.326   2.397
  452   2HG   LYS 138          1HG       LYS 138 144.833  -4.303   2.955
  453   1HD   LYS 138          2HD       LYS 138 144.409  -4.725   5.125
  454   2HD   LYS 138          1HD       LYS 138 142.660  -4.665   4.896
  455   1HE   LYS 138          2HE       LYS 138 143.279  -6.891   5.556
  456   2HE   LYS 138          1HE       LYS 138 142.769  -6.919   3.867
  457   1HZ   LYS 138          1HZ       LYS 138 145.384  -7.425   5.023
  458   2HZ   LYS 138          2HZ       LYS 138 145.383  -6.536   3.584
  459   3HZ   LYS 138          3HZ       LYS 138 144.671  -8.069   3.629
  460    H    ASP 139           H        ASP 139 140.094  -2.266   3.801
  461    HA   ASP 139           HA       ASP 139 139.414  -4.493   5.550
  462   1HB   ASP 139          2HB       ASP 139 139.783  -1.705   5.917
  463   2HB   ASP 139          1HB       ASP 139 138.104  -2.060   6.308
  464    H    GLY 140           H        GLY 140 138.272  -3.766   2.707
  465   1HA   GLY 140          2HA       GLY 140 135.452  -4.133   3.500
  466   2HA   GLY 140          1HA       GLY 140 135.927  -3.157   2.118
  467    H    ASP 141           H        ASP 141 137.990  -4.947   1.192
  468    HA   ASP 141           HA       ASP 141 136.260  -7.043   0.082
  469   1HB   ASP 141          2HB       ASP 141 138.094  -7.183  -1.690
  470   2HB   ASP 141          1HB       ASP 141 137.106  -5.726  -1.685
  471    H    LYS 142           H        LYS 142 136.504  -9.006   0.825
  472    HA   LYS 142           HA       LYS 142 138.771  -9.745   2.433
  473   1HB   LYS 142          2HB       LYS 142 136.175 -10.991   1.684
  474   2HB   LYS 142          1HB       LYS 142 137.468 -12.060   2.212
  475   1HG   LYS 142          2HG       LYS 142 135.925 -11.353   4.021
  476   2HG   LYS 142          1HG       LYS 142 137.616 -10.956   4.323
  477   1HD   LYS 142          2HD       LYS 142 137.109  -8.656   3.400
  478   2HD   LYS 142          1HD       LYS 142 135.403  -9.105   3.461
  479   1HE   LYS 142          2HE       LYS 142 135.385  -9.214   5.780
  480   2HE   LYS 142          1HE       LYS 142 137.136  -9.401   5.882
  481   1HZ   LYS 142          1HZ       LYS 142 135.545  -6.964   5.507
  482   2HZ   LYS 142          2HZ       LYS 142 137.097  -7.025   4.838
  483   3HZ   LYS 142          3HZ       LYS 142 136.886  -7.231   6.504
  484    H    ASN 143           H        ASN 143 137.897 -10.050  -0.885
  485    HA   ASN 143           HA       ASN 143 139.745 -12.241  -1.365
  486   1HB   ASN 143          2HB       ASN 143 139.029 -11.921  -3.762
  487   2HB   ASN 143          1HB       ASN 143 137.731 -12.331  -2.646
  488   1HD2  ASN 143          1HD2      ASN 143 136.789 -11.361  -4.806
  489   2HD2  ASN 143          2HD2      ASN 143 136.353  -9.692  -4.692
  490    H    ASN 144           H        ASN 144 140.167  -9.064  -0.809
  491    HA   ASN 144           HA       ASN 144 141.711  -7.487  -1.358
  492   1HB   ASN 144          2HB       ASN 144 143.013  -9.763  -0.668
  493   2HB   ASN 144          1HB       ASN 144 143.682  -9.490  -2.273
  494   1HD2  ASN 144          1HD2      ASN 144 145.708  -8.947  -1.606
  495   2HD2  ASN 144          2HD2      ASN 144 146.069  -7.502  -0.730
  496    H    ASP 145           H        ASP 145 139.939  -8.418  -3.532
  497    HA   ASP 145           HA       ASP 145 141.443  -8.517  -5.947
  498   1HB   ASP 145          2HB       ASP 145 139.222  -8.123  -7.035
  499   2HB   ASP 145          1HB       ASP 145 139.238  -9.479  -5.912
  500    H    GLY 146           H        GLY 146 140.243  -5.950  -3.946
  501   1HA   GLY 146          2HA       GLY 146 141.207  -3.760  -4.121
  502   2HA   GLY 146          1HA       GLY 146 141.380  -4.018  -5.851
  503    H    ARG 147           H        ARG 147 138.402  -5.183  -5.051
  504    HA   ARG 147           HA       ARG 147 137.065  -2.585  -5.263
  505   1HB   ARG 147          2HB       ARG 147 136.563  -4.963  -7.060
  506   2HB   ARG 147          1HB       ARG 147 135.515  -3.554  -6.967
  507   1HG   ARG 147          2HG       ARG 147 137.776  -2.288  -7.489
  508   2HG   ARG 147          1HG       ARG 147 138.197  -3.850  -8.194
  509   1HD   ARG 147          2HD       ARG 147 135.844  -3.639  -9.316
  510   2HD   ARG 147          1HD       ARG 147 136.058  -1.922  -8.982
  511    HE   ARG 147           HE       ARG 147 138.382  -2.751 -10.210
  512   1HH1  ARG 147          1HH1      ARG 147 134.989  -2.648 -11.017
  513   2HH1  ARG 147          2HH1      ARG 147 135.270  -2.462 -12.716
  514   1HH2  ARG 147          1HH2      ARG 147 138.754  -2.507 -12.444
  515   2HH2  ARG 147          2HH2      ARG 147 137.407  -2.382 -13.527
  516    H    ILE 148           H        ILE 148 134.935  -2.538  -4.459
  517    HA   ILE 148           HA       ILE 148 134.289  -4.823  -2.720
  518    HB   ILE 148           HB       ILE 148 133.328  -1.977  -2.419
  519   1HG1  ILE 148          2HG1      ILE 148 135.449  -3.344  -0.765
  520   2HG1  ILE 148          1HG1      ILE 148 135.839  -2.342  -2.160
  521   1HG2  ILE 148          1HG2      ILE 148 132.834  -4.507  -0.991
  522   2HG2  ILE 148          2HG2      ILE 148 131.815  -3.077  -1.158
  523   3HG2  ILE 148          3HG2      ILE 148 133.125  -3.094   0.023
  524   1HD1  ILE 148          1HD1      ILE 148 134.382  -1.448   0.316
  525   2HD1  ILE 148          2HD1      ILE 148 134.736  -0.440  -1.087
  526   3HD1  ILE 148          3HD1      ILE 148 136.055  -1.084  -0.107
  527    H    ASP 149           H        ASP 149 132.539  -5.973  -3.137
  528    HA   ASP 149           HA       ASP 149 130.581  -4.918  -5.058
  529   1HB   ASP 149          2HB       ASP 149 129.912  -7.282  -5.376
  530   2HB   ASP 149          1HB       ASP 149 131.613  -7.012  -5.740
  531    H    TYR 150           H        TYR 150 128.324  -6.110  -4.656
  532    HA   TYR 150           HA       TYR 150 127.239  -4.927  -2.359
  533   1HB   TYR 150          2HB       TYR 150 125.975  -5.492  -4.446
  534   2HB   TYR 150          1HB       TYR 150 126.014  -7.182  -3.958
  535    HD1  TYR 150           HD1      TYR 150 125.079  -7.630  -1.510
  536    HD2  TYR 150           HD2      TYR 150 124.116  -4.231  -3.883
  537    HE1  TYR 150           HE1      TYR 150 123.027  -7.301  -0.195
  538    HE2  TYR 150           HE2      TYR 150 122.063  -3.899  -2.576
  539    HH   TYR 150           HH       TYR 150 121.454  -5.560   0.355
  540    H    ASP 151           H        ASP 151 128.548  -8.111  -2.915
  541    HA   ASP 151           HA       ASP 151 127.405  -9.395  -0.666
  542   1HB   ASP 151          2HB       ASP 151 129.449  -9.998  -2.672
  543   2HB   ASP 151          1HB       ASP 151 129.798 -10.701  -1.096
  544    H    GLU 152           H        GLU 152 130.728  -8.201  -1.152
  545    HA   GLU 152           HA       GLU 152 131.505  -8.497   1.537
  546   1HB   GLU 152          2HB       GLU 152 132.708  -6.478  -0.340
  547   2HB   GLU 152          1HB       GLU 152 133.497  -7.378   0.947
  548   1HG   GLU 152          2HG       GLU 152 133.010  -9.462  -0.418
  549   2HG   GLU 152          1HG       GLU 152 132.601  -8.369  -1.739
  550    H    PHE 153           H        PHE 153 129.877  -5.920  -0.160
  551    HA   PHE 153           HA       PHE 153 130.333  -3.814   1.625
  552   1HB   PHE 153          2HB       PHE 153 129.209  -2.781  -0.011
  553   2HB   PHE 153          1HB       PHE 153 128.662  -4.322  -0.651
  554    HD1  PHE 153           HD1      PHE 153 126.405  -4.677  -0.804
  555    HD2  PHE 153           HD2      PHE 153 127.862  -1.970   2.136
  556    HE1  PHE 153           HE1      PHE 153 124.096  -4.127  -0.177
  557    HE2  PHE 153           HE2      PHE 153 125.552  -1.417   2.771
  558    HZ   PHE 153           HZ       PHE 153 123.668  -2.500   1.611
  559    H    LEU 154           H        LEU 154 127.845  -6.330   1.625
  560    HA   LEU 154           HA       LEU 154 126.190  -5.425   3.637
  561   1HB   LEU 154          2HB       LEU 154 126.844  -8.005   2.435
  562   2HB   LEU 154          1HB       LEU 154 126.335  -8.149   4.105
  563    HG   LEU 154           HG       LEU 154 124.504  -8.403   2.419
  564   1HD1  LEU 154          1HD1      LEU 154 123.645  -6.033   3.895
  565   2HD1  LEU 154          2HD1      LEU 154 124.469  -7.234   4.889
  566   3HD1  LEU 154          3HD1      LEU 154 123.046  -7.690   3.953
  567   1HD2  LEU 154          1HD2      LEU 154 125.078  -6.831   0.753
  568   2HD2  LEU 154          2HD2      LEU 154 125.177  -5.515   1.922
  569   3HD2  LEU 154          3HD2      LEU 154 123.611  -6.217   1.514
  570    H    GLU 155           H        GLU 155 129.371  -6.867   3.893
  571    HA   GLU 155           HA       GLU 155 129.190  -7.114   6.780
  572   1HB   GLU 155          2HB       GLU 155 131.150  -7.903   4.687
  573   2HB   GLU 155          1HB       GLU 155 131.771  -7.628   6.308
  574   1HG   GLU 155          2HG       GLU 155 130.217  -9.274   7.197
  575   2HG   GLU 155          1HG       GLU 155 129.559  -9.535   5.581
  576    H    PHE 156           H        PHE 156 130.771  -5.042   4.395
  577    HA   PHE 156           HA       PHE 156 132.499  -3.626   6.023
  578   1HB   PHE 156          2HB       PHE 156 131.805  -3.445   3.416
  579   2HB   PHE 156          1HB       PHE 156 130.997  -2.013   4.041
  580    HD1  PHE 156           HD1      PHE 156 133.244  -2.049   2.032
  581    HD2  PHE 156           HD2      PHE 156 133.249  -1.711   6.275
  582    HE1  PHE 156           HE1      PHE 156 135.371  -0.816   1.929
  583    HE2  PHE 156           HE2      PHE 156 135.374  -0.478   6.178
  584    HZ   PHE 156           HZ       PHE 156 136.438  -0.028   4.005
  585    H    MET 157           H        MET 157 129.042  -3.532   5.912
  586    HA   MET 157           HA       MET 157 128.804  -1.029   7.321
  587   1HB   MET 157          2HB       MET 157 126.790  -3.194   6.689
  588   2HB   MET 157          1HB       MET 157 126.388  -1.691   7.508
  589   1HG   MET 157          2HG       MET 157 127.733  -1.655   4.840
  590   2HG   MET 157          1HG       MET 157 125.992  -1.896   4.970
  591   1HE   MET 157          1HE       MET 157 128.326   0.258   3.935
  592   2HE   MET 157          2HE       MET 157 127.798   1.905   4.279
  593   3HE   MET 157          3HE       MET 157 126.794   0.846   3.289
  594    H    LYS 158           H        LYS 158 127.539  -4.226   8.217
  595    HA   LYS 158           HA       LYS 158 127.484  -3.706  10.971
  596   1HB   LYS 158          2HB       LYS 158 127.201  -6.106   9.252
  597   2HB   LYS 158          1HB       LYS 158 127.583  -6.396  10.943
  598   1HG   LYS 158          2HG       LYS 158 125.609  -4.777  11.403
  599   2HG   LYS 158          1HG       LYS 158 125.150  -5.153   9.741
  600   1HD   LYS 158          2HD       LYS 158 125.029  -7.502  10.254
  601   2HD   LYS 158          1HD       LYS 158 125.660  -7.220  11.878
  602   1HE   LYS 158          2HE       LYS 158 123.686  -6.004  12.497
  603   2HE   LYS 158          1HE       LYS 158 123.080  -6.056  10.842
  604   1HZ   LYS 158          1HZ       LYS 158 121.998  -7.698  12.255
  605   2HZ   LYS 158          2HZ       LYS 158 123.491  -8.419  12.596
  606   3HZ   LYS 158          3HZ       LYS 158 122.877  -8.449  11.020
  607    H    GLY 159           H        GLY 159 129.699  -2.725  11.043
  608   1HA   GLY 159          2HA       GLY 159 131.531  -3.321  12.588
  609   2HA   GLY 159          1HA       GLY 159 131.699  -4.810  11.671
  610    H    VAL 160           H        VAL 160 132.233  -1.353  11.667
  611    HA   VAL 160           HA       VAL 160 133.748  -1.531   9.170
  612    HB   VAL 160           HB       VAL 160 133.312   0.993  10.745
  613   1HG1  VAL 160          1HG1      VAL 160 134.839   0.547   8.587
  614   2HG1  VAL 160          2HG1      VAL 160 134.034   2.084   8.903
  615   3HG1  VAL 160          3HG1      VAL 160 133.308   0.921   7.795
  616   1HG2  VAL 160          1HG2      VAL 160 131.440  -0.036   8.622
  617   2HG2  VAL 160          2HG2      VAL 160 131.259   1.413   9.609
  618   3HG2  VAL 160          3HG2      VAL 160 131.127  -0.181  10.351
  619    H    GLU 161           H        GLU 161 134.847  -2.851  11.404
  620    HA   GLU 161           HA       GLU 161 137.082  -1.107  12.184
  621   1HB   GLU 161          2HB       GLU 161 137.520  -2.829  13.938
  622   2HB   GLU 161          1HB       GLU 161 135.957  -2.040  14.092
  623   1HG   GLU 161          2HG       GLU 161 134.845  -3.950  13.843
  624   2HG   GLU 161          1HG       GLU 161 135.843  -4.457  12.480
  Start of MODEL   18
    1   1H    MET  81          1HT       MET  81  91.599 -14.063   3.279
    2   2H    MET  81          2HT       MET  81  91.004 -12.932   2.133
    3   3H    MET  81          3HT       MET  81  89.910 -13.879   3.055
    4    HA   MET  81           HA       MET  81  90.205 -11.527   3.746
    5   1HB   MET  81          2HB       MET  81  90.542 -13.946   5.494
    6   2HB   MET  81          1HB       MET  81  90.476 -12.339   6.208
    7   1HG   MET  81          2HG       MET  81  88.274 -12.103   5.817
    8   2HG   MET  81          1HG       MET  81  88.343 -12.969   4.283
    9   1HE   MET  81          1HE       MET  81  85.975 -13.208   6.437
   10   2HE   MET  81          2HE       MET  81  85.674 -14.945   6.415
   11   3HE   MET  81          3HE       MET  81  85.965 -14.082   4.905
   12    H    VAL  82           H        VAL  82  91.633  -9.955   4.072
   13    HA   VAL  82           HA       VAL  82  94.417 -10.699   4.684
   14    HB   VAL  82           HB       VAL  82  93.463  -8.144   3.385
   15   1HG1  VAL  82          1HG1      VAL  82  95.605  -7.458   3.328
   16   2HG1  VAL  82          2HG1      VAL  82  96.225  -9.082   3.029
   17   3HG1  VAL  82          3HG1      VAL  82  95.805  -8.586   4.668
   18   1HG2  VAL  82          1HG2      VAL  82  93.362 -10.594   2.205
   19   2HG2  VAL  82          2HG2      VAL  82  94.984 -10.059   1.767
   20   3HG2  VAL  82          3HG2      VAL  82  93.586  -9.071   1.344
   21    H    ARG  83           H        ARG  83  95.467  -9.760   6.377
   22    HA   ARG  83           HA       ARG  83  94.609  -7.411   7.698
   23   1HB   ARG  83          2HB       ARG  83  94.068  -8.672   9.900
   24   2HB   ARG  83          1HB       ARG  83  92.817  -8.522   8.674
   25   1HG   ARG  83          2HG       ARG  83  94.410 -10.914   8.308
   26   2HG   ARG  83          1HG       ARG  83  93.658 -10.850   9.902
   27   1HD   ARG  83          2HD       ARG  83  91.517 -10.208   8.607
   28   2HD   ARG  83          1HD       ARG  83  92.365 -10.846   7.199
   29    HE   ARG  83           HE       ARG  83  91.151 -12.350   9.286
   30   1HH1  ARG  83          1HH1      ARG  83  93.836 -12.356   7.056
   31   2HH1  ARG  83          2HH1      ARG  83  93.972 -14.081   7.029
   32   1HH2  ARG  83          1HH2      ARG  83  91.329 -14.622   9.252
   33   2HH2  ARG  83          2HH2      ARG  83  92.550 -15.368   8.275
   34    H    CYS  84           H        CYS  84  96.309 -10.496   8.008
   35    HA   CYS  84           HA       CYS  84  98.192  -9.491   9.924
   36   1HB   CYS  84          2HB       CYS  84  97.571 -11.883   9.811
   37   2HB   CYS  84          1HB       CYS  84  98.324 -11.989   8.224
   38    HG   CYS  84           HG       CYS  84  99.966 -12.843  10.096
   39    H    MET  85           H        MET  85  99.134  -7.670   8.993
   40    HA   MET  85           HA       MET  85 100.521  -7.931   6.455
   41   1HB   MET  85          2HB       MET  85  99.350  -5.801   7.858
   42   2HB   MET  85          1HB       MET  85 101.077  -5.472   7.871
   43   1HG   MET  85          2HG       MET  85 101.198  -5.299   5.574
   44   2HG   MET  85          1HG       MET  85  99.726  -6.235   5.323
   45   1HE   MET  85          1HE       MET  85  97.273  -5.092   6.502
   46   2HE   MET  85          2HE       MET  85  97.591  -5.314   4.782
   47   3HE   MET  85          3HE       MET  85  96.919  -3.791   5.365
   48    H    LYS  86           H        LYS  86 102.558  -8.574   6.291
   49    HA   LYS  86           HA       LYS  86 104.300  -8.337   8.657
   50   1HB   LYS  86          2HB       LYS  86 105.568 -10.265   7.550
   51   2HB   LYS  86          1HB       LYS  86 104.017 -10.639   8.287
   52   1HG   LYS  86          2HG       LYS  86 103.021 -11.092   6.302
   53   2HG   LYS  86          1HG       LYS  86 104.010  -9.932   5.413
   54   1HD   LYS  86          2HD       LYS  86 105.925 -11.454   5.570
   55   2HD   LYS  86          1HD       LYS  86 104.928 -12.613   6.453
   56   1HE   LYS  86          2HE       LYS  86 103.853 -11.686   3.868
   57   2HE   LYS  86          1HE       LYS  86 105.309 -12.678   3.783
   58   1HZ   LYS  86          1HZ       LYS  86 104.099 -14.293   5.252
   59   2HZ   LYS  86          2HZ       LYS  86 103.487 -14.143   3.683
   60   3HZ   LYS  86          3HZ       LYS  86 102.692 -13.395   4.975
   61    H    ASP  87           H        ASP  87 103.841  -6.407   6.418
   62    HA   ASP  87           HA       ASP  87 106.652  -6.173   5.587
   63   1HB   ASP  87          2HB       ASP  87 105.836  -5.206   3.423
   64   2HB   ASP  87          1HB       ASP  87 105.474  -6.918   3.632
   65    H    ASP  88           H        ASP  88 104.900  -4.929   7.729
   66    HA   ASP  88           HA       ASP  88 104.943  -2.127   6.894
   67   1HB   ASP  88          2HB       ASP  88 103.311  -3.682   8.676
   68   2HB   ASP  88          1HB       ASP  88 104.028  -2.341   9.561
   69    H    SER  89           H        SER  89 105.790  -3.852   9.902
   70    HA   SER  89           HA       SER  89 107.471  -1.903  10.939
   71   1HB   SER  89          2HB       SER  89 108.582  -4.091  12.020
   72   2HB   SER  89          1HB       SER  89 107.014  -3.474  12.537
   73    HG   SER  89           HG       SER  89 107.355  -5.435  10.517
   74    H    LYS  90           H        LYS  90 108.228  -4.594   8.773
   75    HA   LYS  90           HA       LYS  90 111.019  -4.334   8.796
   76   1HB   LYS  90          2HB       LYS  90 109.047  -5.815   7.326
   77   2HB   LYS  90          1HB       LYS  90 110.242  -5.174   6.207
   78   1HG   LYS  90          2HG       LYS  90 111.911  -6.469   7.029
   79   2HG   LYS  90          1HG       LYS  90 111.254  -6.473   8.666
   80   1HD   LYS  90          2HD       LYS  90 109.610  -8.096   8.085
   81   2HD   LYS  90          1HD       LYS  90 109.985  -7.949   6.367
   82   1HE   LYS  90          2HE       LYS  90 112.362  -8.695   7.074
