*HEADER    TRANSPORT PROTEIN                       21-NOV-05   2F3J              
*TITLE     THE SOLUTION STRUCTURE OF THE REF2-I MRNA EXPORT FACTOR               
*TITLE    2 (RESIDUES 1-155).                                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RNA AND EXPORT FACTOR BINDING PROTEIN 2;                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RRM DOMAIN (RESIDUES 1 - 155);                             
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   4 GENE: REFBP2, REF2;                                                  
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)-RP;                              
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET24B                                    
*KEYWDS    RRM DOMAIN; RBD DOMAIN.                                               
*EXPDTA    NMR, 14 STRUCTURES                                                    
*AUTHOR    A.P.GOLOVANOV, G.M.HAUTBERGUE, S.A.WILSON, L.Y.LIAN                   
*REVDAT   1   31-OCT-06 2F3J    0                                                


; NMR constraints data for REF2-I(1-155), 
; entry ID RCSB035407, PDB id 2F3J
;Authors: 
'Golovanov, A.P.'
'Hautbergue, G.M.'
'Wilson, S.A.'
'Lian, L.Y.'
;
; Format of constraints is that of ARIA/CNS which were used for 
; NMR structure calculation.
;
; The polypeptide sequence of REF2-I(1-155) used in the study contains
; additional 14-residue N-terminal T7-tag, and C-terminal 
; LEHHHHHH tag. The N-terminal tag was omitted in PDB
; deposition as it was unstructured, however, it was
; partially assigned and was included during NMR structure
; calculations. Therefore note that the numbering
; of REF2-I amino acid residues in the PDB file (PDB id 2F3J, RCSB035407)
; differs from the one used here.
;
; The actual sequence used for the structure calculation:
MASMTGGQQMGRDPMADKMDMSLDDIIKLNRNQRRVNRGG
GPRRNRPAIARGGRNRPAPYSRPKPLPDKWQHDLFDSGCG
GGEGVETGAKLLVSNLDFGVSDADIQELFAEFGTLKKAAV
DYDRSGRSLGTADVHFERRADALKAMKQYKGVPLDGRPMD
IQLVASQIDLEH
;

1   1   MET     2   2   ALA     3   3   SER     4   4   MET     5   5   THR
6   6   GLY     7   7   GLY     8   8   GLN     9   9   GLN     10  10  MET
11  11  GLY     12  12  ARG     13  13  ASP     14  14  PRO     15  15  MET
16  16  ALA     17  17  ASP     18  18  LYS     19  19  MET     20  20  ASP
21  21  MET     22  22  SER     23  23  LEU     24  24  ASP     25  25  ASP
26  26  ILE     27  27  ILE     28  28  LYS     29  29  LEU     30  30  ASN
31  31  ARG     32  32  ASN     33  33  GLN     34  34  ARG     35  35  ARG
36  36  VAL     37  37  ASN     38  38  ARG     39  39  GLY     40  40  GLY
41  41  GLY     42  42  PRO     43  43  ARG     44  44  ARG     45  45  ASN
46  46  ARG     47  47  PRO     48  48  ALA     49  49  ILE     50  50  ALA
51  51  ARG     52  52  GLY     53  53  GLY     54  54  ARG     55  55  ASN
56  56  ARG     57  57  PRO     58  58  ALA     59  59  PRO     60  60  TYR
61  61  SER     62  62  ARG     63  63  PRO     64  64  LYS     65  65  PRO
66  66  LEU     67  67  PRO     68  68  ASP     69  69  LYS     70  70  TRP
71  71  GLN     72  72  HIS     73  73  ASP     74  74  LEU     75  75  PHE
76  76  ASP     77  77  SER     78  78  GLY     79  79  CYS     80  80  GLY
81  81  GLY     82  82  GLY     83  83  GLU     84  84  GLY     85  85  VAL
86  86  GLU     87  87  THR     88  88  GLY     89  89  ALA     90  90  LYS
91  91  LEU     92  92  LEU     93  93  VAL     94  94  SER     95  95  ASN
96  96  LEU     97  97  ASP     98  98  PHE     99  99  GLY     100 100 VAL
101 101 SER     102 102 ASP     103 103 ALA     104 104 ASP     105 105 ILE
106 106 GLN     107 107 GLU     108 108 LEU     109 109 PHE     110 110 ALA
111 111 GLU     112 112 PHE     113 113 GLY     114 114 THR     115 115 LEU
116 116 LYS     117 117 LYS     118 118 ALA     119 119 ALA     120 120 VAL
121 121 ASP     122 122 TYR     123 123 ASP     124 124 ARG     125 125 SER
126 126 GLY     127 127 ARG     128 128 SER     129 129 LEU     130 130 GLY
131 131 THR     132 132 ALA     133 133 ASP     134 134 VAL     135 135 HIS
136 136 PHE     137 137 GLU     138 138 ARG     139 139 ARG     140 140 ALA
141 141 ASP     142 142 ALA     143 143 LEU     144 144 LYS     145 145 ALA
146 146 MET     147 147 LYS     148 148 GLN     149 149 TYR     150 150 LYS
151 151 GLY     152 152 VAL     153 153 PRO     154 154 LEU     155 155 ASP
156 156 GLY     157 157 ARG     158 158 PRO     159 159 MET     160 160 ASP
161 161 ILE     162 162 GLN     163 163 LEU     164 164 VAL     165 165 ALA
166 166 SER     167 167 GLN     168 168 ILE     169 169 ASP     170 170 LEU
171 171 GLU     172 172 HIS



! Dihedral angle restraints:
! CSI restraints, converted by ARIA
! Phi:

! dihedral angle file generated by Csi2Aria.py



! CSI derived phi restraint:
assign (resid  88 and name C)
       (resid  89 and name N)
       (resid  89 and name CA)
       (resid  89 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  89 and name C)
       (resid  90 and name N)
       (resid  90 and name CA)
       (resid  90 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  90 and name C)
       (resid  91 and name N)
       (resid  91 and name CA)
       (resid  91 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  91 and name C)
       (resid  92 and name N)
       (resid  92 and name CA)
       (resid  92 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  92 and name C)
       (resid  93 and name N)
       (resid  93 and name CA)
       (resid  93 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  93 and name C)
       (resid  94 and name N)
       (resid  94 and name CA)
       (resid  94 and name C)
       1.0 -135  30 2



! CSI derived phi restraint:
 assign (resid 101 and name C)
       (resid 102 and name N)
       (resid 102 and name CA)
       (resid 102 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
 assign (resid 102 and name C)
       (resid 103 and name N)
       (resid 103 and name CA)
       (resid 103 and name C)
       1.0 -65  30 2


! CSI derived phi restraint:
 assign (resid 103 and name C)
       (resid 104 and name N)
       (resid 104 and name CA)
       (resid 104 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
 assign (resid 104 and name C)
       (resid 105 and name N)
       (resid 105 and name CA)
       (resid 105 and name C)
       1.0 -65  30 2




! CSI derived phi restraint:
 assign (resid 105 and name C)
       (resid 106 and name N)
       (resid 106 and name CA)
       (resid 106 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
 assign (resid 106 and name C)
       (resid 107 and name N)
       (resid 107 and name CA)
       (resid 107 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 107 and name C)
       (resid 108 and name N)
       (resid 108 and name CA)
       (resid 108 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 108 and name C)
       (resid 109 and name N)
       (resid 109 and name CA)
       (resid 109 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 109 and name C)
       (resid 110 and name N)
       (resid 110 and name CA)
       (resid 110 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 110 and name C)
       (resid 111 and name N)
       (resid 111 and name CA)
       (resid 111 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 111 and name C)
       (resid 112 and name N)
       (resid 112 and name CA)
       (resid 112 and name C)
       1.0 -65  30 2


! CSI derived phi restraint:
assign (resid 116 and name C)
       (resid 117 and name N)
       (resid 117 and name CA)
       (resid 117 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 117 and name C)
       (resid 118 and name N)
       (resid 118 and name CA)
       (resid 118 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 118 and name C)
       (resid 119 and name N)
       (resid 119 and name CA)
       (resid 119 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 119 and name C)
       (resid 120 and name N)
       (resid 120 and name CA)
       (resid 120 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 120 and name C)
       (resid 121 and name N)
       (resid 121 and name CA)
       (resid 121 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 131 and name C)
       (resid 132 and name N)
       (resid 132 and name CA)
       (resid 132 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 132 and name C)
       (resid 133 and name N)
       (resid 133 and name CA)
       (resid 133 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 133 and name C)
       (resid 134 and name N)
       (resid 134 and name CA)
       (resid 134 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 134 and name C)
       (resid 135 and name N)
       (resid 135 and name CA)
       (resid 135 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 135 and name C)
       (resid 136 and name N)
       (resid 136 and name CA)
       (resid 136 and name C)
       1.0 -135  30 2




! CSI derived phi restraint:
 assign (resid 138 and name C)
        (resid 139 and name N)
        (resid 139 and name CA)
        (resid 139 and name C)
        1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 139 and name C)
       (resid 140 and name N)
       (resid 140 and name CA)
       (resid 140 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 140 and name C)
       (resid 141 and name N)
       (resid 141 and name CA)
       (resid 141 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 141 and name C)
       (resid 142 and name N)
       (resid 142 and name CA)
       (resid 142 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 142 and name C)
       (resid 143 and name N)
       (resid 143 and name CA)
       (resid 143 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 143 and name C)
       (resid 144 and name N)
       (resid 144 and name CA)
       (resid 144 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 144 and name C)
       (resid 145 and name N)
       (resid 145 and name CA)
       (resid 145 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 145 and name C)
       (resid 146 and name N)
       (resid 146 and name CA)
       (resid 146 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 146 and name C)
       (resid 147 and name N)
       (resid 147 and name CA)
       (resid 147 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 147 and name C)
       (resid 148 and name N)
       (resid 148 and name CA)
       (resid 148 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 148 and name C)
       (resid 149 and name N)
       (resid 149 and name CA)
       (resid 149 and name C)
       1.0 -65  30 2


! CSI derived phi restraint:
assign (resid 159 and name C)
       (resid 160 and name N)
       (resid 160 and name CA)
       (resid 160 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 160 and name C)
       (resid 161 and name N)
       (resid 161 and name CA)
       (resid 161 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 161 and name C)
       (resid 162 and name N)
       (resid 162 and name CA)
       (resid 162 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 162 and name C)
       (resid 163 and name N)
       (resid 163 and name CA)
       (resid 163 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 163 and name C)
       (resid 164 and name N)
       (resid 164 and name CA)
       (resid 164 and name C)
       1.0 -135  30 2



! Psi:

! dihedral angle file generated by Csi2Aria.py



! CSI derived psi restraint:
assign (resid  89 and name N)
       (resid  89 and name CA)
       (resid  89 and name C)
       (resid  90 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  90 and name N)
       (resid  90 and name CA)
       (resid  90 and name C)
       (resid  91 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  91 and name N)
       (resid  91 and name CA)
       (resid  91 and name C)
       (resid  92 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  92 and name N)
       (resid  92 and name CA)
       (resid  92 and name C)
       (resid  93 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  93 and name N)
       (resid  93 and name CA)
       (resid  93 and name C)
       (resid  94 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  94 and name N)
       (resid  94 and name CA)
       (resid  94 and name C)
       (resid  95 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
 assign (resid 102 and name N)
        (resid 102 and name CA)
        (resid 102 and name C)
        (resid 103 and name N)
        1.0 -35  30 2

! CSI derived psi restraint:
 assign (resid 103 and name N)
        (resid 103 and name CA)
        (resid 103 and name C)
        (resid 104 and name N)
        1.0 -35  30 2


! CSI derived psi restraint:
 assign (resid 104 and name N)
        (resid 104 and name CA)
        (resid 104 and name C)
        (resid 105 and name N)
        1.0 -35  30 2

! CSI derived psi restraint:
 assign (resid 105 and name N)
        (resid 105 and name CA)
        (resid 105 and name C)
        (resid 106 and name N)
        1.0 -35  30 2



! CSI derived psi restraint:
 assign (resid 106 and name N)
        (resid 106 and name CA)
        (resid 106 and name C)
        (resid 107 and name N)
        1.0 -35  30 2

! CSI derived psi restraint:
 assign (resid 107 and name N)
        (resid 107 and name CA)
        (resid 107 and name C)
        (resid 108 and name N)
        1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 108 and name N)
       (resid 108 and name CA)
       (resid 108 and name C)
       (resid 109 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 109 and name N)
       (resid 109 and name CA)
       (resid 109 and name C)
       (resid 110 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 110 and name N)
       (resid 110 and name CA)
       (resid 110 and name C)
       (resid 111 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 111 and name N)
       (resid 111 and name CA)
       (resid 111 and name C)
       (resid 112 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 112 and name N)
       (resid 112 and name CA)
       (resid 112 and name C)
      (resid 113 and name N)
       1.0 -35  30 2



! CSI derived psi restraint:
assign (resid 117 and name N)
       (resid 117 and name CA)
       (resid 117 and name C)
       (resid 118 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 118 and name N)
       (resid 118 and name CA)
       (resid 118 and name C)
       (resid 119 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 119 and name N)
       (resid 119 and name CA)
       (resid 119 and name C)
       (resid 120 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 120 and name N)
       (resid 120 and name CA)
       (resid 120 and name C)
       (resid 121 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 121 and name N)
       (resid 121 and name CA)
       (resid 121 and name C)
       (resid 122 and name N)
       1.0 135  30 2