   83   2HE   LYS  90          1HE       LYS  90 111.570  -9.257   8.546
   84   1HZ   LYS  90          1HZ       LYS  90 111.418 -10.307   5.838
   85   2HZ   LYS  90          2HZ       LYS  90 109.969 -10.306   6.711
   86   3HZ   LYS  90          3HZ       LYS  90 111.323 -11.115   7.323
   87    H    GLY  91           H        GLY  91 111.432  -2.069   8.756
   88   1HA   GLY  91          2HA       GLY  91 110.761  -0.634   6.301
   89   2HA   GLY  91          1HA       GLY  91 111.465   0.063   7.752
   90    H    LYS  92           H        LYS  92 113.636   0.303   7.887
   91    HA   LYS  92           HA       LYS  92 115.161  -0.297   5.482
   92   1HB   LYS  92          2HB       LYS  92 115.472   1.541   7.797
   93   2HB   LYS  92          1HB       LYS  92 116.944   0.987   7.008
   94   1HG   LYS  92          2HG       LYS  92 116.584   2.828   5.754
   95   2HG   LYS  92          1HG       LYS  92 115.564   1.711   4.844
   96   1HD   LYS  92          2HD       LYS  92 113.861   2.600   6.796
   97   2HD   LYS  92          1HD       LYS  92 114.834   4.034   6.468
   98   1HE   LYS  92          2HE       LYS  92 113.642   2.430   4.234
   99   2HE   LYS  92          1HE       LYS  92 112.687   3.641   5.088
  100   1HZ   LYS  92          1HZ       LYS  92 114.128   4.211   2.960
  101   2HZ   LYS  92          2HZ       LYS  92 115.317   4.462   4.136
  102   3HZ   LYS  92          3HZ       LYS  92 113.869   5.334   4.200
  103    H    THR  93           H        THR  93 115.675  -2.435   5.512
  104    HA   THR  93           HA       THR  93 117.174  -3.424   7.846
  105    HB   THR  93           HB       THR  93 116.104  -5.349   5.856
  106    HG1  THR  93           HG1      THR  93 114.029  -5.199   6.649
  107   1HG2  THR  93          1HG2      THR  93 115.277  -6.053   8.397
  108   2HG2  THR  93          2HG2      THR  93 116.877  -5.348   8.635
  109   3HG2  THR  93          3HG2      THR  93 116.663  -6.698   7.519
  110    H    GLU  94           H        GLU  94 117.993  -5.799   6.188
  111    HA   GLU  94           HA       GLU  94 120.495  -4.815   5.320
  112   1HB   GLU  94          2HB       GLU  94 119.293  -7.335   5.783
  113   2HB   GLU  94          1HB       GLU  94 119.922  -7.361   4.142
  114   1HG   GLU  94          2HG       GLU  94 122.004  -7.569   4.862
  115   2HG   GLU  94          1HG       GLU  94 121.832  -6.195   5.952
  116    H    GLU  95           H        GLU  95 117.539  -4.571   3.832
  117    HA   GLU  95           HA       GLU  95 118.587  -4.821   1.116
  118   1HB   GLU  95          2HB       GLU  95 115.830  -4.542   2.270
  119   2HB   GLU  95          1HB       GLU  95 116.121  -4.194   0.571
  120   1HG   GLU  95          2HG       GLU  95 116.622  -6.800   1.984
  121   2HG   GLU  95          1HG       GLU  95 115.344  -6.454   0.820
  122    H    GLU  96           H        GLU  96 118.594  -2.492   3.420
  123    HA   GLU  96           HA       GLU  96 118.007  -0.277   1.601
  124   1HB   GLU  96          2HB       GLU  96 118.052   1.150   3.535
  125   2HB   GLU  96          1HB       GLU  96 117.070  -0.258   3.914
  126   1HG   GLU  96          2HG       GLU  96 118.281  -0.502   5.749
  127   2HG   GLU  96          1HG       GLU  96 119.635  -0.960   4.717
  128    H    LEU  97           H        LEU  97 120.644  -1.901   3.183
  129    HA   LEU  97           HA       LEU  97 122.631   0.041   3.051
  130   1HB   LEU  97          2HB       LEU  97 122.583  -2.927   3.103
  131   2HB   LEU  97          1HB       LEU  97 124.085  -2.161   2.622
  132    HG   LEU  97           HG       LEU  97 122.751  -1.266   5.141
  133   1HD1  LEU  97          1HD1      LEU  97 124.388  -3.063   6.172
  134   2HD1  LEU  97          2HD1      LEU  97 124.037  -3.899   4.659
  135   3HD1  LEU  97          3HD1      LEU  97 122.722  -3.462   5.750
  136   1HD2  LEU  97          1HD2      LEU  97 125.402  -1.118   3.863
  137   2HD2  LEU  97          2HD2      LEU  97 125.403  -1.376   5.609
  138   3HD2  LEU  97          3HD2      LEU  97 124.585   0.028   4.925
  139    H    SER  98           H        SER  98 121.112  -1.735   0.514
  140    HA   SER  98           HA       SER  98 123.189  -1.538  -1.415
  141   1HB   SER  98          2HB       SER  98 121.273  -1.950  -3.047
  142   2HB   SER  98          1HB       SER  98 121.520  -3.183  -1.811
  143    HG   SER  98           HG       SER  98 119.748  -2.487  -0.743
  144    H    ASP  99           H        ASP  99 120.610   0.579  -0.378
  145    HA   ASP  99           HA       ASP  99 120.523   2.337  -2.550
  146   1HB   ASP  99          2HB       ASP  99 118.882   2.355  -0.705
  147   2HB   ASP  99          1HB       ASP  99 120.120   2.978   0.383
  148    H    LEU 100           H        LEU 100 122.501   2.456   0.401
  149    HA   LEU 100           HA       LEU 100 123.916   4.802  -0.407
  150   1HB   LEU 100          2HB       LEU 100 124.371   2.762   1.758
  151   2HB   LEU 100          1HB       LEU 100 125.470   4.100   1.489
  152    HG   LEU 100           HG       LEU 100 122.546   4.582   1.973
  153   1HD1  LEU 100          1HD1      LEU 100 123.286   5.009   4.374
  154   2HD1  LEU 100          2HD1      LEU 100 124.703   4.034   3.987
  155   3HD1  LEU 100          3HD1      LEU 100 123.090   3.328   3.876
  156   1HD2  LEU 100          1HD2      LEU 100 125.069   6.203   2.205
  157   2HD2  LEU 100          2HD2      LEU 100 123.541   6.710   2.927
  158   3HD2  LEU 100          3HD2      LEU 100 123.665   6.500   1.180
  159    H    PHE 101           H        PHE 101 124.290   1.402  -0.948
  160    HA   PHE 101           HA       PHE 101 127.039   1.293  -1.494
  161   1HB   PHE 101          2HB       PHE 101 125.585  -0.700  -1.196
  162   2HB   PHE 101          1HB       PHE 101 124.849  -0.366  -2.761
  163    HD1  PHE 101           HD1      PHE 101 127.844  -1.554  -1.037
  164    HD2  PHE 101           HD2      PHE 101 126.046  -0.775  -4.815
  165    HE1  PHE 101           HE1      PHE 101 129.608  -2.864  -2.143
  166    HE2  PHE 101           HE2      PHE 101 127.807  -2.084  -5.927
  167    HZ   PHE 101           HZ       PHE 101 129.591  -3.129  -4.591
  168    H    ARG 102           H        ARG 102 124.296   1.648  -3.762
  169    HA   ARG 102           HA       ARG 102 125.748   1.922  -6.100
  170   1HB   ARG 102          2HB       ARG 102 123.056   2.772  -5.187
  171   2HB   ARG 102          1HB       ARG 102 123.679   3.549  -6.636
  172   1HG   ARG 102          2HG       ARG 102 123.761   1.547  -7.824
  173   2HG   ARG 102          1HG       ARG 102 123.682   0.568  -6.357
  174   1HD   ARG 102          2HD       ARG 102 121.372   1.406  -5.992
  175   2HD   ARG 102          1HD       ARG 102 121.471   2.239  -7.543
  176    HE   ARG 102           HE       ARG 102 121.020  -0.558  -7.108
  177   1HH1  ARG 102          1HH1      ARG 102 122.282   1.797  -9.354
  178   2HH1  ARG 102          2HH1      ARG 102 122.039   0.789 -10.741
  179   1HH2  ARG 102          1HH2      ARG 102 120.700  -1.884  -8.930
  180   2HH2  ARG 102          2HH2      ARG 102 121.139  -1.301 -10.501
  181    H    MET 103           H        MET 103 124.908   4.359  -3.692
  182    HA   MET 103           HA       MET 103 125.701   6.658  -5.027
  183   1HB   MET 103          2HB       MET 103 126.018   6.040  -2.084
  184   2HB   MET 103          1HB       MET 103 126.055   7.646  -2.802
  185   1HG   MET 103          2HG       MET 103 123.676   5.866  -3.142
  186   2HG   MET 103          1HG       MET 103 123.893   6.827  -1.682
  187   1HE   MET 103          1HE       MET 103 123.167   9.861  -1.904
  188   2HE   MET 103          2HE       MET 103 122.479   8.316  -1.405
  189   3HE   MET 103          3HE       MET 103 121.617   9.333  -2.560
  190    H    PHE 104           H        PHE 104 127.612   4.105  -3.677
  191    HA   PHE 104           HA       PHE 104 130.075   5.627  -3.723
  192   1HB   PHE 104          2HB       PHE 104 129.174   3.107  -2.611
  193   2HB   PHE 104          1HB       PHE 104 130.706   2.911  -3.455
  194    HD1  PHE 104           HD1      PHE 104 129.061   5.192  -1.008
  195    HD2  PHE 104           HD2      PHE 104 132.651   3.307  -2.300
  196    HE1  PHE 104           HE1      PHE 104 130.245   6.119   0.940
  197    HE2  PHE 104           HE2      PHE 104 133.840   4.229  -0.355
  198    HZ   PHE 104           HZ       PHE 104 132.637   5.638   1.269
  199    H    ASP 105           H        ASP 105 128.217   4.006  -6.011
  200    HA   ASP 105           HA       ASP 105 130.508   3.202  -7.635
  201   1HB   ASP 105          2HB       ASP 105 127.952   2.137  -7.289
  202   2HB   ASP 105          1HB       ASP 105 127.902   2.874  -8.887
  203    H    LYS 106           H        LYS 106 131.128   4.227  -9.473
  204    HA   LYS 106           HA       LYS 106 129.716   6.726 -10.117
  205   1HB   LYS 106          2HB       LYS 106 132.042   7.019  -9.404
  206   2HB   LYS 106          1HB       LYS 106 132.581   5.927 -10.672
  207   1HG   LYS 106          2HG       LYS 106 132.947   8.262 -11.272
  208   2HG   LYS 106          1HG       LYS 106 131.807   7.482 -12.370
  209   1HD   LYS 106          2HD       LYS 106 129.964   8.585 -11.412
  210   2HD   LYS 106          1HD       LYS 106 130.889   9.067  -9.989
  211   1HE   LYS 106          2HE       LYS 106 132.348  10.259 -11.899
  212   2HE   LYS 106          1HE       LYS 106 130.768  10.279 -12.683
  213   1HZ   LYS 106          1HZ       LYS 106 130.831  11.129  -9.903
  214   2HZ   LYS 106          2HZ       LYS 106 129.957  11.757 -11.209
  215   3HZ   LYS 106          3HZ       LYS 106 131.587  12.164 -11.009
  216    H    ASN 107           H        ASN 107 131.234   3.874 -11.565
  217    HA   ASN 107           HA       ASN 107 130.065   4.587 -14.157
  218   1HB   ASN 107          2HB       ASN 107 131.513   2.716 -15.017
  219   2HB   ASN 107          1HB       ASN 107 132.393   4.071 -14.316
  220   1HD2  ASN 107          1HD2      ASN 107 133.800   3.679 -12.744
  221   2HD2  ASN 107          2HD2      ASN 107 133.991   2.169 -11.927
  222    H    ALA 108           H        ALA 108 128.998   3.041 -11.539
  223    HA   ALA 108           HA       ALA 108 127.597   1.286 -11.087
  224   1HB   ALA 108          1HB       ALA 108 125.639   1.208 -12.521
  225   2HB   ALA 108          2HB       ALA 108 126.505   2.090 -13.780
  226   3HB   ALA 108          3HB       ALA 108 126.135   2.878 -12.246
  227    H    ASP 109           H        ASP 109 129.282  -0.336 -11.237
  228    HA   ASP 109           HA       ASP 109 128.874  -2.120 -13.544
  229   1HB   ASP 109          2HB       ASP 109 131.253  -2.791 -13.362
  230   2HB   ASP 109          1HB       ASP 109 131.055  -1.091 -13.781
  231    H    GLY 110           H        GLY 110 128.446  -1.792 -10.286
  232   1HA   GLY 110          2HA       GLY 110 127.481  -3.534  -8.985
  233   2HA   GLY 110          1HA       GLY 110 128.357  -4.706  -9.959
  234    H    TYR 111           H        TYR 111 130.727  -2.705  -9.569
  235    HA   TYR 111           HA       TYR 111 131.416  -3.470  -6.818
  236   1HB   TYR 111          2HB       TYR 111 133.222  -3.777  -9.230
  237   2HB   TYR 111          1HB       TYR 111 133.694  -4.060  -7.558
  238    HD1  TYR 111           HD1      TYR 111 131.315  -5.224 -10.172
  239    HD2  TYR 111           HD2      TYR 111 133.429  -6.174  -6.605
  240    HE1  TYR 111           HE1      TYR 111 130.579  -7.563 -10.366
  241    HE2  TYR 111           HE2      TYR 111 132.701  -8.515  -6.790
  242    HH   TYR 111           HH       TYR 111 131.524  -9.866  -9.512
  243    H    ILE 112           H        ILE 112 133.025  -2.120  -5.828
  244    HA   ILE 112           HA       ILE 112 133.167   0.543  -7.074
  245    HB   ILE 112           HB       ILE 112 133.481  -0.134  -4.148
  246   1HG1  ILE 112          2HG1      ILE 112 131.119   1.382  -5.078
  247   2HG1  ILE 112          1HG1      ILE 112 131.148  -0.320  -5.533
  248   1HG2  ILE 112          1HG2      ILE 112 133.642   2.358  -5.742
  249   2HG2  ILE 112          2HG2      ILE 112 134.510   1.886  -4.280
  250   3HG2  ILE 112          3HG2      ILE 112 132.844   2.452  -4.172
  251   1HD1  ILE 112          1HD1      ILE 112 131.682  -0.706  -3.024
  252   2HD1  ILE 112          2HD1      ILE 112 130.027  -0.365  -3.531
  253   3HD1  ILE 112          3HD1      ILE 112 131.015   0.914  -2.824
  254    H    ASP 113           H        ASP 113 135.092   1.599  -7.283
  255    HA   ASP 113           HA       ASP 113 137.507   0.073  -6.562
  256   1HB   ASP 113          2HB       ASP 113 136.736   0.608  -9.091
  257   2HB   ASP 113          1HB       ASP 113 137.671   2.063  -8.753
  258    H    LEU 114           H        LEU 114 139.504   1.662  -6.671
  259    HA   LEU 114           HA       LEU 114 139.259   3.419  -4.504
  260   1HB   LEU 114          2HB       LEU 114 141.367   3.024  -6.602
  261   2HB   LEU 114          1HB       LEU 114 141.523   4.290  -5.399
  262    HG   LEU 114           HG       LEU 114 141.155   1.386  -4.684
  263   1HD1  LEU 114          1HD1      LEU 114 143.664   2.970  -5.153
  264   2HD1  LEU 114          2HD1      LEU 114 143.195   1.422  -5.858
  265   3HD1  LEU 114          3HD1      LEU 114 143.627   1.519  -4.151
  266   1HD2  LEU 114          1HD2      LEU 114 142.399   3.512  -2.989
  267   2HD2  LEU 114          2HD2      LEU 114 141.631   2.000  -2.504
  268   3HD2  LEU 114          3HD2      LEU 114 140.644   3.348  -3.069
  269    H    GLU 115           H        GLU 115 139.109   3.979  -7.975
  270    HA   GLU 115           HA       GLU 115 139.252   6.790  -7.916
  271   1HB   GLU 115          2HB       GLU 115 138.315   4.748  -9.868
  272   2HB   GLU 115          1HB       GLU 115 137.804   6.411 -10.124
  273   1HG   GLU 115          2HG       GLU 115 140.325   6.954  -9.836
  274   2HG   GLU 115          1HG       GLU 115 140.548   5.241 -10.193
  275    H    GLU 116           H        GLU 116 136.576   4.548  -7.521
  276    HA   GLU 116           HA       GLU 116 134.490   6.456  -7.696
  277   1HB   GLU 116          2HB       GLU 116 134.769   3.642  -6.838
  278   2HB   GLU 116          1HB       GLU 116 133.427   4.520  -6.122
  279   1HG   GLU 116          2HG       GLU 116 132.353   3.788  -7.952
  280   2HG   GLU 116          1HG       GLU 116 133.082   5.217  -8.680
  281    H    LEU 117           H        LEU 117 135.819   4.805  -4.833
  282    HA   LEU 117           HA       LEU 117 134.524   6.419  -2.942
  283   1HB   LEU 117          2HB       LEU 117 136.406   5.614  -1.405
  284   2HB   LEU 117          1HB       LEU 117 135.346   4.410  -2.113
  285    HG   LEU 117           HG       LEU 117 137.554   4.753  -3.876
  286   1HD1  LEU 117          1HD1      LEU 117 139.407   4.858  -2.642
  287   2HD1  LEU 117          2HD1      LEU 117 138.773   3.738  -1.436
  288   3HD1  LEU 117          3HD1      LEU 117 138.370   5.452  -1.347
  289   1HD2  LEU 117          1HD2      LEU 117 136.017   2.751  -3.306
  290   2HD2  LEU 117          2HD2      LEU 117 137.189   2.428  -2.029
  291   3HD2  LEU 117          3HD2      LEU 117 137.705   2.447  -3.715
  292    H    LYS 118           H        LYS 118 137.181   7.117  -4.970
  293    HA   LYS 118           HA       LYS 118 138.441   9.049  -3.270
  294   1HB   LYS 118          2HB       LYS 118 138.816   8.008  -5.999
  295   2HB   LYS 118          1HB       LYS 118 139.283   9.690  -5.784
  296   1HG   LYS 118          2HG       LYS 118 140.238   7.647  -3.834
  297   2HG   LYS 118          1HG       LYS 118 141.014   7.778  -5.415
  298   1HD   LYS 118          2HD       LYS 118 141.179  10.293  -4.889
  299   2HD   LYS 118          1HD       LYS 118 140.849   9.819  -3.222
  300   1HE   LYS 118          2HE       LYS 118 143.129   8.850  -4.942
  301   2HE   LYS 118          1HE       LYS 118 143.243   9.989  -3.601
  302   1HZ   LYS 118          1HZ       LYS 118 143.544   7.288  -3.437
  303   2HZ   LYS 118          2HZ       LYS 118 141.977   7.533  -2.850
  304   3HZ   LYS 118          3HZ       LYS 118 143.283   8.335  -2.135
  305    H    ILE 119           H        ILE 119 136.413   9.298  -6.202
  306    HA   ILE 119           HA       ILE 119 136.279  12.070  -6.323
  307    HB   ILE 119           HB       ILE 119 134.066  11.716  -7.499
  308   1HG1  ILE 119          2HG1      ILE 119 134.779   8.795  -7.203
  309   2HG1  ILE 119          1HG1      ILE 119 133.517   9.594  -6.273
  310   1HG2  ILE 119          1HG2      ILE 119 136.674  10.545  -8.294
  311   2HG2  ILE 119          2HG2      ILE 119 135.777  11.895  -8.991
  312   3HG2  ILE 119          3HG2      ILE 119 135.275  10.238  -9.322
  313   1HD1  ILE 119          1HD1      ILE 119 132.403  10.169  -8.421
  314   2HD1  ILE 119          2HD1      ILE 119 132.494   8.441  -8.079
  315   3HD1  ILE 119          3HD1      ILE 119 133.600   9.169  -9.244
  316    H    MET 120           H        MET 120 134.212   9.807  -4.540
  317    HA   MET 120           HA       MET 120 132.407  11.787  -3.602
  318   1HB   MET 120          2HB       MET 120 131.593  10.068  -2.081
  319   2HB   MET 120          1HB       MET 120 131.820   9.406  -3.692
  320   1HG   MET 120          2HG       MET 120 133.158   7.839  -2.906
  321   2HG   MET 120          1HG       MET 120 134.224   9.055  -2.203
  322   1HE   MET 120          1HE       MET 120 134.427   6.623  -0.120
  323   2HE   MET 120          2HE       MET 120 134.250   7.816   1.167
  324   3HE   MET 120          3HE       MET 120 135.059   8.255  -0.337
  325    H    LEU 121           H        LEU 121 135.485  10.602  -2.466
  326    HA   LEU 121           HA       LEU 121 135.258  11.688   0.171
  327   1HB   LEU 121          2HB       LEU 121 137.274  10.264  -1.401
  328   2HB   LEU 121          1HB       LEU 121 137.958  11.452  -0.309
  329    HG   LEU 121           HG       LEU 121 135.930   9.608   0.827
  330   1HD1  LEU 121          1HD1      LEU 121 136.987   7.833  -0.091
  331   2HD1  LEU 121          2HD1      LEU 121 138.111   8.115   1.241
  332   3HD1  LEU 121          3HD1      LEU 121 138.482   8.726  -0.371
  333   1HD2  LEU 121          1HD2      LEU 121 138.553  10.125   2.078
  334   2HD2  LEU 121          2HD2      LEU 121 136.938  10.111   2.786
  335   3HD2  LEU 121          3HD2      LEU 121 137.491  11.518   1.877
  336    H    GLN 122           H        GLN 122 136.864  12.732  -2.817
  337    HA   GLN 122           HA       GLN 122 138.020  15.073  -1.769
  338   1HB   GLN 122          2HB       GLN 122 137.155  14.446  -4.598