! CSI derived psi restraint:
assign (resid 131 and name N)
       (resid 131 and name CA)
       (resid 131 and name C)
       (resid 132 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 132 and name N)
       (resid 132 and name CA)
       (resid 132 and name C)
       (resid 133 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 133 and name N)
       (resid 133 and name CA)
       (resid 133 and name C)
       (resid 134 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 134 and name N)
       (resid 134 and name CA)
       (resid 134 and name C)
       (resid 135 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 135 and name N)
       (resid 135 and name CA)
       (resid 135 and name C)
       (resid 136 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 136 and name N)
       (resid 136 and name CA)
       (resid 136 and name C)
       (resid 137 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 139 and name N)
       (resid 139 and name CA)
       (resid 139 and name C)
       (resid 140 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 140 and name N)
       (resid 140 and name CA)
       (resid 140 and name C)
       (resid 141 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 141 and name N)
       (resid 141 and name CA)
       (resid 141 and name C)
       (resid 142 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 142 and name N)
       (resid 142 and name CA)
       (resid 142 and name C)
       (resid 143 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 143 and name N)
       (resid 143 and name CA)
       (resid 143 and name C)
       (resid 144 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 144 and name N)
       (resid 144 and name CA)
       (resid 144 and name C)
       (resid 145 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 145 and name N)
       (resid 145 and name CA)
       (resid 145 and name C)
       (resid 146 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 146 and name N)
       (resid 146 and name CA)
       (resid 146 and name C)
       (resid 147 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 147 and name N)
       (resid 147 and name CA)
       (resid 147 and name C)
       (resid 148 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 148 and name N)
       (resid 148 and name CA)
       (resid 148 and name C)
       (resid 149 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 149 and name N)
       (resid 149 and name CA)
       (resid 149 and name C)
       (resid 150 and name N)
       1.0 -35  30 2


! CSI derived psi restraint:
assign (resid 160 and name N)
       (resid 160 and name CA)
       (resid 160 and name C)
       (resid 161 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 161 and name N)
       (resid 161 and name CA)
       (resid 161 and name C)
       (resid 162 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 162 and name N)
       (resid 162 and name CA)
       (resid 162 and name C)
       (resid 163 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 163 and name N)
       (resid 163 and name CA)
       (resid 163 and name C)
       (resid 164 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 164 and name N)
       (resid 164 and name CA)
       (resid 164 and name C)
       (resid 165 and name N)
       1.0 135  30 2

! Dihedral angle restraints generated by TALOS for additional loop regions
!
! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! talos_RefNM_pred_loops.tab
!
! settings: min phiError=None, min psiError=None, errorFactor=2.0
!

! Talos derived phi restraint:
assign (resid  11 and name C)
       (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       1.0 -95  74 2

! Talos derived phi restraint:
assign (resid  12 and name C)
       (resid  13 and name N)
       (resid  13 and name CA)
       (resid  13 and name C)
       1.0 -82  31 2

! Talos derived phi restraint:
assign (resid  14 and name C)
       (resid  15 and name N)
       (resid  15 and name CA)
       (resid  15 and name C)
       1.0 -78  35 2

! Talos derived phi restraint:
assign (resid  22 and name C)
       (resid  23 and name N)
       (resid  23 and name CA)
       (resid  23 and name C)
       1.0 -66  26 2

! Talos derived phi restraint:
assign (resid  23 and name C)
       (resid  24 and name N)
       (resid  24 and name CA)
       (resid  24 and name C)
       1.0 -67  20 2

! Talos derived phi restraint:
assign (resid  24 and name C)
       (resid  25 and name N)
       (resid  25 and name CA)
       (resid  25 and name C)
       1.0 -67  24 2

! Talos derived phi restraint:
assign (resid  25 and name C)
       (resid  26 and name N)
       (resid  26 and name CA)
       (resid  26 and name C)
       1.0 -66  13 2

! Talos derived phi restraint:
assign (resid  26 and name C)
       (resid  27 and name N)
       (resid  27 and name CA)
       (resid  27 and name C)
       1.0 -64  14 2

! Talos derived phi restraint:
assign (resid  27 and name C)
       (resid  28 and name N)
       (resid  28 and name CA)
       (resid  28 and name C)
       1.0 -63  23 2

! Talos derived phi restraint:
assign (resid  28 and name C)
       (resid  29 and name N)
       (resid  29 and name CA)
       (resid  29 and name C)
       1.0 -68  27 2

! Talos derived phi restraint:
assign (resid  30 and name C)
       (resid  31 and name N)
       (resid  31 and name CA)
       (resid  31 and name C)
       1.0 -65  23 2

! Talos derived phi restraint:
assign (resid  61 and name C)
       (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       1.0 -95  63 2

! Talos derived phi restraint:
assign (resid  62 and name C)
       (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
       1.0 -63  26 2

! Talos derived phi restraint:
assign (resid  63 and name C)
       (resid  64 and name N)
       (resid  64 and name CA)
       (resid  64 and name C)
       1.0 -86  36 2

! Talos derived phi restraint:
assign (resid  99 and name C)
       (resid 100 and name N)
       (resid 100 and name CA)
       (resid 100 and name C)
       1.0 -71  23 2

! Talos derived phi restraint:
assign (resid 100 and name C)
       (resid 101 and name N)
       (resid 101 and name CA)
       (resid 101 and name C)
       1.0 -99  39 2

! Talos derived phi restraint:
assign (resid 113 and name C)
       (resid 114 and name N)
       (resid 114 and name CA)
       (resid 114 and name C)
       1.0 -83  58 2

! Talos derived phi restraint:
assign (resid 121 and name C)
       (resid 122 and name N)
       (resid 122 and name CA)
       (resid 122 and name C)
       1.0 -114  41 2

! Talos derived phi restraint:
assign (resid 122 and name C)
       (resid 123 and name N)
       (resid 123 and name CA)
       (resid 123 and name C)
       1.0 -87  37 2

! Talos derived phi restraint:
assign (resid 123 and name C)
       (resid 124 and name N)
       (resid 124 and name CA)
       (resid 124 and name C)
       1.0 -57   8 2

! Talos derived phi restraint:
assign (resid 124 and name C)
       (resid 125 and name N)
       (resid 125 and name CA)
       (resid 125 and name C)
       1.0 -94  32 2

! Talos derived phi restraint:
assign (resid 129 and name C)
       (resid 130 and name N)
       (resid 130 and name CA)
       (resid 130 and name C)
       1.0  86  17 2