  339   2HB   GLN 122          1HB       GLN 122 138.176  15.801  -4.137
  340   1HG   GLN 122          2HG       GLN 122 139.133  13.212  -3.181
  341   2HG   GLN 122          1HG       GLN 122 139.063  13.355  -4.936
  342   1HE2  GLN 122          1HE2      GLN 122 139.762  15.780  -2.459
  343   2HE2  GLN 122          2HE2      GLN 122 141.342  16.173  -3.037
  344    H    ALA 123           H        ALA 123 134.797  14.340  -2.831
  345    HA   ALA 123           HA       ALA 123 133.970  17.082  -3.099
  346   1HB   ALA 123          1HB       ALA 123 131.654  15.975  -3.148
  347   2HB   ALA 123          2HB       ALA 123 132.540  14.451  -3.167
  348   3HB   ALA 123          3HB       ALA 123 132.775  15.622  -4.464
  349    H    THR 124           H        THR 124 134.639  15.182  -0.443
  350    HA   THR 124           HA       THR 124 132.502  15.834   1.291
  351    HB   THR 124           HB       THR 124 133.949  15.074   3.080
  352    HG1  THR 124           HG1      THR 124 135.995  15.392   1.159
  353   1HG2  THR 124          1HG2      THR 124 133.422  13.059   2.305
  354   2HG2  THR 124          2HG2      THR 124 135.052  13.034   1.632
  355   3HG2  THR 124          3HG2      THR 124 133.690  13.534   0.628
  356    H    GLY 125           H        GLY 125 133.437  16.958   3.532
  357   1HA   GLY 125          2HA       GLY 125 133.975  19.710   2.662
  358   2HA   GLY 125          1HA       GLY 125 133.266  19.239   4.197
  359    H    GLU 126           H        GLU 126 135.616  17.098   4.050
  360    HA   GLU 126           HA       GLU 126 137.591  18.909   5.271
  361   1HB   GLU 126          2HB       GLU 126 138.361  16.765   6.451
  362   2HB   GLU 126          1HB       GLU 126 136.854  17.494   6.989
  363   1HG   GLU 126          2HG       GLU 126 135.575  15.877   5.743
  364   2HG   GLU 126          1HG       GLU 126 137.050  15.188   5.067
  365    H    THR 127           H        THR 127 139.828  17.565   5.365
  366    HA   THR 127           HA       THR 127 140.392  16.845   2.564
  367    HB   THR 127           HB       THR 127 142.775  17.489   3.177
  368    HG1  THR 127           HG1      THR 127 142.275  17.449   5.496
  369   1HG2  THR 127          1HG2      THR 127 142.101  19.225   1.957
  370   2HG2  THR 127          2HG2      THR 127 141.918  20.053   3.502
  371   3HG2  THR 127          3HG2      THR 127 140.522  19.288   2.743
  372    H    ILE 128           H        ILE 128 141.040  14.839   2.146
  373    HA   ILE 128           HA       ILE 128 142.069  13.208   4.376
  374    HB   ILE 128           HB       ILE 128 140.492  12.155   2.030
  375   1HG1  ILE 128          2HG1      ILE 128 139.032  13.574   3.357
  376   2HG1  ILE 128          1HG1      ILE 128 138.627  11.886   3.649
  377   1HG2  ILE 128          1HG2      ILE 128 142.124  10.657   3.262
  378   2HG2  ILE 128          2HG2      ILE 128 140.456  10.090   3.162
  379   3HG2  ILE 128          3HG2      ILE 128 141.056  10.810   4.657
  380   1HD1  ILE 128          1HD1      ILE 128 140.313  12.217   5.659
  381   2HD1  ILE 128          2HD1      ILE 128 138.607  12.650   5.780
  382   3HD1  ILE 128          3HD1      ILE 128 139.812  13.897   5.464
  383    H    THR 129           H        THR 129 143.795  11.853   3.978
  384    HA   THR 129           HA       THR 129 145.446  12.570   1.728
  385    HB   THR 129           HB       THR 129 146.578  12.284   3.802
  386    HG1  THR 129           HG1      THR 129 147.908  11.482   2.306
  387   1HG2  THR 129          1HG2      THR 129 144.957   9.836   4.043
  388   2HG2  THR 129          2HG2      THR 129 145.493  10.975   5.277
  389   3HG2  THR 129          3HG2      THR 129 146.608   9.759   4.655
  390    H    GLU 130           H        GLU 130 146.546  10.863   0.428
  391    HA   GLU 130           HA       GLU 130 144.605   9.244  -0.872
  392   1HB   GLU 130          2HB       GLU 130 146.906  10.347  -1.687
  393   2HB   GLU 130          1HB       GLU 130 147.496   8.729  -1.329
  394   1HG   GLU 130          2HG       GLU 130 146.851   8.188  -3.379
  395   2HG   GLU 130          1HG       GLU 130 145.199   8.256  -2.767
  396    H    ASP 131           H        ASP 131 147.054   8.639   1.549
  397    HA   ASP 131           HA       ASP 131 147.154   5.831   1.340
  398   1HB   ASP 131          2HB       ASP 131 147.996   7.866   3.313
  399   2HB   ASP 131          1HB       ASP 131 147.721   6.251   3.962
  400    H    ASP 132           H        ASP 132 145.242   7.944   3.472
  401    HA   ASP 132           HA       ASP 132 143.909   5.932   4.877
  402   1HB   ASP 132          2HB       ASP 132 143.272   8.798   4.261
  403   2HB   ASP 132          1HB       ASP 132 142.090   7.791   5.093
  404    H    ILE 133           H        ILE 133 143.102   7.531   1.829
  405    HA   ILE 133           HA       ILE 133 140.563   6.298   1.520
  406    HB   ILE 133           HB       ILE 133 142.345   7.404  -0.651
  407   1HG1  ILE 133          2HG1      ILE 133 140.129   8.876   0.766
  408   2HG1  ILE 133          1HG1      ILE 133 141.796   8.945   1.327
  409   1HG2  ILE 133          1HG2      ILE 133 140.210   7.772  -1.838
  410   2HG2  ILE 133          2HG2      ILE 133 139.372   6.930  -0.534
  411   3HG2  ILE 133          3HG2      ILE 133 140.542   6.065  -1.534
  412   1HD1  ILE 133          1HD1      ILE 133 142.380   9.723  -1.022
  413   2HD1  ILE 133          2HD1      ILE 133 141.507  10.853   0.014
  414   3HD1  ILE 133          3HD1      ILE 133 140.647   9.963  -1.245
  415    H    GLU 134           H        GLU 134 143.815   5.288   0.838
  416    HA   GLU 134           HA       GLU 134 143.039   3.171  -0.962
  417   1HB   GLU 134          2HB       GLU 134 145.351   4.516  -0.641
  418   2HB   GLU 134          1HB       GLU 134 145.698   3.100   0.342
  419   1HG   GLU 134          2HG       GLU 134 145.352   1.641  -1.512
  420   2HG   GLU 134          1HG       GLU 134 144.749   2.966  -2.507
  421    H    GLU 135           H        GLU 135 143.612   3.551   2.450
  422    HA   GLU 135           HA       GLU 135 143.963   0.814   3.091
  423   1HB   GLU 135          2HB       GLU 135 143.215   3.257   4.666
  424   2HB   GLU 135          1HB       GLU 135 143.158   1.667   5.413
  425   1HG   GLU 135          2HG       GLU 135 145.580   1.432   4.555
  426   2HG   GLU 135          1HG       GLU 135 145.518   3.186   4.389
  427    H    LEU 136           H        LEU 136 141.169   2.751   2.423
  428    HA   LEU 136           HA       LEU 136 139.185   1.334   3.768
  429   1HB   LEU 136          2HB       LEU 136 139.321   3.219   1.539
  430   2HB   LEU 136          1HB       LEU 136 137.975   2.101   1.411
  431    HG   LEU 136           HG       LEU 136 137.331   2.778   3.761
  432   1HD1  LEU 136          1HD1      LEU 136 139.769   3.893   3.908
  433   2HD1  LEU 136          2HD1      LEU 136 138.401   4.407   4.896
  434   3HD1  LEU 136          3HD1      LEU 136 138.819   5.300   3.434
  435   1HD2  LEU 136          1HD2      LEU 136 137.222   5.245   2.146
  436   2HD2  LEU 136          2HD2      LEU 136 135.924   4.331   2.916
  437   3HD2  LEU 136          3HD2      LEU 136 136.599   3.783   1.382
  438    H    MET 137           H        MET 137 140.480   0.830   0.497
  439    HA   MET 137           HA       MET 137 138.817  -1.328  -0.188
  440   1HB   MET 137          2HB       MET 137 140.869   0.116  -1.413
  441   2HB   MET 137          1HB       MET 137 141.463  -1.538  -1.362
  442   1HG   MET 137          2HG       MET 137 140.310  -1.859  -3.229
  443   2HG   MET 137          1HG       MET 137 138.871  -1.846  -2.211
  444   1HE   MET 137          1HE       MET 137 137.053   0.382  -4.578
  445   2HE   MET 137          2HE       MET 137 136.872  -0.508  -3.065
  446   3HE   MET 137          3HE       MET 137 137.593  -1.295  -4.470
  447    H    LYS 138           H        LYS 138 141.917  -1.196   1.481
  448    HA   LYS 138           HA       LYS 138 142.556  -3.907   1.472
  449   1HB   LYS 138          2HB       LYS 138 143.933  -1.888   2.297
  450   2HB   LYS 138          1HB       LYS 138 143.106  -2.123   3.831
  451   1HG   LYS 138          2HG       LYS 138 144.457  -4.449   2.557
  452   2HG   LYS 138          1HG       LYS 138 145.434  -3.224   3.368
  453   1HD   LYS 138          2HD       LYS 138 143.523  -3.613   5.227
  454   2HD   LYS 138          1HD       LYS 138 143.570  -5.216   4.491
  455   1HE   LYS 138          2HE       LYS 138 145.837  -5.515   5.028
  456   2HE   LYS 138          1HE       LYS 138 146.070  -3.799   5.359
  457   1HZ   LYS 138          1HZ       LYS 138 144.586  -4.050   7.289
  458   2HZ   LYS 138          2HZ       LYS 138 145.977  -5.005   7.413
  459   3HZ   LYS 138          3HZ       LYS 138 144.499  -5.714   6.995
  460    H    ASP 139           H        ASP 139 140.510  -2.063   3.699
  461    HA   ASP 139           HA       ASP 139 139.842  -4.537   5.117
  462   1HB   ASP 139          2HB       ASP 139 139.997  -1.728   5.852
  463   2HB   ASP 139          1HB       ASP 139 138.470  -2.449   6.349
  464    H    GLY 140           H        GLY 140 138.852  -3.745   2.381
  465   1HA   GLY 140          2HA       GLY 140 135.987  -4.051   2.998
  466   2HA   GLY 140          1HA       GLY 140 136.524  -2.915   1.769
  467    H    ASP 141           H        ASP 141 138.601  -4.543   0.680
  468    HA   ASP 141           HA       ASP 141 136.974  -6.257  -0.987
  469   1HB   ASP 141          2HB       ASP 141 139.372  -4.780  -1.316
  470   2HB   ASP 141          1HB       ASP 141 139.773  -6.475  -1.582
  471    H    LYS 142           H        LYS 142 136.526  -8.245  -0.354
  472    HA   LYS 142           HA       LYS 142 138.319  -9.671   1.433
  473   1HB   LYS 142          2HB       LYS 142 135.507 -10.044   0.495
  474   2HB   LYS 142          1HB       LYS 142 136.382 -11.439   1.114
  475   1HG   LYS 142          2HG       LYS 142 134.980 -10.250   2.796
  476   2HG   LYS 142          1HG       LYS 142 136.679 -10.417   3.238
  477   1HD   LYS 142          2HD       LYS 142 137.032  -8.091   2.348
  478   2HD   LYS 142          1HD       LYS 142 135.278  -7.958   2.198
  479   1HE   LYS 142          2HE       LYS 142 136.370  -8.848   4.809
  480   2HE   LYS 142          1HE       LYS 142 136.597  -7.157   4.368
  481   1HZ   LYS 142          1HZ       LYS 142 134.584  -7.109   5.441
  482   2HZ   LYS 142          2HZ       LYS 142 134.097  -8.623   4.863
  483   3HZ   LYS 142          3HZ       LYS 142 134.080  -7.280   3.835
  484    H    ASN 143           H        ASN 143 137.128  -9.873  -1.877
  485    HA   ASN 143           HA       ASN 143 138.484 -12.374  -2.378
  486   1HB   ASN 143          2HB       ASN 143 137.728 -11.966  -4.746
  487   2HB   ASN 143          1HB       ASN 143 136.429 -12.032  -3.557
  488   1HD2  ASN 143          1HD2      ASN 143 135.211 -10.911  -5.211
  489   2HD2  ASN 143          2HD2      ASN 143 135.338  -9.194  -5.338
  490    H    ASN 144           H        ASN 144 139.418  -9.161  -2.221
  491    HA   ASN 144           HA       ASN 144 141.266  -8.010  -2.843
  492   1HB   ASN 144          2HB       ASN 144 142.234 -10.179  -1.813
  493   2HB   ASN 144          1HB       ASN 144 142.602 -10.628  -3.477
  494   1HD2  ASN 144          1HD2      ASN 144 144.582 -10.174  -4.062
  495   2HD2  ASN 144          2HD2      ASN 144 145.542  -8.855  -3.495
  496    H    ASP 145           H        ASP 145 139.284  -8.882  -4.930
  497    HA   ASP 145           HA       ASP 145 140.779  -9.329  -7.327
  498   1HB   ASP 145          2HB       ASP 145 138.640  -9.025  -8.473
  499   2HB   ASP 145          1HB       ASP 145 138.455 -10.095  -7.086
  500    H    GLY 146           H        GLY 146 140.077  -6.565  -5.459
  501   1HA   GLY 146          2HA       GLY 146 141.322  -4.546  -5.994
  502   2HA   GLY 146          1HA       GLY 146 140.981  -4.855  -7.688
  503    H    ARG 147           H        ARG 147 138.183  -5.602  -6.187
  504    HA   ARG 147           HA       ARG 147 137.199  -2.865  -5.953
  505   1HB   ARG 147          2HB       ARG 147 135.730  -4.847  -7.681
  506   2HB   ARG 147          1HB       ARG 147 135.445  -3.120  -7.524
  507   1HG   ARG 147          2HG       ARG 147 137.961  -3.062  -8.430
  508   2HG   ARG 147          1HG       ARG 147 137.425  -4.579  -9.155
  509   1HD   ARG 147          2HD       ARG 147 135.546  -2.321  -9.382
  510   2HD   ARG 147          1HD       ARG 147 137.057  -2.144 -10.273
  511    HE   ARG 147           HE       ARG 147 135.805  -4.687 -10.686
  512   1HH1  ARG 147          1HH1      ARG 147 135.844  -1.349 -11.701
  513   2HH1  ARG 147          2HH1      ARG 147 135.195  -1.688 -13.270
  514   1HH2  ARG 147          1HH2      ARG 147 134.952  -5.135 -12.750
  515   2HH2  ARG 147          2HH2      ARG 147 134.689  -3.837 -13.865
  516    H    ILE 148           H        ILE 148 135.128  -2.712  -4.900
  517    HA   ILE 148           HA       ILE 148 134.593  -5.046  -3.189
  518    HB   ILE 148           HB       ILE 148 133.795  -2.196  -2.612
  519   1HG1  ILE 148          2HG1      ILE 148 136.230  -3.682  -1.602
  520   2HG1  ILE 148          1HG1      ILE 148 136.261  -2.397  -2.805
  521   1HG2  ILE 148          1HG2      ILE 148 132.677  -4.230  -1.497
  522   2HG2  ILE 148          2HG2      ILE 148 133.257  -2.919  -0.469
  523   3HG2  ILE 148          3HG2      ILE 148 134.201  -4.398  -0.627
  524   1HD1  ILE 148          1HD1      ILE 148 136.658  -2.029  -0.166
  525   2HD1  ILE 148          2HD1      ILE 148 134.926  -1.712  -0.284
  526   3HD1  ILE 148          3HD1      ILE 148 136.063  -0.783  -1.264
  527    H    ASP 149           H        ASP 149 132.637  -5.972  -3.163
  528    HA   ASP 149           HA       ASP 149 130.576  -4.826  -4.916
  529   1HB   ASP 149          2HB       ASP 149 131.594  -7.275  -5.091
  530   2HB   ASP 149          1HB       ASP 149 130.374  -7.612  -3.866
  531    H    TYR 150           H        TYR 150 128.279  -5.715  -4.142
  532    HA   TYR 150           HA       TYR 150 127.765  -4.356  -1.679
  533   1HB   TYR 150          2HB       TYR 150 126.152  -4.261  -3.503
  534   2HB   TYR 150          1HB       TYR 150 125.947  -6.008  -3.446
  535    HD1  TYR 150           HD1      TYR 150 123.856  -6.562  -2.661
  536    HD2  TYR 150           HD2      TYR 150 125.917  -3.316  -0.841
  537    HE1  TYR 150           HE1      TYR 150 122.006  -6.294  -1.063
  538    HE2  TYR 150           HE2      TYR 150 124.073  -3.040   0.765
  539    HH   TYR 150           HH       TYR 150 121.346  -3.758   0.576
  540    H    ASP 151           H        ASP 151 128.480  -7.606  -2.501
  541    HA   ASP 151           HA       ASP 151 127.165  -8.865  -0.314
  542   1HB   ASP 151          2HB       ASP 151 129.087  -9.655  -2.412
  543   2HB   ASP 151          1HB       ASP 151 129.188 -10.580  -0.916
  544    H    GLU 152           H        GLU 152 130.607  -8.127  -0.897
  545    HA   GLU 152           HA       GLU 152 131.370  -8.756   1.766
  546   1HB   GLU 152          2HB       GLU 152 133.554  -7.818   1.142
  547   2HB   GLU 152          1HB       GLU 152 132.954  -8.955  -0.056
  548   1HG   GLU 152          2HG       GLU 152 132.061  -6.871  -1.267
  549   2HG   GLU 152          1HG       GLU 152 133.170  -5.983  -0.224
  550    H    PHE 153           H        PHE 153 130.692  -5.689   0.098
  551    HA   PHE 153           HA       PHE 153 131.570  -3.979   2.135
  552   1HB   PHE 153          2HB       PHE 153 130.315  -3.659  -0.340
  553   2HB   PHE 153          1HB       PHE 153 129.214  -2.922   0.814
  554    HD1  PHE 153           HD1      PHE 153 131.004  -1.681  -1.441
  555    HD2  PHE 153           HD2      PHE 153 131.380  -2.026   2.785
  556    HE1  PHE 153           HE1      PHE 153 132.406   0.340  -1.404
  557    HE2  PHE 153           HE2      PHE 153 132.783  -0.005   2.828
  558    HZ   PHE 153           HZ       PHE 153 133.297   1.180   0.732
  559    H    LEU 154           H        LEU 154 128.768  -5.979   1.950
  560    HA   LEU 154           HA       LEU 154 127.042  -4.629   3.691
  561   1HB   LEU 154          2HB       LEU 154 126.991  -7.004   2.299
  562   2HB   LEU 154          1HB       LEU 154 127.013  -7.543   3.967
  563    HG   LEU 154           HG       LEU 154 124.729  -7.334   3.049
  564   1HD1  LEU 154          1HD1      LEU 154 123.840  -5.875   4.907
  565   2HD1  LEU 154          2HD1      LEU 154 125.519  -5.544   5.331
  566   3HD1  LEU 154          3HD1      LEU 154 124.903  -7.194   5.400
  567   1HD2  LEU 154          1HD2      LEU 154 125.342  -5.335   1.608
  568   2HD2  LEU 154          2HD2      LEU 154 125.160  -4.360   3.066
  569   3HD2  LEU 154          3HD2      LEU 154 123.786  -5.268   2.436
  570    H    GLU 155           H        GLU 155 129.862  -6.590   4.292
  571    HA   GLU 155           HA       GLU 155 129.353  -6.784   7.135
  572   1HB   GLU 155          2HB       GLU 155 131.468  -7.777   5.275
  573   2HB   GLU 155          1HB       GLU 155 131.842  -7.668   6.988
  574   1HG   GLU 155          2HG       GLU 155 129.287  -8.946   6.519
  575   2HG   GLU 155          1HG       GLU 155 130.606  -9.771   5.690
  576    H    PHE 156           H        PHE 156 131.326  -4.874   4.946
  577    HA   PHE 156           HA       PHE 156 133.121  -3.708   6.690
  578   1HB   PHE 156          2HB       PHE 156 132.549  -3.375   4.065
  579   2HB   PHE 156          1HB       PHE 156 131.894  -1.876   4.712
  580    HD1  PHE 156           HD1      PHE 156 134.058  -1.848   7.020
  581    HD2  PHE 156           HD2      PHE 156 134.215  -2.178   2.780
  582    HE1  PHE 156           HE1      PHE 156 136.315  -0.870   7.031
  583    HE2  PHE 156           HE2      PHE 156 136.473  -1.203   2.784
  584    HZ   PHE 156           HZ       PHE 156 137.525  -0.547   4.912
  585    H    MET 157           H        MET 157 129.707  -3.205   6.410
  586    HA   MET 157           HA       MET 157 129.717  -0.761   7.960
  587   1HB   MET 157          2HB       MET 157 127.955  -1.858   6.148
  588   2HB   MET 157          1HB       MET 157 127.148  -2.142   7.683
  589   1HG   MET 157          2HG       MET 157 126.437  -0.047   6.685
  590   2HG   MET 157          1HG       MET 157 127.277   0.225   8.210
  591   1HE   MET 157          1HE       MET 157 129.463  -0.800   5.155
  592   2HE   MET 157          2HE       MET 157 129.530   0.694   4.221
  593   3HE   MET 157          3HE       MET 157 128.007  -0.181   4.375
  594    H    LYS 158           H        LYS 158 127.875  -3.763   8.474