! Talos derived phi restraint:
assign (resid 136 and name C)
       (resid 137 and name N)
       (resid 137 and name CA)
       (resid 137 and name C)
       1.0 -62  16 2

! Talos derived phi restraint:
assign (resid 149 and name C)
       (resid 150 and name N)
       (resid 150 and name CA)
       (resid 150 and name C)
       1.0 -62  31 2

! Talos derived phi restraint:
assign (resid 153 and name C)
       (resid 154 and name N)
       (resid 154 and name CA)
       (resid 154 and name C)
       1.0 -118  50 2

! Talos derived phi restraint:
assign (resid 156 and name C)
       (resid 157 and name N)
       (resid 157 and name CA)
       (resid 157 and name C)
       1.0 -100  46 2

! Talos derived phi restraint:
assign (resid 157 and name C)
       (resid 158 and name N)
       (resid 158 and name CA)
       (resid 158 and name C)
       1.0 -64  16 2

! Talos derived phi restraint:
assign (resid 169 and name C)
       (resid 170 and name N)
       (resid 170 and name CA)
       (resid 170 and name C)
       1.0 -69  33 2

! Talos derived psi restraint:
assign (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       (resid  13 and name N)
       1.0 136  58 2

! Talos derived psi restraint:
assign (resid  13 and name N)
       (resid  13 and name CA)
       (resid  13 and name C)
       (resid  14 and name N)
       1.0 137  63 2

! Talos derived psi restraint:
assign (resid  15 and name N)
       (resid  15 and name CA)
       (resid  15 and name C)
       (resid  16 and name N)
       1.0 -13  56 2

! Talos derived psi restraint:
assign (resid  23 and name N)
       (resid  23 and name CA)
       (resid  23 and name C)
       (resid  24 and name N)
       1.0 -33  43 2

! Talos derived psi restraint:
assign (resid  24 and name N)
       (resid  24 and name CA)
       (resid  24 and name C)
       (resid  25 and name N)
       1.0 -39  21 2

! Talos derived psi restraint:
assign (resid  25 and name N)
       (resid  25 and name CA)
       (resid  25 and name C)
       (resid  26 and name N)
       1.0 -45  18 2

! Talos derived psi restraint:
assign (resid  26 and name N)
       (resid  26 and name CA)
       (resid  26 and name C)
       (resid  27 and name N)
       1.0 -33  34 2

! Talos derived psi restraint:
assign (resid  27 and name N)
       (resid  27 and name CA)
       (resid  27 and name C)
       (resid  28 and name N)
       1.0 -39  19 2

! Talos derived psi restraint:
assign (resid  28 and name N)
       (resid  28 and name CA)
       (resid  28 and name C)
       (resid  29 and name N)
       1.0 -37  21 2

! Talos derived psi restraint:
assign (resid  29 and name N)
       (resid  29 and name CA)
       (resid  29 and name C)
       (resid  30 and name N)
       1.0 -31  49 2

! Talos derived psi restraint:
assign (resid  31 and name N)
       (resid  31 and name CA)
       (resid  31 and name C)
       (resid  32 and name N)
       1.0 -34  47 2

! Talos derived psi restraint:
assign (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       (resid  63 and name N)
       1.0 132  37 2

! Talos derived psi restraint:
assign (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
       (resid  64 and name N)
       1.0 140  26 2

! Talos derived psi restraint:
assign (resid  64 and name N)
       (resid  64 and name CA)
       (resid  64 and name C)
       (resid  65 and name N)
       1.0 139  41 2

! Talos derived psi restraint:
assign (resid 100 and name N)
       (resid 100 and name CA)
       (resid 100 and name C)
       (resid 101 and name N)
       1.0 132  19 2

! Talos derived psi restraint:
assign (resid 101 and name N)
       (resid 101 and name CA)
       (resid 101 and name C)
       (resid 102 and name N)
       1.0 172  25 2

! Talos derived psi restraint:
assign (resid 114 and name N)
       (resid 114 and name CA)
       (resid 114 and name C)
       (resid 115 and name N)
       1.0 133  28 2

! Talos derived psi restraint:
assign (resid 122 and name N)
       (resid 122 and name CA)
       (resid 122 and name C)
       (resid 123 and name N)
       1.0 145  30 2

! Talos derived psi restraint:
assign (resid 123 and name N)
       (resid 123 and name CA)
       (resid 123 and name C)
       (resid 124 and name N)
       1.0 164  28 2

! Talos derived psi restraint:
assign (resid 124 and name N)
       (resid 124 and name CA)
       (resid 124 and name C)
       (resid 125 and name N)
       1.0 -33  27 2

! Talos derived psi restraint:
assign (resid 125 and name N)
       (resid 125 and name CA)
       (resid 125 and name C)
       (resid 126 and name N)
       1.0  -1  32 2

! Talos derived psi restraint:
assign (resid 137 and name N)
       (resid 137 and name CA)
       (resid 137 and name C)
       (resid 138 and name N)
       1.0 -18  26 2

! Talos derived psi restraint:
assign (resid 150 and name N)
       (resid 150 and name CA)
       (resid 150 and name C)
       (resid 151 and name N)
       1.0 135  19 2

! Talos derived psi restraint:
assign (resid 154 and name N)
       (resid 154 and name CA)
       (resid 154 and name C)
       (resid 155 and name N)
       1.0 126  33 2

! Talos derived psi restraint:
assign (resid 157 and name N)
       (resid 157 and name CA)
       (resid 157 and name C)
       (resid 158 and name N)
       1.0 132  22 2

! Talos derived psi restraint:
assign (resid 158 and name N)
       (resid 158 and name CA)
       (resid 158 and name C)
       (resid 159 and name N)
       1.0 142  14 2

! Talos derived psi restraint:
assign (resid 170 and name N)
       (resid 170 and name CA)
       (resid 170 and name C)
       (resid 171 and name N)
       1.0 -27  59 2