  595    HA   LYS 158           HA       LYS 158 127.602  -3.393  11.242
  596   1HB   LYS 158          2HB       LYS 158 126.450  -5.034   9.438
  597   2HB   LYS 158          1HB       LYS 158 127.540  -6.171  10.218
  598   1HG   LYS 158          2HG       LYS 158 125.962  -6.443  11.754
  599   2HG   LYS 158          1HG       LYS 158 126.377  -4.829  12.334
  600   1HD   LYS 158          2HD       LYS 158 124.336  -5.383  10.185
  601   2HD   LYS 158          1HD       LYS 158 123.943  -5.168  11.891
  602   1HE   LYS 158          2HE       LYS 158 124.601  -2.923  11.879
  603   2HE   LYS 158          1HE       LYS 158 125.506  -3.105  10.376
  604   1HZ   LYS 158          1HZ       LYS 158 123.094  -2.032  10.482
  605   2HZ   LYS 158          2HZ       LYS 158 122.649  -3.647  10.247
  606   3HZ   LYS 158          3HZ       LYS 158 123.657  -2.876   9.128
  607    H    GLY 159           H        GLY 159 129.989  -2.832  11.493
  608   1HA   GLY 159          2HA       GLY 159 131.516  -3.781  13.187
  609   2HA   GLY 159          1HA       GLY 159 131.453  -5.282  12.273
  610    H    VAL 160           H        VAL 160 132.742  -2.044  12.402
  611    HA   VAL 160           HA       VAL 160 134.428  -2.586  10.062
  612    HB   VAL 160           HB       VAL 160 134.321   0.042  11.519
  613   1HG1  VAL 160          1HG1      VAL 160 135.194  -0.913   8.824
  614   2HG1  VAL 160          2HG1      VAL 160 136.055   0.091   9.990
  615   3HG1  VAL 160          3HG1      VAL 160 134.722   0.770   9.057
  616   1HG2  VAL 160          1HG2      VAL 160 132.172  -1.210  10.033
  617   2HG2  VAL 160          2HG2      VAL 160 132.679   0.311   9.294
  618   3HG2  VAL 160          3HG2      VAL 160 132.170   0.276  10.983
  619    H    GLU 161           H        GLU 161 135.114  -4.091  12.220
  620    HA   GLU 161           HA       GLU 161 137.471  -2.736  13.347
  621   1HB   GLU 161          2HB       GLU 161 135.873  -5.085  14.373
  622   2HB   GLU 161          1HB       GLU 161 137.402  -4.569  15.071
  623   1HG   GLU 161          2HG       GLU 161 136.505  -2.713  16.025
  624   2HG   GLU 161          1HG       GLU 161 135.268  -2.535  14.784
  Start of MODEL   19
    1   1H    MET  81          1HT       MET  81  99.240 -19.983   5.628
    2   2H    MET  81          2HT       MET  81  98.477 -19.150   4.336
    3   3H    MET  81          3HT       MET  81  98.790 -20.833   4.209
    4    HA   MET  81           HA       MET  81  96.568 -20.703   4.670
    5   1HB   MET  81          2HB       MET  81  98.303 -21.976   6.304
    6   2HB   MET  81          1HB       MET  81  97.472 -20.966   7.478
    7   1HG   MET  81          2HG       MET  81  95.393 -21.994   6.040
    8   2HG   MET  81          1HG       MET  81  96.546 -23.328   6.036
    9   1HE   MET  81          1HE       MET  81  94.278 -21.506   9.523
   10   2HE   MET  81          2HE       MET  81  93.462 -22.217   8.131
   11   3HE   MET  81          3HE       MET  81  94.535 -20.835   7.911
   12    H    VAL  82           H        VAL  82  98.387 -18.571   6.832
   13    HA   VAL  82           HA       VAL  82  95.916 -17.151   7.518
   14    HB   VAL  82           HB       VAL  82  98.670 -16.714   8.678
   15   1HG1  VAL  82          1HG1      VAL  82  96.013 -16.042   9.911
   16   2HG1  VAL  82          2HG1      VAL  82  96.871 -14.918   8.857
   17   3HG1  VAL  82          3HG1      VAL  82  97.615 -15.459  10.362
   18   1HG2  VAL  82          1HG2      VAL  82  96.461 -18.292   9.968
   19   2HG2  VAL  82          2HG2      VAL  82  98.157 -18.182  10.442
   20   3HG2  VAL  82          3HG2      VAL  82  97.704 -19.053   8.976
   21    H    ARG  83           H        ARG  83  95.410 -15.294   6.567
   22    HA   ARG  83           HA       ARG  83  97.556 -13.740   5.281
   23   1HB   ARG  83          2HB       ARG  83  95.813 -13.065   3.583
   24   2HB   ARG  83          1HB       ARG  83  96.345 -14.740   3.497
   25   1HG   ARG  83          2HG       ARG  83  94.321 -15.552   4.045
   26   2HG   ARG  83          1HG       ARG  83  93.986 -14.246   5.184
   27   1HD   ARG  83          2HD       ARG  83  93.377 -12.763   3.417
   28   2HD   ARG  83          1HD       ARG  83  93.946 -13.896   2.193
   29    HE   ARG  83           HE       ARG  83  91.400 -13.897   3.480
   30   1HH1  ARG  83          1HH1      ARG  83  93.812 -15.964   2.038
   31   2HH1  ARG  83          2HH1      ARG  83  92.680 -17.208   1.626
   32   1HH2  ARG  83          1HH2      ARG  83  89.909 -15.531   2.940
   33   2HH2  ARG  83          2HH2      ARG  83  90.464 -16.962   2.136
   34    H    CYS  84           H        CYS  84  97.808 -12.137   6.750
   35    HA   CYS  84           HA       CYS  84  95.403 -10.644   7.561
   36   1HB   CYS  84          2HB       CYS  84  97.962 -11.277   8.936
   37   2HB   CYS  84          1HB       CYS  84  97.244  -9.703   9.260
   38    HG   CYS  84           HG       CYS  84  96.202 -12.385  10.262
   39    H    MET  85           H        MET  85  98.873 -10.032   6.983
   40    HA   MET  85           HA       MET  85  98.193  -7.821   5.226
   41   1HB   MET  85          2HB       MET  85  98.416  -7.089   7.746
   42   2HB   MET  85          1HB       MET  85 100.138  -7.211   7.414
   43   1HG   MET  85          2HG       MET  85  99.382  -4.940   7.115
   44   2HG   MET  85          1HG       MET  85  99.894  -5.621   5.571
   45   1HE   MET  85          1HE       MET  85  97.450  -4.381   7.850
   46   2HE   MET  85          2HE       MET  85  95.867  -4.928   7.295
   47   3HE   MET  85          3HE       MET  85  96.522  -3.394   6.721
   48    H    LYS  86           H        LYS  86  99.223  -9.976   4.214
   49    HA   LYS  86           HA       LYS  86 100.936 -10.837   2.989
   50   1HB   LYS  86          2HB       LYS  86 101.625  -7.963   3.252
   51   2HB   LYS  86          1HB       LYS  86 102.910  -9.035   2.710
   52   1HG   LYS  86          2HG       LYS  86 100.391  -9.485   1.322
   53   2HG   LYS  86          1HG       LYS  86 101.015  -7.848   1.120
   54   1HD   LYS  86          2HD       LYS  86 103.148  -8.737   0.354
   55   2HD   LYS  86          1HD       LYS  86 102.574 -10.384   0.616
   56   1HE   LYS  86          2HE       LYS  86 102.386  -9.900  -1.717
   57   2HE   LYS  86          1HE       LYS  86 100.760  -9.939  -1.036
   58   1HZ   LYS  86          1HZ       LYS  86 101.006  -7.437  -0.834
   59   2HZ   LYS  86          2HZ       LYS  86 100.812  -8.058  -2.396
   60   3HZ   LYS  86          3HZ       LYS  86 102.344  -7.581  -1.860
   61    H    ASP  87           H        ASP  87 103.574 -10.880   3.049
   62    HA   ASP  87           HA       ASP  87 104.171 -12.226   5.484
   63   1HB   ASP  87          2HB       ASP  87 105.265 -12.099   2.881
   64   2HB   ASP  87          1HB       ASP  87 106.548 -11.610   3.983
   65    H    ASP  88           H        ASP  88 106.793 -11.557   6.036
   66    HA   ASP  88           HA       ASP  88 106.408  -9.127   7.554
   67   1HB   ASP  88          2HB       ASP  88 108.607  -9.689   8.550
   68   2HB   ASP  88          1HB       ASP  88 107.464 -11.023   8.650
   69    H    SER  89           H        SER  89 106.758  -7.225   6.625
   70    HA   SER  89           HA       SER  89 108.129  -6.762   4.254
   71   1HB   SER  89          2HB       SER  89 108.129  -4.366   4.941
   72   2HB   SER  89          1HB       SER  89 106.557  -5.139   5.139
   73    HG   SER  89           HG       SER  89 108.473  -4.664   7.177
   74    H    LYS  90           H        LYS  90 110.152  -5.798   3.799
   75    HA   LYS  90           HA       LYS  90 112.311  -6.855   5.288
   76   1HB   LYS  90          2HB       LYS  90 112.543  -4.611   3.292
   77   2HB   LYS  90          1HB       LYS  90 113.729  -5.849   3.680
   78   1HG   LYS  90          2HG       LYS  90 113.001  -6.948   1.897
   79   2HG   LYS  90          1HG       LYS  90 111.529  -7.285   2.810
   80   1HD   LYS  90          2HD       LYS  90 110.526  -5.224   1.927
   81   2HD   LYS  90          1HD       LYS  90 111.995  -4.913   1.000
   82   1HE   LYS  90          2HE       LYS  90 111.658  -6.916  -0.295
   83   2HE   LYS  90          1HE       LYS  90 110.278  -7.373   0.704
   84   1HZ   LYS  90          1HZ       LYS  90 110.156  -4.766  -0.591
   85   2HZ   LYS  90          2HZ       LYS  90 108.929  -5.899  -0.322
   86   3HZ   LYS  90          3HZ       LYS  90 110.017  -6.117  -1.599
   87    H    GLY  91           H        GLY  91 114.254  -5.106   5.614
   88   1HA   GLY  91          2HA       GLY  91 113.141  -3.091   7.470
   89   2HA   GLY  91          1HA       GLY  91 114.619  -3.987   7.788
   90    H    LYS  92           H        LYS  92 115.413  -1.717   8.094
   91    HA   LYS  92           HA       LYS  92 116.221  -0.582   5.501
   92   1HB   LYS  92          2HB       LYS  92 115.350   0.729   8.038
   93   2HB   LYS  92          1HB       LYS  92 116.544   1.548   7.040
   94   1HG   LYS  92          2HG       LYS  92 114.764   2.435   6.024
   95   2HG   LYS  92          1HG       LYS  92 114.678   0.885   5.186
   96   1HD   LYS  92          2HD       LYS  92 112.919   0.136   6.465
   97   2HD   LYS  92          1HD       LYS  92 113.334   1.173   7.832
   98   1HE   LYS  92          2HE       LYS  92 112.768   3.032   5.955
   99   2HE   LYS  92          1HE       LYS  92 111.687   1.732   5.454
  100   1HZ   LYS  92          1HZ       LYS  92 110.659   3.286   7.035
  101   2HZ   LYS  92          2HZ       LYS  92 111.809   2.859   8.199
  102   3HZ   LYS  92          3HZ       LYS  92 110.711   1.704   7.634
  103    H    THR  93           H        THR  93 117.543  -2.644   7.032
  104    HA   THR  93           HA       THR  93 120.039  -1.249   7.748
  105    HB   THR  93           HB       THR  93 119.616  -4.049   8.631
  106    HG1  THR  93           HG1      THR  93 117.603  -3.129   9.086
  107   1HG2  THR  93          1HG2      THR  93 120.320  -2.449  10.780
  108   2HG2  THR  93          2HG2      THR  93 121.207  -1.776   9.411
  109   3HG2  THR  93          3HG2      THR  93 121.387  -3.481   9.828
  110    H    GLU  94           H        GLU  94 119.047  -4.499   6.667
  111    HA   GLU  94           HA       GLU  94 121.548  -4.866   5.279
  112   1HB   GLU  94          2HB       GLU  94 120.162  -6.640   6.556
  113   2HB   GLU  94          1HB       GLU  94 119.200  -6.727   5.085
  114   1HG   GLU  94          2HG       GLU  94 122.004  -6.881   4.469
  115   2HG   GLU  94          1HG       GLU  94 121.557  -8.100   5.661
  116    H    GLU  95           H        GLU  95 118.302  -3.956   4.440
  117    HA   GLU  95           HA       GLU  95 118.891  -4.299   1.588
  118   1HB   GLU  95          2HB       GLU  95 116.437  -4.210   3.210
  119   2HB   GLU  95          1HB       GLU  95 116.329  -3.347   1.683
  120   1HG   GLU  95          2HG       GLU  95 115.638  -5.417   1.036
  121   2HG   GLU  95          1HG       GLU  95 117.368  -5.553   0.723
  122    H    GLU  96           H        GLU  96 119.538  -2.021   3.762
  123    HA   GLU  96           HA       GLU  96 118.719   0.243   2.090
  124   1HB   GLU  96          2HB       GLU  96 119.416  -0.086   4.961
  125   2HB   GLU  96          1HB       GLU  96 119.800   1.456   4.206
  126   1HG   GLU  96          2HG       GLU  96 117.074   0.237   3.997
  127   2HG   GLU  96          1HG       GLU  96 117.551   1.226   5.375
  128    H    LEU  97           H        LEU  97 121.498  -1.509   3.245
  129    HA   LEU  97           HA       LEU  97 123.510   0.352   2.686
  130   1HB   LEU  97          2HB       LEU  97 123.422  -2.633   2.844
  131   2HB   LEU  97          1HB       LEU  97 124.879  -1.840   2.278
  132    HG   LEU  97           HG       LEU  97 123.578  -1.300   4.948
  133   1HD1  LEU  97          1HD1      LEU  97 125.987  -2.987   4.288
  134   2HD1  LEU  97          2HD1      LEU  97 124.421  -3.587   4.832
  135   3HD1  LEU  97          3HD1      LEU  97 125.406  -2.594   5.906
  136   1HD2  LEU  97          1HD2      LEU  97 126.198  -0.439   3.732
  137   2HD2  LEU  97          2HD2      LEU  97 125.781  -0.246   5.435
  138   3HD2  LEU  97          3HD2      LEU  97 124.844   0.591   4.197
  139    H    SER  98           H        SER  98 121.502  -1.468   0.570
  140    HA   SER  98           HA       SER  98 123.239  -1.545  -1.680
  141   1HB   SER  98          2HB       SER  98 120.882  -2.748  -1.099
  142   2HB   SER  98          1HB       SER  98 120.318  -1.460  -2.164
  143    HG   SER  98           HG       SER  98 121.032  -3.573  -3.117
  144    H    ASP  99           H        ASP  99 120.512   0.572  -0.798
  145    HA   ASP  99           HA       ASP  99 120.634   2.274  -3.006
  146   1HB   ASP  99          2HB       ASP  99 119.492   2.411  -0.279
  147   2HB   ASP  99          1HB       ASP  99 119.766   3.961  -1.070
  148    H    LEU 100           H        LEU 100 122.407   2.309   0.033
  149    HA   LEU 100           HA       LEU 100 123.716   4.810  -0.516
  150   1HB   LEU 100          2HB       LEU 100 124.598   2.742   1.484
  151   2HB   LEU 100          1HB       LEU 100 124.890   4.470   1.519
  152    HG   LEU 100           HG       LEU 100 122.103   3.369   1.717
  153   1HD1  LEU 100          1HD1      LEU 100 124.016   3.849   3.997
  154   2HD1  LEU 100          2HD1      LEU 100 123.416   2.280   3.462
  155   3HD1  LEU 100          3HD1      LEU 100 122.303   3.463   4.146
  156   1HD2  LEU 100          1HD2      LEU 100 122.110   5.684   1.307
  157   2HD2  LEU 100          2HD2      LEU 100 123.457   5.960   2.412
  158   3HD2  LEU 100          3HD2      LEU 100 121.869   5.524   3.047
  159    H    PHE 101           H        PHE 101 124.364   1.421  -1.033
  160    HA   PHE 101           HA       PHE 101 127.123   1.507  -1.475
  161   1HB   PHE 101          2HB       PHE 101 125.875  -0.593  -1.264
  162   2HB   PHE 101          1HB       PHE 101 125.050  -0.270  -2.785
  163    HD1  PHE 101           HD1      PHE 101 125.738  -1.846  -4.309
  164    HD2  PHE 101           HD2      PHE 101 128.636   0.012  -1.809
  165    HE1  PHE 101           HE1      PHE 101 127.530  -3.013  -5.526
  166    HE2  PHE 101           HE2      PHE 101 130.434  -1.150  -3.022
  167    HZ   PHE 101           HZ       PHE 101 129.882  -2.664  -4.883
  168    H    ARG 102           H        ARG 102 124.410   2.156  -3.646
  169    HA   ARG 102           HA       ARG 102 125.876   2.380  -6.032
  170   1HB   ARG 102          2HB       ARG 102 123.236   3.470  -5.106
  171   2HB   ARG 102          1HB       ARG 102 123.890   3.927  -6.671
  172   1HG   ARG 102          2HG       ARG 102 123.984   1.553  -7.304
  173   2HG   ARG 102          1HG       ARG 102 123.261   1.132  -5.748
  174   1HD   ARG 102          2HD       ARG 102 121.217   2.096  -6.300
  175   2HD   ARG 102          1HD       ARG 102 121.918   3.084  -7.580
  176    HE   ARG 102           HE       ARG 102 121.684   1.324  -9.031
  177   1HH1  ARG 102          1HH1      ARG 102 121.208   0.185  -5.767
  178   2HH1  ARG 102          2HH1      ARG 102 120.644  -1.376  -6.261
  179   1HH2  ARG 102          1HH2      ARG 102 120.944  -0.730  -9.683
  180   2HH2  ARG 102          2HH2      ARG 102 120.494  -1.894  -8.483
  181    H    MET 103           H        MET 103 125.014   4.771  -3.568
  182    HA   MET 103           HA       MET 103 125.909   7.073  -4.834
  183   1HB   MET 103          2HB       MET 103 125.784   6.286  -1.933
  184   2HB   MET 103          1HB       MET 103 126.377   7.866  -2.428
  185   1HG   MET 103          2HG       MET 103 124.014   7.639  -3.807
  186   2HG   MET 103          1HG       MET 103 123.657   6.850  -2.273
  187   1HE   MET 103          1HE       MET 103 122.394  10.448  -3.041
  188   2HE   MET 103          2HE       MET 103 121.834   9.721  -1.534
  189   3HE   MET 103          3HE       MET 103 121.990   8.733  -2.987
  190    H    PHE 104           H        PHE 104 127.705   4.526  -3.272
  191    HA   PHE 104           HA       PHE 104 130.184   5.978  -3.177
  192   1HB   PHE 104          2HB       PHE 104 129.235   3.286  -2.435
  193   2HB   PHE 104          1HB       PHE 104 130.914   3.361  -2.959
  194    HD1  PHE 104           HD1      PHE 104 128.503   4.902  -0.591
  195    HD2  PHE 104           HD2      PHE 104 132.573   4.042  -1.486
  196    HE1  PHE 104           HE1      PHE 104 129.158   5.698   1.643
  197    HE2  PHE 104           HE2      PHE 104 133.236   4.833   0.748
  198    HZ   PHE 104           HZ       PHE 104 131.528   5.663   2.315
  199    H    ASP 105           H        ASP 105 128.532   3.944  -5.458
  200    HA   ASP 105           HA       ASP 105 130.893   3.561  -7.104
  201   1HB   ASP 105          2HB       ASP 105 128.831   1.942  -6.749
  202   2HB   ASP 105          1HB       ASP 105 128.137   2.897  -8.055
  203    H    LYS 106           H        LYS 106 131.160   4.409  -9.190
  204    HA   LYS 106           HA       LYS 106 129.523   6.795  -9.746
  205   1HB   LYS 106          2HB       LYS 106 132.462   6.279 -10.084
  206   2HB   LYS 106          1HB       LYS 106 131.652   7.512 -11.040
  207   1HG   LYS 106          2HG       LYS 106 131.052   7.699  -8.197
  208   2HG   LYS 106          1HG       LYS 106 132.769   7.865  -8.562
  209   1HD   LYS 106          2HD       LYS 106 130.542   9.449  -9.842
  210   2HD   LYS 106          1HD       LYS 106 131.613  10.032  -8.566
  211   1HE   LYS 106          2HE       LYS 106 133.522   9.438 -10.176
  212   2HE   LYS 106          1HE       LYS 106 132.273   9.361 -11.417
  213   1HZ   LYS 106          1HZ       LYS 106 131.738  11.713 -10.245
  214   2HZ   LYS 106          2HZ       LYS 106 132.703  11.534 -11.622
  215   3HZ   LYS 106          3HZ       LYS 106 133.423  11.660 -10.097
  216    H    ASN 107           H        ASN 107 131.389   4.172 -11.241
  217    HA   ASN 107           HA       ASN 107 130.398   4.717 -13.872
  218   1HB   ASN 107          2HB       ASN 107 131.697   2.160 -12.942
  219   2HB   ASN 107          1HB       ASN 107 131.664   2.827 -14.572
  220   1HD2  ASN 107          1HD2      ASN 107 133.069   4.458 -15.124
  221   2HD2  ASN 107          2HD2      ASN 107 134.402   4.923 -14.127
  222    H    ALA 108           H        ALA 108 128.864   3.439 -11.239
  223    HA   ALA 108           HA       ALA 108 127.060   2.087 -10.907
  224   1HB   ALA 108          1HB       ALA 108 126.399   2.935 -13.724
  225   2HB   ALA 108          2HB       ALA 108 126.085   3.890 -12.274
  226   3HB   ALA 108          3HB       ALA 108 125.265   2.345 -12.508
  227    H    ASP 109           H        ASP 109 128.877   0.361 -11.122
  228    HA   ASP 109           HA       ASP 109 128.040  -1.568 -13.189
  229   1HB   ASP 109          2HB       ASP 109 130.349  -2.483 -13.106
  230   2HB   ASP 109          1HB       ASP 109 130.292  -0.817 -13.674
  231    H    GLY 110           H        GLY 110 128.805  -1.000  -9.841
  232   1HA   GLY 110          2HA       GLY 110 127.531  -2.408  -8.262
  233   2HA   GLY 110          1HA       GLY 110 128.004  -3.783  -9.249
  234    H    TYR 111           H        TYR 111 130.615  -1.783  -9.195
  235    HA   TYR 111           HA       TYR 111 131.673  -2.820  -6.666
  236   1HB   TYR 111          2HB       TYR 111 133.224  -2.976  -9.254
  237   2HB   TYR 111          1HB       TYR 111 133.684  -3.635  -7.688
  238    HD1  TYR 111           HD1      TYR 111 132.529  -5.631  -6.797
  239    HD2  TYR 111           HD2      TYR 111 131.737  -4.157 -10.709
  240    HE1  TYR 111           HE1      TYR 111 131.476  -7.774  -7.385
  241    HE2  TYR 111           HE2      TYR 111 130.682  -6.296 -11.307
  242    HH   TYR 111           HH       TYR 111 131.063  -8.920 -10.163
  243    H    ILE 112           H        ILE 112 133.357  -1.588  -5.766
  244    HA   ILE 112           HA       ILE 112 133.623   1.098  -6.941
  245    HB   ILE 112           HB       ILE 112 134.062   0.337  -4.054
  246   1HG1  ILE 112          2HG1      ILE 112 131.674   1.846  -5.079
  247   2HG1  ILE 112          1HG1      ILE 112 131.671   0.086  -5.047
  248   1HG2  ILE 112          1HG2      ILE 112 134.500   2.516  -3.629
  249   2HG2  ILE 112          2HG2      ILE 112 133.413   3.095  -4.892
  250   3HG2  ILE 112          3HG2      ILE 112 135.017   2.494  -5.315
  251   1HD1  ILE 112          1HD1      ILE 112 130.606   1.126  -3.078
  252   2HD1  ILE 112          2HD1      ILE 112 132.166   1.827  -2.648
  253   3HD1  ILE 112          3HD1      ILE 112 131.963   0.075  -2.671
  254    H    ASP 113           H        ASP 113 135.565   1.810  -7.539
  255    HA   ASP 113           HA       ASP 113 137.908   0.168  -6.852
  256   1HB   ASP 113          2HB       ASP 113 137.036   0.752  -9.328
  257   2HB   ASP 113          1HB       ASP 113 138.074   2.148  -9.057
  258    H    LEU 114           H        LEU 114 140.007   1.648  -7.170
  259    HA   LEU 114           HA       LEU 114 140.045   3.392  -4.966
  260   1HB   LEU 114          2HB       LEU 114 141.932   2.125  -6.481
  261   2HB   LEU 114          1HB       LEU 114 142.155   3.792  -6.970
  262    HG   LEU 114           HG       LEU 114 143.673   3.254  -5.167
  263   1HD1  LEU 114          1HD1      LEU 114 142.980   4.980  -3.520
  264   2HD1  LEU 114          2HD1      LEU 114 141.414   5.062  -4.328
  265   3HD1  LEU 114          3HD1      LEU 114 142.879   5.516  -5.197
  266   1HD2  LEU 114          1HD2      LEU 114 142.903   1.579  -3.858
  267   2HD2  LEU 114          2HD2      LEU 114 141.226   2.116  -3.963
  268   3HD2  LEU 114          3HD2      LEU 114 142.346   2.925  -2.865
  269    H    GLU 115           H        GLU 115 139.499   3.935  -8.372
  270    HA   GLU 115           HA       GLU 115 139.864   6.774  -8.258
  271   1HB   GLU 115          2HB       GLU 115 138.528   5.034 -10.335
  272   2HB   GLU 115          1HB       GLU 115 138.879   6.746 -10.532
  273   1HG   GLU 115          2HG       GLU 115 140.952   4.617 -10.057
  274   2HG   GLU 115          1HG       GLU 115 140.515   5.264 -11.637
  275    H    GLU 116           H        GLU 116 137.219   4.585  -7.718
  276    HA   GLU 116           HA       GLU 116 135.198   6.645  -7.909
  277   1HB   GLU 116          2HB       GLU 116 135.099   3.754  -7.048
  278   2HB   GLU 116          1HB       GLU 116 133.693   4.809  -7.045
  279   1HG   GLU 116          2HG       GLU 116 133.438   3.801  -9.068
  280   2HG   GLU 116          1HG       GLU 116 134.386   5.211  -9.541
  281    H    LEU 117           H        LEU 117 136.362   4.526  -5.289
  282    HA   LEU 117           HA       LEU 117 135.013   5.645  -3.173
  283   1HB   LEU 117          2HB       LEU 117 136.358   3.623  -2.982
  284   2HB   LEU 117          1HB       LEU 117 137.827   4.555  -3.193
  285    HG   LEU 117           HG       LEU 117 137.485   5.669  -1.068
  286   1HD1  LEU 117          1HD1      LEU 117 135.636   5.165   0.384
  287   2HD1  LEU 117          2HD1      LEU 117 134.994   3.999  -0.773
  288   3HD1  LEU 117          3HD1      LEU 117 135.012   5.717  -1.171
  289   1HD2  LEU 117          1HD2      LEU 117 138.494   3.314  -1.266
  290   2HD2  LEU 117          2HD2      LEU 117 136.988   2.763  -0.535
  291   3HD2  LEU 117          3HD2      LEU 117 138.029   3.890   0.333
  292    H    LYS 118           H        LYS 118 137.728   6.947  -4.908
  293    HA   LYS 118           HA       LYS 118 138.439   8.888  -2.920
  294   1HB   LYS 118          2HB       LYS 118 139.916   9.807  -4.620
  295   2HB   LYS 118          1HB       LYS 118 140.070   8.056  -4.564
  296   1HG   LYS 118          2HG       LYS 118 139.286   7.787  -6.653
  297   2HG   LYS 118          1HG       LYS 118 138.103   9.088  -6.492
  298   1HD   LYS 118          2HD       LYS 118 140.079  10.686  -6.612
  299   2HD   LYS 118          1HD       LYS 118 141.035   9.298  -7.133
  300   1HE   LYS 118          2HE       LYS 118 139.113   8.994  -8.874
  301   2HE   LYS 118          1HE       LYS 118 138.794  10.693  -8.532
  302   1HZ   LYS 118          1HZ       LYS 118 140.417  10.025 -10.426
  303   2HZ   LYS 118          2HZ       LYS 118 141.535   9.850  -9.168
  304   3HZ   LYS 118          3HZ       LYS 118 140.784  11.343  -9.428
  305    H    ILE 119           H        ILE 119 136.077   8.704  -5.418
  306    HA   ILE 119           HA       ILE 119 135.745  11.457  -5.953
  307    HB   ILE 119           HB       ILE 119 133.603   9.336  -6.102
  308   1HG1  ILE 119          2HG1      ILE 119 135.649   8.638  -7.306
  309   2HG1  ILE 119          1HG1      ILE 119 134.311   8.958  -8.404
  310   1HG2  ILE 119          1HG2      ILE 119 133.771  12.142  -6.866
  311   2HG2  ILE 119          2HG2      ILE 119 132.361  11.103  -6.672
  312   3HG2  ILE 119          3HG2      ILE 119 133.262  11.092  -8.188
  313   1HD1  ILE 119          1HD1      ILE 119 135.262  11.125  -8.947
  314   2HD1  ILE 119          2HD1      ILE 119 136.411   9.824  -9.264
  315   3HD1  ILE 119          3HD1      ILE 119 136.592  10.829  -7.826
  316    H    MET 120           H        MET 120 133.759   9.284  -3.939
  317    HA   MET 120           HA       MET 120 132.096  11.201  -2.834
  318   1HB   MET 120          2HB       MET 120 131.824   8.727  -2.640
  319   2HB   MET 120          1HB       MET 120 133.102   8.723  -1.432
  320   1HG   MET 120          2HG       MET 120 131.450  10.586  -0.394
  321   2HG   MET 120          1HG       MET 120 130.291   9.543  -1.215
  322   1HE   MET 120          1HE       MET 120 133.281   9.711   1.163
  323   2HE   MET 120          2HE       MET 120 133.730   8.172   0.427
  324   3HE   MET 120          3HE       MET 120 133.188   8.223   2.105
  325    H    LEU 121           H        LEU 121 135.417  10.536  -2.128
  326    HA   LEU 121           HA       LEU 121 135.408  11.830   0.443
  327   1HB   LEU 121          2HB       LEU 121 137.418  10.532  -1.302
  328   2HB   LEU 121          1HB       LEU 121 138.018  11.762  -0.204
  329    HG   LEU 121           HG       LEU 121 137.009  10.513   1.691
  330   1HD1  LEU 121          1HD1      LEU 121 135.898   8.530   1.469
  331   2HD1  LEU 121          2HD1      LEU 121 136.678   8.136  -0.063
  332   3HD1  LEU 121          3HD1      LEU 121 135.386   9.335  -0.014
  333   1HD2  LEU 121          1HD2      LEU 121 139.103   9.778   1.821
  334   2HD2  LEU 121          2HD2      LEU 121 139.264   9.732   0.066
  335   3HD2  LEU 121          3HD2      LEU 121 138.587   8.349   0.927
  336    H    GLN 122           H        GLN 122 136.513  12.675  -2.828
  337    HA   GLN 122           HA       GLN 122 137.492  15.239  -2.099
  338   1HB   GLN 122          2HB       GLN 122 137.452  15.684  -4.554
  339   2HB   GLN 122          1HB       GLN 122 138.310  14.215  -4.111
  340   1HG   GLN 122          2HG       GLN 122 136.416  12.871  -4.772
  341   2HG   GLN 122          1HG       GLN 122 135.484  14.323  -5.134
  342   1HE2  GLN 122          1HE2      GLN 122 138.638  12.896  -5.933
  343   2HE2  GLN 122          2HE2      GLN 122 138.574  13.278  -7.617
  344    H    ALA 123           H        ALA 123 134.451  14.089  -3.476
  345    HA   ALA 123           HA       ALA 123 133.234  16.576  -3.893
  346   1HB   ALA 123          1HB       ALA 123 132.383  14.464  -4.815
  347   2HB   ALA 123          2HB       ALA 123 131.133  15.360  -3.953
  348   3HB   ALA 123          3HB       ALA 123 131.898  13.963  -3.197
  349    H    THR 124           H        THR 124 133.624  14.645  -1.001
  350    HA   THR 124           HA       THR 124 131.709  16.117   0.550
  351    HB   THR 124           HB       THR 124 133.139  14.931   2.451
  352    HG1  THR 124           HG1      THR 124 134.554  13.574   1.737
  353   1HG2  THR 124          1HG2      THR 124 131.924  12.730   1.826
  354   2HG2  THR 124          2HG2      THR 124 131.163  13.718   0.580
  355   3HG2  THR 124          3HG2      THR 124 130.985  14.153   2.280
  356    H    GLY 125           H        GLY 125 132.406  17.223   2.613
  357   1HA   GLY 125          2HA       GLY 125 134.415  19.210   1.921
  358   2HA   GLY 125          1HA       GLY 125 133.297  19.283   3.275
  359    H    GLU 126           H        GLU 126 134.841  16.281   3.085
  360    HA   GLU 126           HA       GLU 126 136.459  16.941   5.408
  361   1HB   GLU 126          2HB       GLU 126 136.151  14.239   4.101
  362   2HB   GLU 126          1HB       GLU 126 136.683  14.585   5.740
  363   1HG   GLU 126          2HG       GLU 126 134.068  15.689   5.261
  364   2HG   GLU 126          1HG       GLU 126 134.107  13.965   4.890
  365    H    THR 127           H        THR 127 138.683  16.021   5.554
  366    HA   THR 127           HA       THR 127 140.080  16.259   2.968
  367    HB   THR 127           HB       THR 127 142.038  16.968   4.593
  368    HG1  THR 127           HG1      THR 127 139.756  17.833   6.030
  369   1HG2  THR 127          1HG2      THR 127 141.671  18.692   3.215
  370   2HG2  THR 127          2HG2      THR 127 140.823  19.374   4.603
  371   3HG2  THR 127          3HG2      THR 127 139.917  18.552   3.333
  372    H    ILE 128           H        ILE 128 140.440  14.172   2.439
  373    HA   ILE 128           HA       ILE 128 141.880  12.522   4.414
  374    HB   ILE 128           HB       ILE 128 140.109  11.448   2.223
  375   1HG1  ILE 128          2HG1      ILE 128 138.736  10.825   4.422
  376   2HG1  ILE 128          1HG1      ILE 128 139.500  12.294   5.017
  377   1HG2  ILE 128          1HG2      ILE 128 141.604   9.766   2.780
  378   2HG2  ILE 128          2HG2      ILE 128 140.230   9.423   3.831
  379   3HG2  ILE 128          3HG2      ILE 128 141.656  10.236   4.480
  380   1HD1  ILE 128          1HD1      ILE 128 138.423  13.632   3.450
  381   2HD1  ILE 128          2HD1      ILE 128 137.187  12.478   3.952
  382   3HD1  ILE 128          3HD1      ILE 128 138.024  12.260   2.415
  383    H    THR 129           H        THR 129 143.650  11.373   3.724
  384    HA   THR 129           HA       THR 129 144.893  12.318   1.291
  385    HB   THR 129           HB       THR 129 146.320  12.162   3.198
  386    HG1  THR 129           HG1      THR 129 147.929  11.008   2.321
  387   1HG2  THR 129          1HG2      THR 129 144.865   9.777   3.785
  388   2HG2  THR 129          2HG2      THR 129 145.982  10.685   4.802
  389   3HG2  THR 129          3HG2      THR 129 146.593   9.425   3.732
  390    H    GLU 130           H        GLU 130 146.123  10.634  -0.047
  391    HA   GLU 130           HA       GLU 130 144.208   8.878  -1.207
  392   1HB   GLU 130          2HB       GLU 130 146.913   9.804  -1.806
  393   2HB   GLU 130          1HB       GLU 130 146.659   8.121  -2.245
  394   1HG   GLU 130          2HG       GLU 130 144.423   9.199  -3.264
  395   2HG   GLU 130          1HG       GLU 130 145.514  10.579  -3.395
  396    H    ASP 131           H        ASP 131 146.817   8.497   1.079
  397    HA   ASP 131           HA       ASP 131 147.184   5.726   0.929
  398   1HB   ASP 131          2HB       ASP 131 148.492   7.560   2.258
  399   2HB   ASP 131          1HB       ASP 131 147.352   7.185   3.546
  400    H    ASP 132           H        ASP 132 145.017   7.635   3.005
  401    HA   ASP 132           HA       ASP 132 143.892   5.530   4.440
  402   1HB   ASP 132          2HB       ASP 132 142.850   8.245   3.662
  403   2HB   ASP 132          1HB       ASP 132 141.875   7.126   4.612
  404    H    ILE 133           H        ILE 133 143.117   6.789   1.253
  405    HA   ILE 133           HA       ILE 133 140.681   5.393   0.902
  406    HB   ILE 133           HB       ILE 133 142.594   6.260  -1.267
  407   1HG1  ILE 133          2HG1      ILE 133 140.349   7.809   0.047
  408   2HG1  ILE 133          1HG1      ILE 133 142.069   8.126   0.252
  409   1HG2  ILE 133          1HG2      ILE 133 139.760   5.351  -1.209
  410   2HG2  ILE 133          2HG2      ILE 133 141.039   4.988  -2.367
  411   3HG2  ILE 133          3HG2      ILE 133 140.241   6.560  -2.399
  412   1HD1  ILE 133          1HD1      ILE 133 142.293   8.822  -2.002
  413   2HD1  ILE 133          2HD1      ILE 133 140.878   9.641  -1.336
  414   3HD1  ILE 133          3HD1      ILE 133 140.673   8.252  -2.404
  415    H    GLU 134           H        GLU 134 144.036   4.612   0.077
  416    HA   GLU 134           HA       GLU 134 143.506   2.227  -1.319
  417   1HB   GLU 134          2HB       GLU 134 145.827   3.634  -0.305
  418   2HB   GLU 134          1HB       GLU 134 146.001   1.899  -0.089
  419   1HG   GLU 134          2HG       GLU 134 146.665   1.784  -2.193
  420   2HG   GLU 134          1HG       GLU 134 145.020   2.197  -2.673
  421    H    GLU 135           H        GLU 135 144.441   2.760   2.076
  422    HA   GLU 135           HA       GLU 135 144.341   0.056   2.844
  423   1HB   GLU 135          2HB       GLU 135 144.283   0.901   5.144
  424   2HB   GLU 135          1HB       GLU 135 145.477   1.758   4.182
  425   1HG   GLU 135          2HG       GLU 135 143.822   3.587   3.870
  426   2HG   GLU 135          1HG       GLU 135 142.754   2.743   4.990
  427    H    LEU 136           H        LEU 136 141.867   2.487   2.504
  428    HA   LEU 136           HA       LEU 136 139.847   1.346   4.066
  429   1HB   LEU 136          2HB       LEU 136 140.098   3.537   2.375
  430   2HB   LEU 136          1HB       LEU 136 138.850   2.565   1.620
  431    HG   LEU 136           HG       LEU 136 138.483   2.900   4.509
  432   1HD1  LEU 136          1HD1      LEU 136 138.609   5.280   2.688
  433   2HD1  LEU 136          2HD1      LEU 136 139.317   5.071   4.290
  434   3HD1  LEU 136          3HD1      LEU 136 137.573   5.256   4.115
  435   1HD2  LEU 136          1HD2      LEU 136 136.224   3.116   3.913
  436   2HD2  LEU 136          2HD2      LEU 136 136.885   1.942   2.774
  437   3HD2  LEU 136          3HD2      LEU 136 136.616   3.609   2.267
  438    H    MET 137           H        MET 137 141.022   0.541   0.881
  439    HA   MET 137           HA       MET 137 138.791  -1.186   0.268
  440   1HB   MET 137          2HB       MET 137 141.454  -0.951  -1.140
  441   2HB   MET 137          1HB       MET 137 139.998  -1.709  -1.772
  442   1HG   MET 137          2HG       MET 137 140.414   1.213  -1.194
  443   2HG   MET 137          1HG       MET 137 140.274   0.449  -2.776
  444   1HE   MET 137          1HE       MET 137 138.456  -0.559  -3.729
  445   2HE   MET 137          2HE       MET 137 137.630   0.974  -4.000
  446   3HE   MET 137          3HE       MET 137 136.750  -0.392  -3.312
  447    H    LYS 138           H        LYS 138 142.045  -1.497   1.525
  448    HA   LYS 138           HA       LYS 138 142.340  -4.278   1.248
  449   1HB   LYS 138          2HB       LYS 138 144.056  -2.428   1.935
  450   2HB   LYS 138          1HB       LYS 138 143.513  -2.790   3.568
  451   1HG   LYS 138          2HG       LYS 138 144.001  -5.282   2.638
  452   2HG   LYS 138          1HG       LYS 138 145.207  -4.349   1.750
  453   1HD   LYS 138          2HD       LYS 138 146.368  -3.801   3.629
  454   2HD   LYS 138          1HD       LYS 138 144.925  -3.785   4.645
  455   1HE   LYS 138          2HE       LYS 138 145.643  -6.418   3.560
  456   2HE   LYS 138          1HE       LYS 138 146.825  -5.733   4.674
  457   1HZ   LYS 138          1HZ       LYS 138 144.811  -5.313   6.168
  458   2HZ   LYS 138          2HZ       LYS 138 145.379  -6.900   6.037
  459   3HZ   LYS 138          3HZ       LYS 138 144.001  -6.422   5.182
  460    H    ASP 139           H        ASP 139 140.509  -2.365   3.475
  461    HA   ASP 139           HA       ASP 139 140.114  -4.639   5.267
  462   1HB   ASP 139          2HB       ASP 139 140.136  -1.795   5.602
  463   2HB   ASP 139          1HB       ASP 139 138.563  -2.412   6.103
  464    H    GLY 140           H        GLY 140 138.787  -3.672   2.445
  465   1HA   GLY 140          2HA       GLY 140 136.104  -4.613   3.250
  466   2HA   GLY 140          1HA       GLY 140 136.344  -3.364   2.038
  467    H    ASP 141           H        ASP 141 138.683  -4.764   0.890
  468    HA   ASP 141           HA       ASP 141 137.221  -6.450  -0.926
  469   1HB   ASP 141          2HB       ASP 141 139.800  -5.096  -0.879
  470   2HB   ASP 141          1HB       ASP 141 139.923  -6.726  -1.535
  471    H    LYS 142           H        LYS 142 136.598  -8.325   0.048
  472    HA   LYS 142           HA       LYS 142 138.426  -9.866   1.657
  473   1HB   LYS 142          2HB       LYS 142 135.731 -10.724   0.602
  474   2HB   LYS 142          1HB       LYS 142 136.603 -11.393   1.973
  475   1HG   LYS 142          2HG       LYS 142 135.653  -8.545   1.890
  476   2HG   LYS 142          1HG       LYS 142 134.666  -9.871   2.508
  477   1HD   LYS 142          2HD       LYS 142 137.159 -10.156   3.747
  478   2HD   LYS 142          1HD       LYS 142 136.811  -8.426   3.786
  479   1HE   LYS 142          2HE       LYS 142 134.409  -9.428   4.509
  480   2HE   LYS 142          1HE       LYS 142 135.479 -10.666   5.164
  481   1HZ   LYS 142          1HZ       LYS 142 136.750  -8.673   6.136