! H-bond restraints used for the final round of structure calculations
! hbonds for betta-structure regions
assign (resid  164 and name HN) (resid  90 and name O) 2.2 1.0 0.0
assign (resid  164 and name N) (resid  90 and name O) 3.2 1.0 0.0

assign (resid  162 and name HN) (resid  92 and name O) 2.2 1.0 0.0
assign (resid  162 and name N) (resid  92 and name O) 3.2 1.0 0.0

assign (resid  160 and name HN) (resid  94 and name O) 2.2 1.0 0.0
assign (resid  160 and name N) (resid  94 and name O) 3.2 1.0 0.0


assign (resid  90 and name HN) (resid  164 and name O) 2.2 1.0 0.0
assign (resid  90 and name N) (resid  164 and name O) 3.2 1.0 0.0

assign (resid  92 and name HN) (resid  162 and name O) 2.2 1.0 0.0
assign (resid  92 and name N) (resid  162 and name O) 3.2 1.0 0.0

assign (resid  94 and name HN) (resid  160 and name O) 2.2 1.0 0.0
assign (resid  94 and name N) (resid  160 and name O) 3.2 1.0 0.0



assign (resid  89 and name HN) (resid  136 and name O) 2.2 1.0 0.0
assign (resid  89 and name N) (resid  136 and name O) 3.2 1.0 0.0

assign (resid  91 and name HN) (resid  134 and name O) 2.2 1.0 0.0
assign (resid  91 and name N) (resid  134 and name O) 3.2 1.0 0.0

assign (resid  93 and name HN) (resid  132 and name O) 2.2 1.0 0.0
assign (resid  93 and name N) (resid  132 and name O) 3.2 1.0 0.0


assign (resid  136 and name HN) (resid  89 and name O) 2.2 1.0 0.0
assign (resid  136 and name N) (resid  89 and name O) 3.2 1.0 0.0

assign (resid  134 and name HN) (resid  91 and name O) 2.2 1.0 0.0
assign (resid  134 and name N) (resid  91 and name O) 3.2 1.0 0.0

assign (resid  132 and name HN) (resid  93 and name O) 2.2 1.0 0.0
assign (resid  132 and name N) (resid  93 and name O) 3.2 1.0 0.0




assign (resid  135 and name HN) (resid  117 and name O) 2.2 1.0 0.0
assign (resid  135 and name N) (resid  117 and name O) 3.2 1.0 0.0

assign (resid  133 and name HN) (resid  119 and name O) 2.2 1.0 0.0
assign (resid  133 and name N) (resid  119 and name O) 3.2 1.0 0.0

assign (resid  117 and name HN) (resid  135 and name O) 2.2 1.0 0.0
assign (resid  117 and name N) (resid  135 and name O) 3.2 1.0 0.0

assign (resid  119 and name HN) (resid  133 and name O) 2.2 1.0 0.0
assign (resid  119 and name N) (resid  133 and name O) 3.2 1.0 0.0

assign (resid  121 and name HN) (resid  131 and name O) 2.2 1.0 0.0
assign (resid  121 and name N) (resid  131 and name O) 3.2 1.0 0.0



! CSI derived hbond restraint:
assign (resid  27 and name N) (resid  23 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  27 and name HN) (resid  23 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  28 and name N) (resid  24 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  28 and name HN) (resid  24 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  29 and name N) (resid  25 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  29 and name HN) (resid  25 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  30 and name N) (resid  26 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  30 and name HN) (resid  26 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  31 and name N) (resid  27 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  31 and name HN) (resid  27 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  32 and name N) (resid  28 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  32 and name HN) (resid  28 and name O) 2.2 1.0 0.0 



! CSI derived hbond restraint: added manually
assign (resid 107 and name N) (resid 103 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint: added manually
assign (resid 107 and name HN) (resid 103 and name O) 2.2 1.0 0.0 


! CSI derived hbond restraint: added manually
assign (resid 108 and name N) (resid 104 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint: added manually
assign (resid 108 and name HN) (resid 104 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint: added manually
assign (resid 109 and name N) (resid 105 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint: added manually
assign (resid 109 and name HN) (resid 105 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint: added manually
assign (resid 110 and name N) (resid 106 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint: added manually
assign (resid 110 and name HN) (resid 106 and name O) 2.2 1.0 0.0 



! CSI derived hbond restraint:
assign (resid 111 and name N) (resid 107 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 111 and name HN) (resid 107 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 112 and name N) (resid 108 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 112 and name HN) (resid 108 and name O) 2.2 1.0 0.0 



! Temperature dependence derived hbond restraint:
assign (resid 143 and name N) (resid 139 and name O) 3.2 1.0 0.0 

! Temperature dependence derived hbond restraint:
assign (resid 143 and name HN) (resid 139 and name O) 2.2 1.0 0.0 

! Temperature dependence derived hbond restraints for loop L5:
assign (resid 152 and name N) (resid 149 and name O) 3.2 1.0 0.0 
assign (resid 152 and name HN) (resid 149 and name O) 2.2 1.0 0.0 
assign (resid 154 and name N) (resid 157 and name O) 3.2 1.0 0.0 
assign (resid 154 and name HN) (resid 157 and name O) 2.2 1.0 0.0 
assign (resid 157 and name N) (resid 155 and name O) 3.2 1.0 0.0 
assign (resid 157 and name HN) (resid 155 and name O) 2.2 1.0 0.0 
assign (resid 159 and name N) (resid 152 and name O) 3.2 1.0 0.0 
assign (resid 159 and name HN) (resid 152 and name O) 2.2 1.0 0.0 



! CSI derived hbond restraint:
assign (resid 144 and name N) (resid 140 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 144 and name HN) (resid 140 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 145 and name N) (resid 141 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 145 and name HN) (resid 141 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 146 and name N) (resid 142 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 146 and name HN) (resid 142 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 147 and name N) (resid 143 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 147 and name HN) (resid 143 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 148 and name N) (resid 144 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 148 and name HN) (resid 144 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 149 and name N) (resid 145 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 149 and name HN) (resid 145 and name O) 2.2 1.0 0.0 


! Residual Dipolar Coupling restraints:
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  89  and name N   )
       ( resid  89  and name HN  )  
-0.20   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  90  and name N   )
       ( resid  90  and name HN  )  
-6.10   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  91  and name N   )
       ( resid  91  and name HN  )  
6.50    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  92  and name N   )
       ( resid  92  and name HN  )  
5.80    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  93  and name N   )
       ( resid  93  and name HN  )  
9.40    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  94  and name N   )
       ( resid  94  and name HN  )  
8.30    0.40    


assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 101  and name N   )
       ( resid 101  and name HN  )  
-5.60   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 102  and name N   )
       ( resid 102  and name HN  )  
6.20    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 104  and name N   )
       ( resid 104  and name HN  )  
4.00    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 105  and name N   )
       ( resid 105  and name HN  )  
2.90    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 106  and name N   )
       ( resid 106  and name HN  )  
2.60    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 107  and name N   )
       ( resid 107  and name HN  )  
0.00    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 108  and name N   )
       ( resid 108  and name HN  )  
4.70    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 109  and name N   )
       ( resid 109  and name HN  )  
1.50    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 110  and name N   )
       ( resid 110  and name HN  )  
-2.80   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 111  and name N   )
       ( resid 111  and name HN  )  
2.60    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 112  and name N   )
       ( resid 112  and name HN  )  
4.70    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 113  and name N   )
       ( resid 113  and name HN  )  
-9.20   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 114  and name N   )
       ( resid 114  and name HN  )  
1.20    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 115  and name N   )
       ( resid 115  and name HN  )  
-6.70   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 116  and name N   )
       ( resid 116  and name HN  )  
6.90    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 117  and name N   )
       ( resid 117  and name HN  )  
5.10    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 118  and name N   )
       ( resid 118  and name HN  )  
7.60    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 120  and name N   )
       ( resid 120  and name HN  )  
1.90    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 121  and name N   )
       ( resid 121  and name HN  )  
10.10   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 122  and name N   )
       ( resid 122  and name HN  )  
-0.90   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 123  and name N   )
       ( resid 123  and name HN  )  
-12.50  0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 124  and name N   )
       ( resid 124  and name HN  )  
0.10    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 125  and name N   )
       ( resid 125  and name HN  )  
10.40   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 126  and name N   )
       ( resid 126  and name HN  )  
-13.70  0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 128  and name N   )
       ( resid 128  and name HN  )  
-15.30  0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 129  and name N   )
       ( resid 129  and name HN  )  
6.50    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 130  and name N   )
       ( resid 130  and name HN  )  
5.80    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 131  and name N   )
       ( resid 131  and name HN  )  
5.80    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 132  and name N   )
       ( resid 132  and name HN  )  
7.50    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 135  and name N   )
       ( resid 135  and name HN  )  
-1.30   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 136  and name N   )
       ( resid 136  and name HN  )  
2.20    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 138  and name N   )
       ( resid 138  and name HN  )  
-15.60  0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 139  and name N   )
       ( resid 139  and name HN  )  
-11.80  0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 140  and name N   )
       ( resid 140  and name HN  )  
-3.50   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 141  and name N   )
       ( resid 141  and name HN  )  
0.80    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 142  and name N   )
       ( resid 142  and name HN  )  
-9.90   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 143  and name N   )
       ( resid 143  and name HN  )  
-2.10   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 144  and name N   )
       ( resid 144  and name HN  )  
2.90    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 145  and name N   )
       ( resid 145  and name HN  )  
-0.70   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 146  and name N   )
       ( resid 146  and name HN  )  
-8.80   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 147  and name N   )
       ( resid 147  and name HN  )  
0.40    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 148  and name N   )
       ( resid 148  and name HN  )  
3.70    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 151  and name N   )
       ( resid 151  and name HN  )  
6.10    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 154  and name N   )
       ( resid 154  and name HN  )  
-0.70   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 155  and name N   )
       ( resid 155  and name HN  )  
0.10    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 156  and name N   )
       ( resid 156  and name HN  )  
5.40    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 157  and name N   )
       ( resid 157  and name HN  )  
12.90   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 159  and name N   )
       ( resid 159  and name HN  )  
1.20    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 160  and name N   )
       ( resid 160  and name HN  )  
0.40    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 161  and name N   )
       ( resid 161  and name HN  )  
8.70    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 162  and name N   )
       ( resid 162  and name HN  )  
7.90    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 163  and name N   )
       ( resid 163  and name HN  )  
10.00   0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 164  and name N   )
       ( resid 164  and name HN  )  
3.70    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 165  and name N   )
       ( resid 165  and name HN  )  
7.60    0.40    

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 166  and name N   )
       ( resid 166  and name HN  )  
4.00    0.40    


! Unambiguous NOE restraints:


 ASSI {    1}
   (( segid "AREF" and resid 135  and name HE1 ))
   (( segid "AREF" and resid 133  and name HB2 ))
      2.000     2.000     4.000 peak     1 spectrum    1 weight  0.10000E+01 volume  0.63158E-02 ppm1      7.770 ppm2      2.596 CV     1
 OR {    1}
   (( segid "AREF" and resid 135  and name HE1 ))
   (( segid "AREF" and resid 133  and name HB1 ))
 ASSI {    2}
   (( segid "AREF" and resid 135  and name HE1 ))
   (( segid "AREF" and resid 90   and name HB1 ))
      3.600     1.600     1.600 peak     2 spectrum    1 weight  0.10000E+01 volume  0.36484E-02 ppm1      7.771 ppm2      1.324 CV     1
 ASSI {    3}
   (( segid "AREF" and resid 135  and name HE1 ))
   (( segid "AREF" and resid 135  and name HD2 ))
      3.200     1.300     1.300 peak     3 spectrum    1 weight  0.10000E+01 volume  0.52271E-02 ppm1      7.765 ppm2      6.880 CV     1
 ASSI {    6}
   (  segid "AREF" and resid 109  and name HD% )
   (  segid "AREF" and resid 112  and name HD% )
      2.600     0.800     0.800 peak     6 spectrum    1 weight  0.10000E+01 volume  0.42155E-02 ppm1      7.672 ppm2      7.463 CV     1
 ASSI {    8}
   (  segid "AREF" and resid 109  and name HD% )
   (( segid "AREF" and resid 109  and name HA  ))
      2.200     0.600     0.600 peak     8 spectrum    1 weight  0.10000E+01 volume  0.55644E-02 ppm1      7.667 ppm2      4.870 CV     1
 ASSI {    9}
   (  segid "AREF" and resid 109  and name HD% )
   (  segid "AREF" and resid 163  and name HD2%)
      3.600     3.600     2.400 peak     9 spectrum    1 weight  0.10000E+01 volume  0.56107E-02 ppm1      7.670 ppm2      0.881 CV     1
 ASSI {   10}
   (  segid "AREF" and resid 109  and name HD% )
   (  segid "AREF" and resid 136  and name HD% )
      2.800     2.800     3.200 peak    10 spectrum    1 weight  0.10000E+01 volume  0.63158E-02 ppm1      7.662 ppm2      7.236 CV     1
 ASSI {   11}
   (  segid "AREF" and resid 109  and name HD% )
   (( segid "AREF" and resid 109  and name HZ  ))
      3.000     1.200     1.200 peak    11 spectrum    1 weight  0.10000E+01 volume  0.44915E-02 ppm1      7.663 ppm2      7.113 CV     1
 ASSI {   12}
   (  segid "AREF" and resid 109  and name HD% )
   (  segid "AREF" and resid 109  and name HE% )
      2.400     0.700     0.700 peak    12 spectrum    1 weight  0.10000E+01 volume  0.26060E-02 ppm1      7.665 ppm2      7.031 CV     1
 ASSI {   13}
   (  segid "AREF" and resid 109  and name HD% )
   (  segid "AREF" and resid 145  and name HB% )
      3.400     1.400     1.400 peak    13 spectrum    1 weight  0.10000E+01 volume  0.41236E-02 ppm1      7.663 ppm2      1.150 CV     1
 ASSI {   14}
   (  segid "AREF" and resid 109  and name HD% )
   (  segid "AREF" and resid 105  and name HD1%)
      2.600     0.800     0.800 peak    14 spectrum    1 weight  0.10000E+01 volume  0.33264E-02 ppm1      7.665 ppm2      0.740 CV     1
 ASSI {   17}
   (( segid "AREF" and resid 70   and name HE3 ))
   (( segid "AREF" and resid 70   and name HB1 ))
      2.700     0.900     0.900 peak    17 spectrum    1 weight  0.10000E+01 volume  0.38476E-02 ppm1      7.572 ppm2      3.214 CV     1
 ASSI {   18}
   (( segid "AREF" and resid 70   and name HE3 ))
   (( segid "AREF" and resid 70   and name HA  ))
      2.700     0.900     0.900 peak    18 spectrum    1 weight  0.10000E+01 volume  0.40162E-02 ppm1      7.565 ppm2      4.614 CV     1
 ASSI {   19}
   (( segid "AREF" and resid 70   and name HE3 ))
   (( segid "AREF" and resid 70   and name HB2 ))
      3.100     1.200     1.200 peak    19 spectrum    1 weight  0.10000E+01 volume  0.44148E-02 ppm1      7.563 ppm2      3.275 CV     1
 ASSI {   20}
   (( segid "AREF" and resid 70   and name HE3 ))
   (( segid "AREF" and resid 70   and name HZ3 ))
      2.800     1.000     1.000 peak    20 spectrum    1 weight  0.10000E+01 volume  0.33418E-02 ppm1      7.560 ppm2      7.086 CV     1
 ASSI {   27}
   (  segid "AREF" and resid 112  and name HD% )
   (( segid "AREF" and resid 109  and name HA  ))
      2.400     0.700     0.700 peak    27 spectrum    1 weight  0.10000E+01 volume  0.36177E-02 ppm1      7.495 ppm2      4.868 CV     1
 ASSI {   31}
   (  segid "AREF" and resid 112  and name HD% )
   (( segid "AREF" and resid 112  and name HB2 ))
      2.400     0.700     0.700 peak    31 spectrum    1 weight  0.10000E+01 volume  0.41236E-02 ppm1      7.492 ppm2      3.404 CV     1
 ASSI {   32}
   (  segid "AREF" and resid 112  and name HD% )
   (( segid "AREF" and resid 112  and name HZ  ))
      3.200     1.300     1.300 peak    32 spectrum    1 weight  0.10000E+01 volume  0.63004E-02 ppm1      7.488 ppm2      6.870 CV     1
 ASSI {   33}
   (  segid "AREF" and resid 112  and name HD% )
   (  segid "AREF" and resid 149  and name HE% )
      2.400     0.700     0.700 peak    33 spectrum    1 weight  0.10000E+01 volume  0.55644E-02 ppm1      7.486 ppm2      6.651 CV     1
 ASSI {   34}
   (  segid "AREF" and resid 112  and name HD% )
   (  segid "AREF" and resid 112  and name HE% )
      2.600     0.800     0.800 peak    34 spectrum    1 weight  0.10000E+01 volume  0.28972E-02 ppm1      7.482 ppm2      7.252 CV     1
 ASSI {   40}
   (( segid "AREF" and resid 70   and name HZ2 ))
   (( segid "AREF" and resid 70   and name HH2 ))
      2.900     1.000     1.000 peak    40 spectrum    1 weight  0.10000E+01 volume  0.30352E-02 ppm1      7.441 ppm2      7.166 CV     1
 ASSI {   41}
   (( segid "AREF" and resid 70   and name HZ2 ))
   (( segid "AREF" and resid 70   and name HZ3 ))
      3.700     1.700     1.700 peak    41 spectrum    1 weight  0.10000E+01 volume  0.48285E-02 ppm1      7.443 ppm2      7.091 CV     1
 ASSI {   44}
   (  segid "AREF" and resid 136  and name HE% )
   (( segid "AREF" and resid 134  and name HA  ))
      2.000     2.000     4.000 peak    44 spectrum    1 weight  0.10000E+01 volume  0.55953E-02 ppm1      7.270 ppm2      4.373 CV     1
 ASSI {   45}
   (  segid "AREF" and resid 112  and name HE% )
   (( segid "AREF" and resid 109  and name HB2 ))
      2.000     2.000     4.000 peak    45 spectrum    1 weight  0.10000E+01 volume  0.55336E-02 ppm1      7.270 ppm2      3.434 CV     1
 OR {   45}
   (  segid "AREF" and resid 112  and name HE% )
   (( segid "AREF" and resid 109  and name HB1 ))
 ASSI {   51}
   (  segid "AREF" and resid 136  and name HD% )
   (( segid "AREF" and resid 142  and name HN  ))
      2.800     2.800     3.200 peak    51 spectrum    1 weight  0.10000E+01 volume  0.43688E-02 ppm1      7.239 ppm2      6.640 CV     1
 ASSI {   53}
   (  segid "AREF" and resid 136  and name HD% )
   (( segid "AREF" and resid 136  and name HA  ))