  482   2HZ   LYS 142          2HZ       LYS 142 135.305  -9.147   6.879
  483   3HZ   LYS 142          3HZ       LYS 142 135.326  -7.803   5.851
  484    H    ASN 143           H        ASN 143 137.191  -9.939  -1.628
  485    HA   ASN 143           HA       ASN 143 138.388 -12.509  -2.198
  486   1HB   ASN 143          2HB       ASN 143 137.255 -10.562  -4.206
  487   2HB   ASN 143          1HB       ASN 143 137.437 -12.305  -4.371
  488   1HD2  ASN 143          1HD2      ASN 143 136.145 -13.644  -2.904
  489   2HD2  ASN 143          2HD2      ASN 143 134.571 -13.093  -2.459
  490    H    ASN 144           H        ASN 144 139.583  -9.433  -1.890
  491    HA   ASN 144           HA       ASN 144 141.452  -8.349  -2.574
  492   1HB   ASN 144          2HB       ASN 144 142.192 -11.229  -2.521
  493   2HB   ASN 144          1HB       ASN 144 143.334 -10.116  -3.270
  494   1HD2  ASN 144          1HD2      ASN 144 144.709  -9.103  -1.992
  495   2HD2  ASN 144          2HD2      ASN 144 144.582  -8.968  -0.275
  496    H    ASP 145           H        ASP 145 139.413  -8.982  -4.626
  497    HA   ASP 145           HA       ASP 145 140.808  -9.544  -7.063
  498   1HB   ASP 145          2HB       ASP 145 138.675  -8.912  -8.152
  499   2HB   ASP 145          1HB       ASP 145 138.444 -10.087  -6.863
  500    H    GLY 146           H        GLY 146 139.822  -6.667  -5.324
  501   1HA   GLY 146          2HA       GLY 146 141.450  -4.777  -5.721
  502   2HA   GLY 146          1HA       GLY 146 141.090  -5.017  -7.423
  503    H    ARG 147           H        ARG 147 138.262  -5.595  -5.850
  504    HA   ARG 147           HA       ARG 147 137.467  -2.798  -5.616
  505   1HB   ARG 147          2HB       ARG 147 135.933  -4.737  -7.354
  506   2HB   ARG 147          1HB       ARG 147 135.578  -3.034  -7.099
  507   1HG   ARG 147          2HG       ARG 147 137.960  -2.670  -8.084
  508   2HG   ARG 147          1HG       ARG 147 137.729  -4.296  -8.733
  509   1HD   ARG 147          2HD       ARG 147 135.369  -3.170  -9.394
  510   2HD   ARG 147          1HD       ARG 147 136.418  -1.754  -9.458
  511    HE   ARG 147           HE       ARG 147 137.785  -3.617 -10.876
  512   1HH1  ARG 147          1HH1      ARG 147 134.525  -2.377 -11.049
  513   2HH1  ARG 147          2HH1      ARG 147 134.390  -2.621 -12.758
  514   1HH2  ARG 147          1HH2      ARG 147 137.607  -3.939 -13.123
  515   2HH2  ARG 147          2HH2      ARG 147 136.138  -3.509 -13.936
  516    H    ILE 148           H        ILE 148 135.283  -2.567  -4.665
  517    HA   ILE 148           HA       ILE 148 134.755  -4.783  -2.799
  518    HB   ILE 148           HB       ILE 148 133.973  -1.883  -2.474
  519   1HG1  ILE 148          2HG1      ILE 148 136.249  -3.409  -1.187
  520   2HG1  ILE 148          1HG1      ILE 148 136.427  -2.188  -2.442
  521   1HG2  ILE 148          1HG2      ILE 148 133.891  -4.228  -0.582
  522   2HG2  ILE 148          2HG2      ILE 148 132.513  -3.358  -1.258
  523   3HG2  ILE 148          3HG2      ILE 148 133.593  -2.553  -0.119
  524   1HD1  ILE 148          1HD1      ILE 148 135.093  -1.561   0.162
  525   2HD1  ILE 148          2HD1      ILE 148 135.818  -0.459  -1.008
  526   3HD1  ILE 148          3HD1      ILE 148 136.845  -1.500  -0.023
  527    H    ASP 149           H        ASP 149 132.918  -5.860  -2.958
  528    HA   ASP 149           HA       ASP 149 130.798  -4.772  -4.675
  529   1HB   ASP 149          2HB       ASP 149 129.976  -7.194  -4.640
  530   2HB   ASP 149          1HB       ASP 149 131.475  -6.876  -5.507
  531    H    TYR 150           H        TYR 150 128.550  -5.364  -4.058
  532    HA   TYR 150           HA       TYR 150 127.905  -4.318  -1.543
  533   1HB   TYR 150          2HB       TYR 150 126.376  -4.303  -3.486
  534   2HB   TYR 150          1HB       TYR 150 126.180  -6.046  -3.334
  535    HD1  TYR 150           HD1      TYR 150 124.052  -6.540  -2.596
  536    HD2  TYR 150           HD2      TYR 150 126.100  -3.239  -0.856
  537    HE1  TYR 150           HE1      TYR 150 122.167  -6.189  -1.053
  538    HE2  TYR 150           HE2      TYR 150 124.220  -2.884   0.691
  539    HH   TYR 150           HH       TYR 150 121.637  -3.457   0.610
  540    H    ASP 151           H        ASP 151 128.777  -7.514  -2.465
  541    HA   ASP 151           HA       ASP 151 127.480  -8.875  -0.315
  542   1HB   ASP 151          2HB       ASP 151 129.527  -9.591  -2.372
  543   2HB   ASP 151          1HB       ASP 151 129.342 -10.638  -0.968
  544    H    GLU 152           H        GLU 152 130.929  -8.173  -0.927
  545    HA   GLU 152           HA       GLU 152 131.698  -8.848   1.728
  546   1HB   GLU 152          2HB       GLU 152 133.904  -8.038   1.099
  547   2HB   GLU 152          1HB       GLU 152 133.236  -9.055  -0.169
  548   1HG   GLU 152          2HG       GLU 152 132.450  -6.818  -1.202
  549   2HG   GLU 152          1HG       GLU 152 133.663  -6.106  -0.138
  550    H    PHE 153           H        PHE 153 130.766  -5.863   0.147
  551    HA   PHE 153           HA       PHE 153 131.786  -4.104   2.130
  552   1HB   PHE 153          2HB       PHE 153 130.785  -3.709  -0.331
  553   2HB   PHE 153          1HB       PHE 153 129.357  -3.320   0.615
  554    HD1  PHE 153           HD1      PHE 153 131.466  -1.662  -1.173
  555    HD2  PHE 153           HD2      PHE 153 130.612  -2.031   2.978
  556    HE1  PHE 153           HE1      PHE 153 132.362   0.597  -0.790
  557    HE2  PHE 153           HE2      PHE 153 131.504   0.225   3.369
  558    HZ   PHE 153           HZ       PHE 153 132.381   1.544   1.483
  559    H    LEU 154           H        LEU 154 128.764  -5.849   1.742
  560    HA   LEU 154           HA       LEU 154 127.125  -4.595   3.555
  561   1HB   LEU 154          2HB       LEU 154 126.989  -6.895   2.103
  562   2HB   LEU 154          1HB       LEU 154 127.092  -7.534   3.732
  563    HG   LEU 154           HG       LEU 154 124.779  -7.349   3.142
  564   1HD1  LEU 154          1HD1      LEU 154 125.684  -5.207   5.051
  565   2HD1  LEU 154          2HD1      LEU 154 125.170  -6.851   5.428
  566   3HD1  LEU 154          3HD1      LEU 154 123.997  -5.673   4.841
  567   1HD2  LEU 154          1HD2      LEU 154 125.579  -4.626   2.219
  568   2HD2  LEU 154          2HD2      LEU 154 123.922  -4.916   2.750
  569   3HD2  LEU 154          3HD2      LEU 154 124.593  -5.844   1.409
  570    H    GLU 155           H        GLU 155 129.737  -6.870   4.188
  571    HA   GLU 155           HA       GLU 155 129.227  -7.027   7.004
  572   1HB   GLU 155          2HB       GLU 155 131.229  -8.104   5.115
  573   2HB   GLU 155          1HB       GLU 155 131.787  -7.882   6.767
  574   1HG   GLU 155          2HG       GLU 155 129.284  -9.389   6.067
  575   2HG   GLU 155          1HG       GLU 155 130.868 -10.150   6.209
  576    H    PHE 156           H        PHE 156 131.110  -4.975   4.919
  577    HA   PHE 156           HA       PHE 156 132.952  -3.943   6.745
  578   1HB   PHE 156          2HB       PHE 156 132.428  -3.524   4.106
  579   2HB   PHE 156          1HB       PHE 156 131.847  -2.015   4.800
  580    HD1  PHE 156           HD1      PHE 156 133.933  -2.082   7.121
  581    HD2  PHE 156           HD2      PHE 156 134.218  -2.484   2.894
  582    HE1  PHE 156           HE1      PHE 156 136.240  -1.230   7.200
  583    HE2  PHE 156           HE2      PHE 156 136.524  -1.632   2.967
  584    HZ   PHE 156           HZ       PHE 156 137.539  -1.006   5.121
  585    H    MET 157           H        MET 157 129.551  -3.344   6.376
  586    HA   MET 157           HA       MET 157 129.725  -1.203   8.392
  587   1HB   MET 157          2HB       MET 157 128.519  -1.098   5.930
  588   2HB   MET 157          1HB       MET 157 127.166  -1.491   6.982
  589   1HG   MET 157          2HG       MET 157 127.016   0.707   7.294
  590   2HG   MET 157          1HG       MET 157 128.389   0.499   8.380
  591   1HE   MET 157          1HE       MET 157 130.703   0.548   7.731
  592   2HE   MET 157          2HE       MET 157 131.377   1.776   6.661
  593   3HE   MET 157          3HE       MET 157 130.999   0.172   6.034
  594    H    LYS 158           H        LYS 158 129.059  -4.413   8.151
  595    HA   LYS 158           HA       LYS 158 126.866  -4.370  10.101
  596   1HB   LYS 158          2HB       LYS 158 127.488  -6.071   7.929
  597   2HB   LYS 158          1HB       LYS 158 127.702  -7.028   9.387
  598   1HG   LYS 158          2HG       LYS 158 125.486  -7.390   8.851
  599   2HG   LYS 158          1HG       LYS 158 125.389  -6.107  10.060
  600   1HD   LYS 158          2HD       LYS 158 125.648  -4.716   7.697
  601   2HD   LYS 158          1HD       LYS 158 124.634  -6.087   7.241
  602   1HE   LYS 158          2HE       LYS 158 122.937  -4.855   8.023
  603   2HE   LYS 158          1HE       LYS 158 123.525  -5.316   9.619
  604   1HZ   LYS 158          1HZ       LYS 158 124.815  -3.009   8.419
  605   2HZ   LYS 158          2HZ       LYS 158 124.319  -3.264  10.016
  606   3HZ   LYS 158          3HZ       LYS 158 123.192  -2.796   8.845
  607    H    GLY 159           H        GLY 159 129.423  -3.479  10.877
  608   1HA   GLY 159          2HA       GLY 159 130.228  -3.910  13.164
  609   2HA   GLY 159          1HA       GLY 159 130.238  -5.620  12.746
  610    H    VAL 160           H        VAL 160 132.158  -2.943  13.088
  611    HA   VAL 160           HA       VAL 160 134.177  -4.051  11.248
  612    HB   VAL 160           HB       VAL 160 134.527  -1.241  12.083
  613   1HG1  VAL 160          1HG1      VAL 160 134.816  -2.822   9.545
  614   2HG1  VAL 160          2HG1      VAL 160 136.082  -2.111  10.545
  615   3HG1  VAL 160          3HG1      VAL 160 135.018  -1.072   9.599
  616   1HG2  VAL 160          1HG2      VAL 160 132.312  -2.016  10.182
  617   2HG2  VAL 160          2HG2      VAL 160 132.929  -0.380  10.415
  618   3HG2  VAL 160          3HG2      VAL 160 132.122  -1.215  11.742
  619    H    GLU 161           H        GLU 161 134.116  -5.233  13.613
  620    HA   GLU 161           HA       GLU 161 135.453  -4.067  15.761
  621   1HB   GLU 161          2HB       GLU 161 136.092  -6.470  16.319
  622   2HB   GLU 161          1HB       GLU 161 134.376  -6.127  16.157
  623   1HG   GLU 161          2HG       GLU 161 135.375  -6.888  13.610
  624   2HG   GLU 161          1HG       GLU 161 135.931  -8.063  14.801
  Start of MODEL   20
    1   1H    MET  81          1HT       MET  81  92.946 -14.139   2.624
    2   2H    MET  81          2HT       MET  81  94.075 -13.133   1.811
    3   3H    MET  81          3HT       MET  81  93.200 -14.325   0.939
    4    HA   MET  81           HA       MET  81  92.426 -12.014   0.666
    5   1HB   MET  81          2HB       MET  81  90.836 -14.388   1.499
    6   2HB   MET  81          1HB       MET  81  89.976 -12.862   1.338
    7   1HG   MET  81          2HG       MET  81  91.755 -13.582  -0.896
    8   2HG   MET  81          1HG       MET  81  90.334 -14.601  -0.672
    9   1HE   MET  81          1HE       MET  81  89.251 -12.270  -3.622
   10   2HE   MET  81          2HE       MET  81  89.551 -13.926  -3.097
   11   3HE   MET  81          3HE       MET  81  90.901 -12.816  -3.328
   12    H    VAL  82           H        VAL  82  91.410 -13.472   3.763
   13    HA   VAL  82           HA       VAL  82  90.948 -10.772   4.814
   14    HB   VAL  82           HB       VAL  82  90.136 -13.392   6.074
   15   1HG1  VAL  82          1HG1      VAL  82  90.000 -11.880   7.784
   16   2HG1  VAL  82          2HG1      VAL  82  88.405 -11.665   7.062
   17   3HG1  VAL  82          3HG1      VAL  82  89.697 -10.518   6.705
   18   1HG2  VAL  82          1HG2      VAL  82  89.020 -13.265   3.960
   19   2HG2  VAL  82          2HG2      VAL  82  88.591 -11.576   4.230
   20   3HG2  VAL  82          3HG2      VAL  82  87.858 -12.840   5.217
   21    H    ARG  83           H        ARG  83  91.787 -10.133   6.826
   22    HA   ARG  83           HA       ARG  83  93.577  -9.787   8.208
   23   1HB   ARG  83          2HB       ARG  83  93.935 -11.569   9.814
   24   2HB   ARG  83          1HB       ARG  83  92.220 -11.425   9.453
   25   1HG   ARG  83          2HG       ARG  83  92.308 -13.363   8.030
   26   2HG   ARG  83          1HG       ARG  83  94.059 -13.467   8.223
   27   1HD   ARG  83          2HD       ARG  83  92.442 -13.460  10.699
   28   2HD   ARG  83          1HD       ARG  83  92.329 -14.898   9.687
   29    HE   ARG  83           HE       ARG  83  95.031 -14.080  10.172
   30   1HH1  ARG  83          1HH1      ARG  83  92.334 -15.868  11.475
   31   2HH1  ARG  83          2HH1      ARG  83  93.326 -16.888  12.462
   32   1HH2  ARG  83          1HH2      ARG  83  96.339 -15.421  11.467
   33   2HH2  ARG  83          2HH2      ARG  83  95.600 -16.634  12.458
   34    H    CYS  84           H        CYS  84  94.403 -10.254   5.556
   35    HA   CYS  84           HA       CYS  84  97.141 -10.983   6.032
   36   1HB   CYS  84          2HB       CYS  84  95.628 -13.118   5.428
   37   2HB   CYS  84          1HB       CYS  84  95.973 -12.554   3.798
   38    HG   CYS  84           HG       CYS  84  97.800 -14.274   4.594
   39    H    MET  85           H        MET  85  95.599  -8.682   5.123
   40    HA   MET  85           HA       MET  85  96.435  -8.423   2.327
   41   1HB   MET  85          2HB       MET  85  94.092  -7.751   3.322
   42   2HB   MET  85          1HB       MET  85  94.941  -6.287   3.796
   43   1HG   MET  85          2HG       MET  85  94.381  -5.524   1.786
   44   2HG   MET  85          1HG       MET  85  95.682  -6.549   1.186
   45   1HE   MET  85          1HE       MET  85  95.215  -8.551  -0.583
   46   2HE   MET  85          2HE       MET  85  93.910  -9.660  -0.160
   47   3HE   MET  85          3HE       MET  85  95.126  -9.228   1.043
   48    H    LYS  86           H        LYS  86  96.449  -6.324   5.216
   49    HA   LYS  86           HA       LYS  86  98.703  -4.840   4.193
   50   1HB   LYS  86          2HB       LYS  86  96.621  -4.251   5.908
   51   2HB   LYS  86          1HB       LYS  86  97.995  -4.382   6.996
   52   1HG   LYS  86          2HG       LYS  86  99.200  -2.710   5.737
   53   2HG   LYS  86          1HG       LYS  86  97.896  -2.630   4.549
   54   1HD   LYS  86          2HD       LYS  86  96.369  -1.946   6.427
   55   2HD   LYS  86          1HD       LYS  86  97.802  -1.806   7.446
   56   1HE   LYS  86          2HE       LYS  86  98.632  -0.326   5.399
   57   2HE   LYS  86          1HE       LYS  86  96.895  -0.107   5.187
   58   1HZ   LYS  86          1HZ       LYS  86  96.707   0.785   7.361
   59   2HZ   LYS  86          2HZ       LYS  86  97.994   1.589   6.614
   60   3HZ   LYS  86          3HZ       LYS  86  98.303   0.376   7.752
   61    H    ASP  87           H        ASP  87 100.322  -6.448   4.092
   62    HA   ASP  87           HA       ASP  87 101.233  -7.541   6.657
   63   1HB   ASP  87          2HB       ASP  87 100.922  -8.808   4.289
   64   2HB   ASP  87          1HB       ASP  87 102.609  -8.322   4.154
   65    H    ASP  88           H        ASP  88 103.366  -7.294   7.364
   66    HA   ASP  88           HA       ASP  88 104.512  -4.786   7.075
   67   1HB   ASP  88          2HB       ASP  88 104.982  -7.019   8.646
   68   2HB   ASP  88          1HB       ASP  88 106.475  -6.846   7.729
   69    H    SER  89           H        SER  89 105.108  -3.991   5.150
   70    HA   SER  89           HA       SER  89 106.345  -5.611   3.126
   71   1HB   SER  89          2HB       SER  89 106.257  -3.681   1.745
   72   2HB   SER  89          1HB       SER  89 104.800  -3.608   2.737
   73    HG   SER  89           HG       SER  89 105.869  -1.598   2.678
   74    H    LYS  90           H        LYS  90 108.234  -3.822   2.067
   75    HA   LYS  90           HA       LYS  90 110.597  -4.621   3.154
   76   1HB   LYS  90          2HB       LYS  90 110.213  -1.883   1.946
   77   2HB   LYS  90          1HB       LYS  90 111.674  -2.860   1.940
   78   1HG   LYS  90          2HG       LYS  90 111.064  -3.558  -0.074
   79   2HG   LYS  90          1HG       LYS  90 109.791  -4.481   0.725
   80   1HD   LYS  90          2HD       LYS  90 108.216  -2.703   0.414
   81   2HD   LYS  90          1HD       LYS  90 109.480  -1.619  -0.169
   82   1HE   LYS  90          2HE       LYS  90 109.074  -4.187  -1.607
   83   2HE   LYS  90          1HE       LYS  90 107.862  -2.923  -1.821
   84   1HZ   LYS  90          1HZ       LYS  90 110.650  -2.117  -2.073
   85   2HZ   LYS  90          2HZ       LYS  90 109.296  -1.615  -2.951
   86   3HZ   LYS  90          3HZ       LYS  90 110.034  -3.093  -3.311
   87    H    GLY  91           H        GLY  91 111.980  -3.997   4.742
   88   1HA   GLY  91          2HA       GLY  91 111.022  -1.850   6.536
   89   2HA   GLY  91          1HA       GLY  91 111.798  -3.317   7.112
   90    H    LYS  92           H        LYS  92 113.407  -2.176   8.202
   91    HA   LYS  92           HA       LYS  92 115.328  -0.761   6.474
   92   1HB   LYS  92          2HB       LYS  92 116.119   0.246   8.692
   93   2HB   LYS  92          1HB       LYS  92 114.584   0.813   8.049
   94   1HG   LYS  92          2HG       LYS  92 113.417  -0.753   9.569
   95   2HG   LYS  92          1HG       LYS  92 114.980  -1.188  10.263
   96   1HD   LYS  92          2HD       LYS  92 114.618   0.478  11.713
   97   2HD   LYS  92          1HD       LYS  92 115.000   1.562  10.373
   98   1HE   LYS  92          2HE       LYS  92 112.516   1.390   9.776
   99   2HE   LYS  92          1HE       LYS  92 112.307   0.700  11.384
  100   1HZ   LYS  92          1HZ       LYS  92 112.166   3.299  10.882
  101   2HZ   LYS  92          2HZ       LYS  92 113.814   3.181  11.245
  102   3HZ   LYS  92          3HZ       LYS  92 112.660   2.675  12.375
  103    H    THR  93           H        THR  93 115.871  -3.168   6.093
  104    HA   THR  93           HA       THR  93 117.801  -4.063   8.129
  105    HB   THR  93           HB       THR  93 115.938  -5.629   7.720
  106    HG1  THR  93           HG1      THR  93 117.316  -7.160   8.027
  107   1HG2  THR  93          1HG2      THR  93 116.854  -6.608   5.162
  108   2HG2  THR  93          2HG2      THR  93 116.206  -4.971   5.054
  109   3HG2  THR  93          3HG2      THR  93 115.219  -6.269   5.727
  110    H    GLU  94           H        GLU  94 119.090  -5.958   6.428
  111    HA   GLU  94           HA       GLU  94 121.053  -4.293   5.241
  112   1HB   GLU  94          2HB       GLU  94 120.566  -7.263   5.177
  113   2HB   GLU  94          1HB       GLU  94 121.915  -6.517   4.331
  114   1HG   GLU  94          2HG       GLU  94 122.967  -5.884   6.297
  115   2HG   GLU  94          1HG       GLU  94 121.487  -6.012   7.245
  116    H    GLU  95           H        GLU  95 118.057  -5.265   4.108
  117    HA   GLU  95           HA       GLU  95 118.700  -5.576   1.332
  118   1HB   GLU  95          2HB       GLU  95 116.159  -5.312   2.901
  119   2HB   GLU  95          1HB       GLU  95 116.122  -5.153   1.151
  120   1HG   GLU  95          2HG       GLU  95 117.119  -7.375   0.933
  121   2HG   GLU  95          1HG       GLU  95 117.132  -7.534   2.688
  122    H    GLU  96           H        GLU  96 117.794  -2.926   3.426
  123    HA   GLU  96           HA       GLU  96 117.295  -1.089   1.269
  124   1HB   GLU  96          2HB       GLU  96 117.010   0.582   2.986
  125   2HB   GLU  96          1HB       GLU  96 116.184  -0.889   3.480
  126   1HG   GLU  96          2HG       GLU  96 117.298  -0.873   5.385
  127   2HG   GLU  96          1HG       GLU  96 118.816  -1.019   4.499
  128    H    LEU  97           H        LEU  97 120.038  -2.118   3.107
  129    HA   LEU  97           HA       LEU  97 121.704   0.123   2.783
  130   1HB   LEU  97          2HB       LEU  97 122.101  -2.754   3.399
  131   2HB   LEU  97          1HB       LEU  97 123.504  -1.849   2.865
  132    HG   LEU  97           HG       LEU  97 121.781  -0.996   5.187
  133   1HD1  LEU  97          1HD1      LEU  97 124.458  -2.179   5.625
  134   2HD1  LEU  97          2HD1      LEU  97 123.137  -3.286   5.251
  135   3HD1  LEU  97          3HD1      LEU  97 123.020  -2.212   6.645
  136   1HD2  LEU  97          1HD2      LEU  97 124.529  -0.182   4.250
  137   2HD2  LEU  97          2HD2      LEU  97 123.776   0.343   5.756
  138   3HD2  LEU  97          3HD2      LEU  97 123.064   0.800   4.210
  139    H    SER  98           H        SER  98 120.575  -2.152   0.501
  140    HA   SER  98           HA       SER  98 122.723  -2.272  -1.292
  141   1HB   SER  98          2HB       SER  98 120.926  -3.799  -1.612
  142   2HB   SER  98          1HB       SER  98 119.740  -2.499  -1.696
  143    HG   SER  98           HG       SER  98 121.829  -2.897  -3.577
  144    H    ASP  99           H        ASP  99 120.049   0.035  -1.019
  145    HA   ASP  99           HA       ASP  99 120.574   1.524  -3.325
  146   1HB   ASP  99          2HB       ASP  99 118.524   1.681  -1.866
  147   2HB   ASP  99          1HB       ASP  99 119.483   2.625  -0.730
  148    H    LEU 100           H        LEU 100 121.852   1.825  -0.043
  149    HA   LEU 100           HA       LEU 100 123.271   4.218  -0.403
  150   1HB   LEU 100          2HB       LEU 100 123.637   1.881   1.454
  151   2HB   LEU 100          1HB       LEU 100 124.707   3.269   1.500
  152    HG   LEU 100           HG       LEU 100 122.798   3.224   3.177
  153   1HD1  LEU 100          1HD1      LEU 100 122.206   5.721   2.453
  154   2HD1  LEU 100          2HD1      LEU 100 123.609   5.456   1.419
  155   3HD1  LEU 100          3HD1      LEU 100 123.754   5.274   3.167
  156   1HD2  LEU 100          1HD2      LEU 100 121.207   3.943   0.720
  157   2HD2  LEU 100          2HD2      LEU 100 120.631   4.026   2.384
  158   3HD2  LEU 100          3HD2      LEU 100 121.040   2.466   1.669
  159    H    PHE 101           H        PHE 101 123.947   0.969  -1.402
  160    HA   PHE 101           HA       PHE 101 126.731   1.098  -1.687
  161   1HB   PHE 101          2HB       PHE 101 125.407  -0.989  -1.848
  162   2HB   PHE 101          1HB       PHE 101 124.765  -0.445  -3.393
  163    HD1  PHE 101           HD1      PHE 101 125.578  -2.090  -4.839
  164    HD2  PHE 101           HD2      PHE 101 128.252  -0.108  -2.190
  165    HE1  PHE 101           HE1      PHE 101 127.486  -3.125  -5.997
  166    HE2  PHE 101           HE2      PHE 101 130.165  -1.139  -3.341
  167    HZ   PHE 101           HZ       PHE 101 129.784  -2.649  -5.248
  168    H    ARG 102           H        ARG 102 124.130   1.948  -3.950
  169    HA   ARG 102           HA       ARG 102 125.703   2.530  -6.174
  170   1HB   ARG 102          2HB       ARG 102 123.009   3.426  -5.233
  171   2HB   ARG 102          1HB       ARG 102 123.735   4.222  -6.623
  172   1HG   ARG 102          2HG       ARG 102 124.087   1.668  -7.348
  173   2HG   ARG 102          1HG       ARG 102 122.640   1.497  -6.353
  174   1HD   ARG 102          2HD       ARG 102 121.748   3.503  -7.713
  175   2HD   ARG 102          1HD       ARG 102 123.035   3.104  -8.851
  176    HE   ARG 102           HE       ARG 102 121.847   1.257  -9.506
  177   1HH1  ARG 102          1HH1      ARG 102 120.476   2.503  -6.548
  178   2HH1  ARG 102          2HH1      ARG 102 119.092   1.465  -6.606
  179   1HH2  ARG 102          1HH2      ARG 102 120.027  -0.108  -9.584
  180   2HH2  ARG 102          2HH2      ARG 102 118.836  -0.018  -8.329
  181    H    MET 103           H        MET 103 124.823   4.539  -3.409
  182    HA   MET 103           HA       MET 103 125.742   7.002  -4.327
  183   1HB   MET 103          2HB       MET 103 125.668   5.851  -1.537
  184   2HB   MET 103          1HB       MET 103 126.080   7.526  -1.880
  185   1HG   MET 103          2HG       MET 103 123.708   7.141  -3.239
  186   2HG   MET 103          1HG       MET 103 123.490   6.236  -1.743
  187   1HE   MET 103          1HE       MET 103 122.694   7.857   0.694
  188   2HE   MET 103          2HE       MET 103 124.199   8.731   0.984
  189   3HE   MET 103          3HE       MET 103 124.244   7.061   0.420
  190    H    PHE 104           H        PHE 104 127.486   4.235  -3.125
  191    HA   PHE 104           HA       PHE 104 129.973   5.648  -2.791
  192   1HB   PHE 104          2HB       PHE 104 128.937   3.155  -1.984
  193   2HB   PHE 104          1HB       PHE 104 130.307   2.795  -3.028
  194    HD1  PHE 104           HD1      PHE 104 129.237   4.329   0.111
  195    HD2  PHE 104           HD2      PHE 104 132.552   3.402  -2.390
  196    HE1  PHE 104           HE1      PHE 104 130.771   4.799   1.977
  197    HE2  PHE 104           HE2      PHE 104 134.092   3.869  -0.529
  198    HZ   PHE 104           HZ       PHE 104 133.203   4.568   1.659
  199    H    ASP 105           H        ASP 105 128.320   4.044  -5.361
  200    HA   ASP 105           HA       ASP 105 130.741   3.806  -6.973
  201   1HB   ASP 105          2HB       ASP 105 128.572   2.198  -6.824
  202   2HB   ASP 105          1HB       ASP 105 128.097   3.221  -8.175
  203    H    LYS 106           H        LYS 106 131.073   4.923  -8.899
  204    HA   LYS 106           HA       LYS 106 129.415   7.335  -9.212
  205   1HB   LYS 106          2HB       LYS 106 132.126   7.165  -8.771
  206   2HB   LYS 106          1HB       LYS 106 132.039   7.359 -10.517
  207   1HG   LYS 106          2HG       LYS 106 130.491   9.177  -8.722
  208   2HG   LYS 106          1HG       LYS 106 132.212   9.450  -9.008
  209   1HD   LYS 106          2HD       LYS 106 130.181   9.149 -11.214
  210   2HD   LYS 106          1HD       LYS 106 130.659  10.706 -10.534
  211   1HE   LYS 106          2HE       LYS 106 133.077   9.558 -11.072
  212   2HE   LYS 106          1HE       LYS 106 132.081   8.938 -12.388
  213   1HZ   LYS 106          1HZ       LYS 106 133.239  11.105 -12.818
  214   2HZ   LYS 106          2HZ       LYS 106 132.201  11.815 -11.687
  215   3HZ   LYS 106          3HZ       LYS 106 131.569  11.114 -13.091
  216    H    ASN 107           H        ASN 107 131.123   4.785 -10.970
  217    HA   ASN 107           HA       ASN 107 129.934   5.646 -13.485
  218   1HB   ASN 107          2HB       ASN 107 131.291   3.775 -14.453
  219   2HB   ASN 107          1HB       ASN 107 132.243   4.996 -13.612
  220   1HD2  ASN 107          1HD2      ASN 107 133.198   2.454 -14.138
  221   2HD2  ASN 107          2HD2      ASN 107 133.402   1.610 -12.645
  222    H    ALA 108           H        ALA 108 128.763   3.974 -10.974
  223    HA   ALA 108           HA       ALA 108 127.238   2.305 -10.656
  224   1HB   ALA 108          1HB       ALA 108 125.455   2.305 -12.544
  225   2HB   ALA 108          2HB       ALA 108 126.363   3.686 -13.156
  226   3HB   ALA 108          3HB       ALA 108 125.659   3.741 -11.540
  227    H    ASP 109           H        ASP 109 129.166   0.817 -11.044
  228    HA   ASP 109           HA       ASP 109 128.584  -0.942 -13.336
  229   1HB   ASP 109          2HB       ASP 109 130.956  -1.605 -13.307
  230   2HB   ASP 109          1HB       ASP 109 130.764   0.123 -13.591
  231    H    GLY 110           H        GLY 110 128.453  -0.693 -10.004
  232   1HA   GLY 110          2HA       GLY 110 127.565  -2.397  -8.629
  233   2HA   GLY 110          1HA       GLY 110 128.152  -3.594  -9.775
  234    H    TYR 111           H        TYR 111 130.757  -1.840  -9.653
  235    HA   TYR 111           HA       TYR 111 131.755  -2.862  -7.088
  236   1HB   TYR 111          2HB       TYR 111 133.128  -3.180  -9.766
  237   2HB   TYR 111          1HB       TYR 111 133.836  -3.595  -8.210
  238    HD1  TYR 111           HD1      TYR 111 133.588  -5.751  -7.376
  239    HD2  TYR 111           HD2      TYR 111 130.900  -4.373 -10.373
  240    HE1  TYR 111           HE1      TYR 111 132.617  -8.004  -7.531
  241    HE2  TYR 111           HE2      TYR 111 129.920  -6.623 -10.535
  242    HH   TYR 111           HH       TYR 111 129.837  -8.736  -8.642
  243    H    ILE 112           H        ILE 112 133.352  -1.636  -6.115
  244    HA   ILE 112           HA       ILE 112 133.822   0.994  -7.356
  245    HB   ILE 112           HB       ILE 112 134.049   0.286  -4.430
  246   1HG1  ILE 112          2HG1      ILE 112 131.865   2.035  -5.420
  247   2HG1  ILE 112          1HG1      ILE 112 131.707   0.316  -5.763
  248   1HG2  ILE 112          1HG2      ILE 112 135.324   2.171  -4.625
  249   2HG2  ILE 112          2HG2      ILE 112 133.736   2.905  -4.406
  250   3HG2  ILE 112          3HG2      ILE 112 134.428   2.768  -6.022
  251   1HD1  ILE 112          1HD1      ILE 112 132.001  -0.133  -3.344
  252   2HD1  ILE 112          2HD1      ILE 112 130.563   0.812  -3.728
  253   3HD1  ILE 112          3HD1      ILE 112 131.989   1.607  -3.064
  254    H    ASP 113           H        ASP 113 135.843   1.719  -7.702
  255    HA   ASP 113           HA       ASP 113 138.060  -0.055  -6.919
  256   1HB   ASP 113          2HB       ASP 113 137.382   0.572  -9.446
  257   2HB   ASP 113          1HB       ASP 113 138.452   1.926  -9.096
  258    H    LEU 114           H        LEU 114 140.234   1.371  -7.126
  259    HA   LEU 114           HA       LEU 114 140.223   3.061  -4.887
  260   1HB   LEU 114          2HB       LEU 114 142.146   1.969  -6.688
  261   2HB   LEU 114          1HB       LEU 114 142.467   3.685  -6.521
  262    HG   LEU 114           HG       LEU 114 143.787   2.522  -4.904
  263   1HD1  LEU 114          1HD1      LEU 114 142.228   4.605  -4.291
  264   2HD1  LEU 114          2HD1      LEU 114 143.342   3.866  -3.141
  265   3HD1  LEU 114          3HD1      LEU 114 141.630   3.442  -3.106
  266   1HD2  LEU 114          1HD2      LEU 114 142.740   0.431  -4.684
  267   2HD2  LEU 114          2HD2      LEU 114 141.207   1.155  -4.200
  268   3HD2  LEU 114          3HD2      LEU 114 142.583   1.187  -3.099
  269    H    GLU 115           H        GLU 115 139.793   3.714  -8.290
  270    HA   GLU 115           HA       GLU 115 140.305   6.487  -8.240
  271   1HB   GLU 115          2HB       GLU 115 138.904   4.615 -10.084
  272   2HB   GLU 115          1HB       GLU 115 138.603   6.338 -10.279
  273   1HG   GLU 115          2HG       GLU 115 140.357   5.803 -11.750
  274   2HG   GLU 115          1HG       GLU 115 141.099   6.644 -10.390
  275    H    GLU 116           H        GLU 116 137.229   4.690  -8.077
  276    HA   GLU 116           HA       GLU 116 135.526   6.873  -7.819
  277   1HB   GLU 116          2HB       GLU 116 135.381   3.988  -7.273
  278   2HB   GLU 116          1HB       GLU 116 134.285   4.961  -6.301
  279   1HG   GLU 116          2HG       GLU 116 132.909   4.700  -8.046
  280   2HG   GLU 116          1HG       GLU 116 133.842   6.031  -8.731
  281    H    LEU 117           H        LEU 117 137.096   4.953  -5.279
  282    HA   LEU 117           HA       LEU 117 136.030   6.206  -3.051
  283   1HB   LEU 117          2HB       LEU 117 138.856   5.190  -3.346
  284   2HB   LEU 117          1HB       LEU 117 138.000   5.442  -1.836
  285    HG   LEU 117           HG       LEU 117 137.105   3.474  -3.937
  286   1HD1  LEU 117          1HD1      LEU 117 138.085   1.738  -2.531
  287   2HD1  LEU 117          2HD1      LEU 117 138.743   2.972  -1.455
  288   3HD1  LEU 117          3HD1      LEU 117 139.321   2.854  -3.118
  289   1HD2  LEU 117          1HD2      LEU 117 135.310   4.101  -2.506
  290   2HD2  LEU 117          2HD2      LEU 117 136.327   3.972  -1.072
  291   3HD2  LEU 117          3HD2      LEU 117 135.880   2.521  -1.967
  292    H    LYS 118           H        LYS 118 138.499   7.310  -5.244
  293    HA   LYS 118           HA       LYS 118 139.416   9.447  -3.553
  294   1HB   LYS 118          2HB       LYS 118 140.693   8.247  -5.461
  295   2HB   LYS 118          1HB       LYS 118 139.812   9.329  -6.530
  296   1HG   LYS 118          2HG       LYS 118 140.821  11.021  -4.602
  297   2HG   LYS 118          1HG       LYS 118 142.114   9.844  -4.840
  298   1HD   LYS 118          2HD       LYS 118 142.543  10.549  -6.945
  299   2HD   LYS 118          1HD       LYS 118 140.843  10.863  -7.298
  300   1HE   LYS 118          2HE       LYS 118 140.906  12.965  -6.238
  301   2HE   LYS 118          1HE       LYS 118 142.443  12.610  -5.449
  302   1HZ   LYS 118          1HZ       LYS 118 143.613  12.924  -7.403
  303   2HZ   LYS 118          2HZ       LYS 118 142.431  14.129  -7.496
  304   3HZ   LYS 118          3HZ       LYS 118 142.256  12.705  -8.390
  305    H    ILE 119           H        ILE 119 136.844   8.986  -5.804
  306    HA   ILE 119           HA       ILE 119 136.439  11.820  -6.271
  307    HB   ILE 119           HB       ILE 119 134.608   9.538  -7.009
  308   1HG1  ILE 119          2HG1      ILE 119 136.671  10.865  -8.773
  309   2HG1  ILE 119          1HG1      ILE 119 136.959   9.349  -7.926
  310   1HG2  ILE 119          1HG2      ILE 119 133.511  11.685  -7.066
  311   2HG2  ILE 119          2HG2      ILE 119 133.793  11.128  -8.718
  312   3HG2  ILE 119          3HG2      ILE 119 134.830  12.370  -8.016
  313   1HD1  ILE 119          1HD1      ILE 119 134.527   9.486  -9.586
  314   2HD1  ILE 119          2HD1      ILE 119 135.663   8.160  -9.337
  315   3HD1  ILE 119          3HD1      ILE 119 136.073   9.479 -10.435
  316    H    MET 120           H        MET 120 134.477   9.197  -4.846
  317    HA   MET 120           HA       MET 120 132.445  10.743  -3.791
  318   1HB   MET 120          2HB       MET 120 132.394   8.291  -3.863
  319   2HB   MET 120          1HB       MET 120 133.636   8.224  -2.619
  320   1HG   MET 120          2HG       MET 120 131.926   9.623  -1.237
  321   2HG   MET 120          1HG       MET 120 130.762   8.975  -2.392
  322   1HE   MET 120          1HE       MET 120 133.310   6.772   0.644
  323   2HE   MET 120          2HE       MET 120 133.762   8.157  -0.350
  324   3HE   MET 120          3HE       MET 120 133.902   6.523  -0.999
  325    H    LEU 121           H        LEU 121 135.693  10.298  -2.630
  326    HA   LEU 121           HA       LEU 121 135.145  11.431  -0.028
  327   1HB   LEU 121          2HB       LEU 121 137.657  10.563  -1.433
  328   2HB   LEU 121          1HB       LEU 121 137.700  11.388   0.113
  329    HG   LEU 121           HG       LEU 121 136.185   8.820  -0.329
  330   1HD1  LEU 121          1HD1      LEU 121 138.011   7.570   0.096
  331   2HD1  LEU 121          2HD1      LEU 121 138.725   8.781   1.161
  332   3HD1  LEU 121          3HD1      LEU 121 138.857   8.958  -0.588
  333   1HD2  LEU 121          1HD2      LEU 121 136.815   8.874   2.269
  334   2HD2  LEU 121          2HD2      LEU 121 135.335   9.584   1.625
  335   3HD2  LEU 121          3HD2      LEU 121 136.730  10.609   1.961
  336    H    GLN 122           H        GLN 122 136.230  12.526  -3.146
  337    HA   GLN 122           HA       GLN 122 137.407  14.966  -2.312
  338   1HB   GLN 122          2HB       GLN 122 136.637  13.703  -4.847
  339   2HB   GLN 122          1HB       GLN 122 136.520  15.457  -4.865
  340   1HG   GLN 122          2HG       GLN 122 138.987  14.567  -3.652
  341   2HG   GLN 122          1HG       GLN 122 138.792  13.932  -5.286
  342   1HE2  GLN 122          1HE2      GLN 122 140.760  15.787  -4.488
  343   2HE2  GLN 122          2HE2      GLN 122 140.475  17.265  -5.336
  344    H    ALA 123           H        ALA 123 134.128  13.957  -2.871
  345    HA   ALA 123           HA       ALA 123 133.074  16.638  -3.017
  346   1HB   ALA 123          1HB       ALA 123 132.108  14.529  -4.116
  347   2HB   ALA 123          2HB       ALA 123 130.987  15.665  -3.366
  348   3HB   ALA 123          3HB       ALA 123 131.432  14.180  -2.525
  349    H    THR 124           H        THR 124 134.162  14.713  -0.498
  350    HA   THR 124           HA       THR 124 132.201  15.386   1.473
  351    HB   THR 124           HB       THR 124 133.695  14.371   3.062
  352    HG1  THR 124           HG1      THR 124 135.642  15.300   2.388
  353   1HG2  THR 124          1HG2      THR 124 132.605  12.735   1.690
  354   2HG2  THR 124          2HG2      THR 124 134.262  12.218   2.003
  355   3HG2  THR 124          3HG2      THR 124 133.833  12.909   0.438
  356    H    GLY 125           H        GLY 125 133.504  16.282   3.650
  357   1HA   GLY 125          2HA       GLY 125 134.420  18.959   2.805
  358   2HA   GLY 125          1HA       GLY 125 133.507  18.647   4.273
  359    H    GLU 126           H        GLU 126 135.528  16.124   4.186
  360    HA   GLU 126           HA       GLU 126 137.482  17.494   5.887
  361   1HB   GLU 126          2HB       GLU 126 137.040  14.519   5.606
  362   2HB   GLU 126          1HB       GLU 126 137.958  15.346   6.856
  363   1HG   GLU 126          2HG       GLU 126 135.611  16.515   7.264
  364   2HG   GLU 126          1HG       GLU 126 135.035  15.009   6.553
  365    H    THR 127           H        THR 127 139.691  16.178   5.859
  366    HA   THR 127           HA       THR 127 140.548  16.130   3.041
  367    HB   THR 127           HB       THR 127 142.876  16.440   4.203
  368    HG1  THR 127           HG1      THR 127 141.149  17.529   6.167
  369   1HG2  THR 127          1HG2      THR 127 142.492  18.294   3.006
  370   2HG2  THR 127          2HG2      THR 127 142.124  18.996   4.582
  371   3HG2  THR 127          3HG2      THR 127 140.817  18.424   3.543
  372    H    ILE 128           H        ILE 128 141.275  14.286   2.208
  373    HA   ILE 128           HA       ILE 128 142.238  12.183   4.024
  374    HB   ILE 128           HB       ILE 128 140.470  11.627   1.643
  375   1HG1  ILE 128          2HG1      ILE 128 138.969  10.883   3.763
  376   2HG1  ILE 128          1HG1      ILE 128 139.813  12.261   4.463
  377   1HG2  ILE 128          1HG2      ILE 128 141.725   9.717   2.020
  378   2HG2  ILE 128          2HG2      ILE 128 140.267   9.413   2.964
  379   3HG2  ILE 128          3HG2      ILE 128 141.741   9.949   3.768
  380   1HD1  ILE 128          1HD1      ILE 128 138.143  12.287   1.960
  381   2HD1  ILE 128          2HD1      ILE 128 139.011  13.669   2.628
  382   3HD1  ILE 128          3HD1      ILE 128 137.687  12.938   3.534
  383    H    THR 129           H        THR 129 144.126  11.327   3.423
  384    HA   THR 129           HA       THR 129 145.385  12.223   0.996
  385    HB   THR 129           HB       THR 129 146.698  12.044   3.041
  386    HG1  THR 129           HG1      THR 129 148.081  11.722   1.459
  387   1HG2  THR 129          1HG2      THR 129 145.386   9.592   3.403
  388   2HG2  THR 129          2HG2      THR 129 146.597  10.344   4.442
  389   3HG2  THR 129          3HG2      THR 129 147.094   9.224   3.174
  390    H    GLU 130           H        GLU 130 146.757  10.415  -0.172
  391    HA   GLU 130           HA       GLU 130 144.863   8.740  -1.483
  392   1HB   GLU 130          2HB       GLU 130 147.423   9.747  -2.043
  393   2HB   GLU 130          1HB       GLU 130 147.602   7.998  -2.031
  394   1HG   GLU 130          2HG       GLU 130 145.668   7.875  -3.610
  395   2HG   GLU 130          1HG       GLU 130 145.736   9.633  -3.726
  396    H    ASP 131           H        ASP 131 147.244   8.264   1.027
  397    HA   ASP 131           HA       ASP 131 147.378   5.450   0.937
  398   1HB   ASP 131          2HB       ASP 131 147.823   7.364   3.237
  399   2HB   ASP 131          1HB       ASP 131 148.222   5.649   3.280
  400    H    ASP 132           H        ASP 132 145.417   7.637   2.948
  401    HA   ASP 132           HA       ASP 132 144.066   5.752   4.454
  402   1HB   ASP 132          2HB       ASP 132 143.710   8.553   3.761
  403   2HB   ASP 132          1HB       ASP 132 142.166   7.731   3.962
  404    H    ILE 133           H        ILE 133 143.471   6.803   1.159
  405    HA   ILE 133           HA       ILE 133 140.943   5.510   0.892
  406    HB   ILE 133           HB       ILE 133 142.840   6.282  -1.325
  407   1HG1  ILE 133          2HG1      ILE 133 140.591   7.957  -0.204
  408   2HG1  ILE 133          1HG1      ILE 133 142.262   8.134   0.321
  409   1HG2  ILE 133          1HG2      ILE 133 140.865   4.756  -1.799
  410   2HG2  ILE 133          2HG2      ILE 133 140.981   6.228  -2.763
  411   3HG2  ILE 133          3HG2      ILE 133 139.841   6.142  -1.420
  412   1HD1  ILE 133          1HD1      ILE 133 142.918   8.686  -1.964
  413   2HD1  ILE 133          2HD1      ILE 133 141.689   9.792  -1.349
  414   3HD1  ILE 133          3HD1      ILE 133 141.240   8.518  -2.483
  415    H    GLU 134           H        GLU 134 144.275   4.622   0.121
  416    HA   GLU 134           HA       GLU 134 143.693   2.235  -1.257
  417   1HB   GLU 134          2HB       GLU 134 146.038   3.607  -0.274
  418   2HB   GLU 134          1HB       GLU 134 146.170   1.877   0.015
  419   1HG   GLU 134          2HG       GLU 134 145.615   1.521  -2.396
  420   2HG   GLU 134          1HG       GLU 134 145.741   3.266  -2.615
  421    H    GLU 135           H        GLU 135 144.435   2.868   2.154
  422    HA   GLU 135           HA       GLU 135 144.303   0.144   2.951
  423   1HB   GLU 135          2HB       GLU 135 144.261   1.034   5.244
  424   2HB   GLU 135          1HB       GLU 135 145.519   1.789   4.273
  425   1HG   GLU 135          2HG       GLU 135 144.552   3.824   4.350
  426   2HG   GLU 135          1HG       GLU 135 142.915   3.170   4.336
  427    H    LEU 136           H        LEU 136 141.940   2.680   2.577
  428    HA   LEU 136           HA       LEU 136 139.873   1.600   4.143
  429   1HB   LEU 136          2HB       LEU 136 140.225   3.812   2.451
  430   2HB   LEU 136          1HB       LEU 136 138.863   2.931   1.787
  431    HG   LEU 136           HG       LEU 136 138.102   2.953   4.347
  432   1HD1  LEU 136          1HD1      LEU 136 140.348   4.396   4.624
  433   2HD1  LEU 136          2HD1      LEU 136 138.922   4.610   5.640
  434   3HD1  LEU 136          3HD1      LEU 136 139.201   5.688   4.273
  435   1HD2  LEU 136          1HD2      LEU 136 137.692   5.469   2.793
  436   2HD2  LEU 136          2HD2      LEU 136 136.535   4.528   3.734
  437   3HD2  LEU 136          3HD2      LEU 136 137.079   3.939   2.163
  438    H    MET 137           H        MET 137 140.658   1.184   0.708
  439    HA   MET 137           HA       MET 137 138.475  -0.413   0.005
  440   1HB   MET 137          2HB       MET 137 140.100   0.643  -1.579
  441   2HB   MET 137          1HB       MET 137 141.268  -0.594  -1.135
  442   1HG   MET 137          2HG       MET 137 140.403  -2.009  -2.593
  443   2HG   MET 137          1HG       MET 137 138.802  -1.836  -1.877
  444   1HE   MET 137          1HE       MET 137 136.948  -1.448  -4.011
  445   2HE   MET 137          2HE       MET 137 136.835   0.310  -4.070
  446   3HE   MET 137          3HE       MET 137 137.055  -0.507  -2.524
  447    H    LYS 138           H        LYS 138 141.522  -1.222   1.544
  448    HA   LYS 138           HA       LYS 138 141.282  -4.041   1.276
  449   1HB   LYS 138          2HB       LYS 138 143.213  -2.251   2.230
  450   2HB   LYS 138          1HB       LYS 138 142.779  -3.233   3.624
  451   1HG   LYS 138          2HG       LYS 138 143.594  -4.361   0.956
  452   2HG   LYS 138          1HG       LYS 138 144.698  -4.101   2.308
  453   1HD   LYS 138          2HD       LYS 138 142.247  -5.602   2.948
  454   2HD   LYS 138          1HD       LYS 138 143.368  -6.414   1.853
  455   1HE   LYS 138          2HE       LYS 138 144.227  -7.110   3.846
  456   2HE   LYS 138          1HE       LYS 138 145.135  -5.611   3.650
  457   1HZ   LYS 138          1HZ       LYS 138 143.812  -4.518   5.196
  458   2HZ   LYS 138          2HZ       LYS 138 144.016  -6.050   5.883
  459   3HZ   LYS 138          3HZ       LYS 138 142.565  -5.660   5.106
  460    H    ASP 139           H        ASP 139 140.007  -1.709   3.513
  461    HA   ASP 139           HA       ASP 139 139.344  -3.569   5.575
  462   1HB   ASP 139          2HB       ASP 139 138.475  -0.741   4.995
  463   2HB   ASP 139          1HB       ASP 139 137.858  -1.655   6.369
  464    H    GLY 140           H        GLY 140 138.037  -3.029   2.518
  465   1HA   GLY 140          2HA       GLY 140 135.471  -4.218   3.373
  466   2HA   GLY 140          1HA       GLY 140 135.581  -3.039   2.078
  467    H    ASP 141           H        ASP 141 138.164  -4.387   1.196
  468    HA   ASP 141           HA       ASP 141 136.888  -6.254  -0.594
  469   1HB   ASP 141          2HB       ASP 141 138.997  -4.541  -0.875
  470   2HB   ASP 141          1HB       ASP 141 139.828  -6.077  -0.652
  471    H    LYS 142           H        LYS 142 136.272  -7.960   0.761
  472    HA   LYS 142           HA       LYS 142 138.171  -9.329   2.415
  473   1HB   LYS 142          2HB       LYS 142 135.413 -10.139   1.474
  474   2HB   LYS 142          1HB       LYS 142 136.360 -11.016   2.668
  475   1HG   LYS 142          2HG       LYS 142 135.436  -8.167   2.958
  476   2HG   LYS 142          1HG       LYS 142 134.644  -9.571   3.675
  477   1HD   LYS 142          2HD       LYS 142 137.476  -9.522   4.277
  478   2HD   LYS 142          1HD       LYS 142 136.677  -8.039   4.802
  479   1HE   LYS 142          2HE       LYS 142 136.559  -9.560   6.618
  480   2HE   LYS 142          1HE       LYS 142 134.946  -9.489   5.908
  481   1HZ   LYS 142          1HZ       LYS 142 135.511 -11.541   4.673
  482   2HZ   LYS 142          2HZ       LYS 142 135.492 -11.755   6.351
  483   3HZ   LYS 142          3HZ       LYS 142 136.968 -11.631   5.533
  484    H    ASN 143           H        ASN 143 136.976  -9.661  -0.849
  485    HA   ASN 143           HA       ASN 143 138.306 -12.221  -1.220
  486   1HB   ASN 143          2HB       ASN 143 137.416 -11.967  -3.587
  487   2HB   ASN 143          1HB       ASN 143 136.204 -12.081  -2.314
  488   1HD2  ASN 143          1HD2      ASN 143 134.733 -11.096  -3.776
  489   2HD2  ASN 143          2HD2      ASN 143 134.751  -9.388  -4.023
  490    H    ASN 144           H        ASN 144 139.226  -9.027  -1.279
  491    HA   ASN 144           HA       ASN 144 140.970  -7.864  -2.154
  492   1HB   ASN 144          2HB       ASN 144 141.942 -10.629  -1.740
  493   2HB   ASN 144          1HB       ASN 144 142.954  -9.599  -2.747
  494   1HD2  ASN 144          1HD2      ASN 144 143.404  -7.407  -1.812
  495   2HD2  ASN 144          2HD2      ASN 144 143.742  -7.334  -0.120
  496    H    ASP 145           H        ASP 145 138.963  -8.560  -4.067
  497    HA   ASP 145           HA       ASP 145 140.348  -9.385  -6.471
  498   1HB   ASP 145          2HB       ASP 145 137.532  -8.319  -6.215
  499   2HB   ASP 145          1HB       ASP 145 138.204  -9.241  -7.555
  500    H    GLY 146           H        GLY 146 140.427  -6.589  -4.823
  501   1HA   GLY 146          2HA       GLY 146 141.438  -4.613  -5.586
  502   2HA   GLY 146          1HA       GLY 146 141.038  -5.071  -7.233
  503    H    ARG 147           H        ARG 147 138.217  -5.631  -5.909
  504    HA   ARG 147           HA       ARG 147 137.325  -2.851  -5.707
  505   1HB   ARG 147          2HB       ARG 147 135.990  -4.854  -7.534
  506   2HB   ARG 147          1HB       ARG 147 135.539  -3.170  -7.304
  507   1HG   ARG 147          2HG       ARG 147 138.190  -3.031  -8.061
  508   2HG   ARG 147          1HG       ARG 147 137.538  -4.341  -9.047
  509   1HD   ARG 147          2HD       ARG 147 136.010  -1.787  -8.793
  510   2HD   ARG 147          1HD       ARG 147 137.405  -1.859  -9.870
  511    HE   ARG 147           HE       ARG 147 135.749  -4.054 -10.405
  512   1HH1  ARG 147          1HH1      ARG 147 135.732  -0.577 -10.711
  513   2HH1  ARG 147          2HH1      ARG 147 134.680  -0.579 -12.088
  514   1HH2  ARG 147          1HH2      ARG 147 134.367  -4.058 -12.215
  515   2HH2  ARG 147          2HH2      ARG 147 133.905  -2.555 -12.941
  516    H    ILE 148           H        ILE 148 135.194  -2.616  -4.783
  517    HA   ILE 148           HA       ILE 148 134.508  -4.886  -3.038
  518    HB   ILE 148           HB       ILE 148 133.884  -1.960  -2.611
  519   1HG1  ILE 148          2HG1      ILE 148 135.917  -3.662  -1.160
  520   2HG1  ILE 148          1HG1      ILE 148 136.327  -2.579  -2.487
  521   1HG2  ILE 148          1HG2      ILE 148 133.596  -4.318  -0.756
  522   2HG2  ILE 148          2HG2      ILE 148 132.274  -3.478  -1.569
  523   3HG2  ILE 148          3HG2      ILE 148 133.247  -2.637  -0.361
  524   1HD1  ILE 148          1HD1      ILE 148 136.769  -1.593  -0.291
  525   2HD1  ILE 148          2HD1      ILE 148 135.057  -1.740   0.107
  526   3HD1  ILE 148          3HD1      ILE 148 135.569  -0.678  -1.204
  527    H    ASP 149           H        ASP 149 132.628  -5.869  -3.308
  528    HA   ASP 149           HA       ASP 149 130.608  -4.600  -5.023
  529   1HB   ASP 149          2HB       ASP 149 129.670  -6.974  -5.132
  530   2HB   ASP 149          1HB       ASP 149 131.214  -6.700  -5.933
  531    H    TYR 150           H        TYR 150 128.298  -5.328  -4.463
  532    HA   TYR 150           HA       TYR 150 127.614  -4.246  -1.968
  533   1HB   TYR 150          2HB       TYR 150 126.044  -4.204  -3.808
  534   2HB   TYR 150          1HB       TYR 150 125.994  -5.962  -3.860
  535    HD1  TYR 150           HD1      TYR 150 125.759  -3.626  -0.957
  536    HD2  TYR 150           HD2      TYR 150 123.815  -6.565  -3.340
  537    HE1  TYR 150           HE1      TYR 150 123.849  -3.612   0.595
  538    HE2  TYR 150           HE2      TYR 150 121.899  -6.559  -1.796
  539    HH   TYR 150           HH       TYR 150 121.251  -4.226   0.318
  540    H    ASP 151           H        ASP 151 128.545  -7.439  -2.841
  541    HA   ASP 151           HA       ASP 151 127.259  -8.804  -0.694
  542   1HB   ASP 151          2HB       ASP 151 128.641  -9.558  -2.979
  543   2HB   ASP 151          1HB       ASP 151 129.699 -10.070  -1.669
  544    H    GLU 152           H        GLU 152 130.685  -7.988  -1.242
  545    HA   GLU 152           HA       GLU 152 131.404  -8.605   1.448
  546   1HB   GLU 152          2HB       GLU 152 133.606  -7.518   0.780
  547   2HB   GLU 152          1HB       GLU 152 133.112  -8.938  -0.130
  548   1HG   GLU 152          2HG       GLU 152 132.243  -7.439  -1.898
  549   2HG   GLU 152          1HG       GLU 152 132.895  -6.071  -1.002
  550    H    PHE 153           H        PHE 153 130.483  -5.660  -0.223
  551    HA   PHE 153           HA       PHE 153 131.483  -3.841   1.704
  552   1HB   PHE 153          2HB       PHE 153 130.371  -3.533  -0.743
  553   2HB   PHE 153          1HB       PHE 153 129.007  -3.080   0.270
  554    HD1  PHE 153           HD1      PHE 153 130.113  -1.626   2.452
  555    HD2  PHE 153           HD2      PHE 153 131.363  -1.665  -1.614
  556    HE1  PHE 153           HE1      PHE 153 131.076   0.620   2.733
  557    HE2  PHE 153           HE2      PHE 153 132.329   0.581  -1.341
  558    HZ   PHE 153           HZ       PHE 153 132.187   1.726   0.834
  559    H    LEU 154           H        LEU 154 128.528  -5.703   1.469
  560    HA   LEU 154           HA       LEU 154 126.881  -4.432   3.274
  561   1HB   LEU 154          2HB       LEU 154 126.739  -6.739   1.888
  562   2HB   LEU 154          1HB       LEU 154 127.016  -7.382   3.496
  563    HG   LEU 154           HG       LEU 154 124.617  -7.240   2.881
  564   1HD1  LEU 154          1HD1      LEU 154 124.746  -5.302   5.065
  565   2HD1  LEU 154          2HD1      LEU 154 125.805  -6.697   5.276
  566   3HD1  LEU 154          3HD1      LEU 154 124.076  -6.933   5.028
  567   1HD2  LEU 154          1HD2      LEU 154 125.204  -4.873   1.747
  568   2HD2  LEU 154          2HD2      LEU 154 124.571  -4.322   3.297
  569   3HD2  LEU 154          3HD2      LEU 154 123.580  -5.338   2.250
  570    H    GLU 155           H        GLU 155 129.741  -6.329   3.886
  571    HA   GLU 155           HA       GLU 155 129.280  -6.571   6.717
  572   1HB   GLU 155          2HB       GLU 155 131.563  -7.233   4.882
  573   2HB   GLU 155          1HB       GLU 155 131.788  -7.257   6.626
  574   1HG   GLU 155          2HG       GLU 155 129.478  -8.712   6.266
  575   2HG   GLU 155          1HG       GLU 155 130.475  -9.174   4.887
  576    H    PHE 156           H        PHE 156 130.780  -4.282   4.592
  577    HA   PHE 156           HA       PHE 156 132.555  -3.027   6.344
  578   1HB   PHE 156          2HB       PHE 156 131.776  -2.644   3.734
  579   2HB   PHE 156          1HB       PHE 156 131.159  -1.197   4.525
  580    HD1  PHE 156           HD1      PHE 156 133.146  -0.574   6.515
  581    HD2  PHE 156           HD2      PHE 156 133.672  -2.067   2.564
  582    HE1  PHE 156           HE1      PHE 156 135.391   0.429   6.439
  583    HE2  PHE 156           HE2      PHE 156 135.919  -1.067   2.483
  584    HZ   PHE 156           HZ       PHE 156 136.780   0.181   4.421
  585    H    MET 157           H        MET 157 129.127  -3.066   6.365
  586    HA   MET 157           HA       MET 157 129.096  -0.795   8.241
  587   1HB   MET 157          2HB       MET 157 127.461  -1.368   5.997
  588   2HB   MET 157          1HB       MET 157 126.455  -1.568   7.425
  589   1HG   MET 157          2HG       MET 157 126.151   0.624   7.376
  590   2HG   MET 157          1HG       MET 157 127.821   0.779   7.915
  591   1HE   MET 157          1HE       MET 157 129.947   1.225   5.956
  592   2HE   MET 157          2HE       MET 157 129.539   0.810   4.291
  593   3HE   MET 157          3HE       MET 157 129.326  -0.382   5.573
  594    H    LYS 158           H        LYS 158 129.669  -3.753   8.650
  595    HA   LYS 158           HA       LYS 158 127.466  -4.733  10.201
  596   1HB   LYS 158          2HB       LYS 158 129.509  -5.951   8.925
  597   2HB   LYS 158          1HB       LYS 158 130.129  -5.959  10.569
  598   1HG   LYS 158          2HG       LYS 158 127.342  -6.813  10.343
  599   2HG   LYS 158          1HG       LYS 158 128.491  -7.848   9.493
  600   1HD   LYS 158          2HD       LYS 158 129.824  -8.007  11.571
  601   2HD   LYS 158          1HD       LYS 158 128.593  -7.055  12.403
  602   1HE   LYS 158          2HE       LYS 158 127.080  -9.007  11.274
  603   2HE   LYS 158          1HE       LYS 158 128.578  -9.879  11.595
  604   1HZ   LYS 158          1HZ       LYS 158 128.277  -9.756  13.807
  605   2HZ   LYS 158          2HZ       LYS 158 126.648  -9.566  13.393
  606   3HZ   LYS 158          3HZ       LYS 158 127.591  -8.209  13.758
  607    H    GLY 159           H        GLY 159 129.109  -2.181  10.989
  608   1HA   GLY 159          2HA       GLY 159 128.754  -1.474  13.327
  609   2HA   GLY 159          1HA       GLY 159 129.449  -3.010  13.805
  610    H    VAL 160           H        VAL 160 131.320  -2.217  11.286
  611    HA   VAL 160           HA       VAL 160 133.625  -1.720  12.653
  612    HB   VAL 160           HB       VAL 160 134.545  -0.731  10.599
  613   1HG1  VAL 160          1HG1      VAL 160 134.104  -2.629   9.108
  614   2HG1  VAL 160          2HG1      VAL 160 132.739  -3.098  10.120
  615   3HG1  VAL 160          3HG1      VAL 160 134.378  -3.148  10.771
  616   1HG2  VAL 160          1HG2      VAL 160 133.065  -0.493   8.621
  617   2HG2  VAL 160          2HG2      VAL 160 132.708   0.661   9.906
  618   3HG2  VAL 160          3HG2      VAL 160 131.674  -0.749   9.675
  619    H    GLU 161           H        GLU 161 131.307   0.686  11.483
  620    HA   GLU 161           HA       GLU 161 132.648   2.687  13.180
  621   1HB   GLU 161          2HB       GLU 161 131.182   3.277  10.607
  622   2HB   GLU 161          1HB       GLU 161 132.102   4.409  11.587
  623   1HG   GLU 161          2HG       GLU 161 133.914   2.401  11.000
  624   2HG   GLU 161          1HG       GLU 161 132.992   2.603   9.512