      2.700     0.900     0.900 peak    53 spectrum    1 weight  0.10000E+01 volume  0.37097E-02 ppm1      7.227 ppm2      4.825 CV     1
 ASSI {   56}
   (  segid "AREF" and resid 136  and name HD% )
   (( segid "AREF" and resid 109  and name HB1 ))
      2.800     2.800     3.200 peak    56 spectrum    1 weight  0.10000E+01 volume  0.34491E-02 ppm1      7.227 ppm2      3.406 CV     1
 ASSI {   58}
   (  segid "AREF" and resid 136  and name HD% )
   (  segid "AREF" and resid 89   and name HB% )
      2.200     0.600     0.600 peak    58 spectrum    1 weight  0.10000E+01 volume  0.46754E-02 ppm1      7.228 ppm2      1.205 CV     1
 ASSI {   59}
   (  segid "AREF" and resid 136  and name HD% )
   (  segid "AREF" and resid 115  and name HD1%)
      2.500     0.800     0.800 peak    59 spectrum    1 weight  0.10000E+01 volume  0.49972E-02 ppm1      7.227 ppm2     -0.088 CV     1
 ASSI {   60}
   (  segid "AREF" and resid 98   and name HD% )
   (  segid "AREF" and resid 98   and name HE% )
      2.600     0.900     0.900 peak    60 spectrum    1 weight  0.10000E+01 volume  0.39856E-02 ppm1      7.225 ppm2      7.108 CV     1
 ASSI {   62}
   (  segid "AREF" and resid 98   and name HD% )
   (( segid "AREF" and resid 98   and name HA  ))
      2.900     1.000     1.000 peak    62 spectrum    1 weight  0.10000E+01 volume  0.31118E-02 ppm1      7.225 ppm2      4.364 CV     1
 ASSI {   64}
   (  segid "AREF" and resid 98   and name HD% )
   (( segid "AREF" and resid 98   and name HB2 ))
      2.700     0.900     0.900 peak    64 spectrum    1 weight  0.10000E+01 volume  0.38476E-02 ppm1      7.226 ppm2      3.042 CV     1
 OR {   64}
   (  segid "AREF" and resid 98   and name HD% )
   (( segid "AREF" and resid 98   and name HB1 ))
 ASSI {   65}
   (  segid "AREF" and resid 136  and name HD% )
   (( segid "AREF" and resid 136  and name HB1 ))
      2.300     0.700     0.700 peak    65 spectrum    1 weight  0.10000E+01 volume  0.38323E-02 ppm1      7.221 ppm2      2.710 CV     1
 OR {   65}
   (  segid "AREF" and resid 136  and name HD% )
   (( segid "AREF" and resid 136  and name HB2 ))
 ASSI {   66}
   (  segid "AREF" and resid 136  and name HD% )
   (  segid "AREF" and resid 91   and name HD2%)
      3.800     3.800     2.200 peak    66 spectrum    1 weight  0.10000E+01 volume  0.38476E-02 ppm1      7.223 ppm2      0.812 CV     1
 ASSI {   67}
   (  segid "AREF" and resid 136  and name HD% )
   (  segid "AREF" and resid 91   and name HD1%)
      3.900     1.900     1.900 peak    67 spectrum    1 weight  0.10000E+01 volume  0.39089E-02 ppm1      7.225 ppm2      0.762 CV     1
 ASSI {   68}
   (  segid "AREF" and resid 136  and name HD% )
   (  segid "AREF" and resid 145  and name HB% )
      3.300     3.300     2.700 peak    68 spectrum    1 weight  0.10000E+01 volume  0.33111E-02 ppm1      7.219 ppm2      1.139 CV     1
 ASSI {   69}
   (( segid "AREF" and resid 70   and name HD1 ))
   (( segid "AREF" and resid 70   and name HB2 ))
      2.700     0.900     0.900 peak    69 spectrum    1 weight  0.10000E+01 volume  0.37403E-02 ppm1      7.211 ppm2      3.254 CV     1
 ASSI {   71}
   (  segid "AREF" and resid 136  and name HD% )
   (( segid "AREF" and resid 141  and name HB1 ))
      2.400     2.400     3.600 peak    71 spectrum    1 weight  0.10000E+01 volume  0.49818E-02 ppm1      7.209 ppm2      2.839 CV     1
 ASSI {   73}
   (  segid "AREF" and resid 75   and name HD% )
   (( segid "AREF" and resid 75   and name HB2 ))
      2.800     1.000     1.000 peak    73 spectrum    1 weight  0.10000E+01 volume  0.32958E-02 ppm1      7.204 ppm2      3.145 CV     1
 ASSI {   75}
   (  segid "AREF" and resid 75   and name HD% )
   (  segid "AREF" and resid 75   and name HE% )
      2.900     1.000     1.000 peak    75 spectrum    1 weight  0.10000E+01 volume  0.21461E-02 ppm1      7.200 ppm2      7.285 CV     1
 ASSI {   76}
   (( segid "AREF" and resid 70   and name HD1 ))
   (( segid "AREF" and resid 69   and name HA  ))
      3.200     3.200     2.800 peak    76 spectrum    1 weight  0.10000E+01 volume  0.55953E-02 ppm1      7.202 ppm2      4.153 CV     1
 ASSI {   78}
   (( segid "AREF" and resid 109  and name HZ  ))
   (  segid "AREF" and resid 109  and name HE% )
      2.200     0.600     0.600 peak    78 spectrum    1 weight  0.10000E+01 volume  0.42462E-02 ppm1      7.131 ppm2      7.034 CV     1
 ASSI {   79}
   (  segid "AREF" and resid 98   and name HE% )
   (  segid "AREF" and resid 96   and name HD2%)
      2.200     2.200     3.800 peak    79 spectrum    1 weight  0.10000E+01 volume  0.35410E-02 ppm1      7.128 ppm2      0.730 CV     1
 ASSI {   80}
   (( segid "AREF" and resid 109  and name HZ  ))
   (  segid "AREF" and resid 149  and name HD% )
      2.400     0.700     0.700 peak    80 spectrum    1 weight  0.10000E+01 volume  0.30812E-02 ppm1      7.118 ppm2      6.793 CV     1
 ASSI {   81}
   (( segid "AREF" and resid 109  and name HZ  ))
   (( segid "AREF" and resid 91   and name HG  ))
      2.000     0.500     0.500 peak    81 spectrum    1 weight  0.10000E+01 volume  0.32958E-02 ppm1      7.123 ppm2      1.060 CV     1
 ASSI {   84}
   (( segid "AREF" and resid 109  and name HZ  ))
   (( segid "AREF" and resid 142  and name HA  ))
      3.100     3.100     2.900 peak    84 spectrum    1 weight  0.10000E+01 volume  0.43841E-02 ppm1      7.110 ppm2      2.822 CV     1
 ASSI {   88}
   (( segid "AREF" and resid 109  and name HZ  ))
   (  segid "AREF" and resid 134  and name HG2%)
      3.200     1.300     1.300 peak    88 spectrum    1 weight  0.10000E+01 volume  0.38936E-02 ppm1      7.108 ppm2      0.291 CV     1
 OR {   88}
   (( segid "AREF" and resid 109  and name HZ  ))
   (  segid "AREF" and resid 134  and name HG1%)
 ASSI {   92}
   (( segid "AREF" and resid 109  and name HZ  ))
   (( segid "AREF" and resid 109  and name HB1 ))
      3.100     3.100     2.900 peak    92 spectrum    1 weight  0.10000E+01 volume  0.62849E-02 ppm1      7.106 ppm2      3.407 CV     1
 OR {   92}
   (( segid "AREF" and resid 109  and name HZ  ))
   (( segid "AREF" and resid 109  and name HB2 ))
 ASSI {   93}
   (( segid "AREF" and resid 109  and name HZ  ))
   (( segid "AREF" and resid 112  and name HB1 ))
      3.000     3.000     3.000 peak    93 spectrum    1 weight  0.10000E+01 volume  0.63004E-02 ppm1      7.097 ppm2      3.135 CV     1
 ASSI {   96}
   (( segid "AREF" and resid 109  and name HZ  ))
   (  segid "AREF" and resid 91   and name HD2%)
      2.700     0.900     0.900 peak    96 spectrum    1 weight  0.10000E+01 volume  0.37097E-02 ppm1      7.098 ppm2      0.824 CV     1
 ASSI {   97}
   (( segid "AREF" and resid 70   and name HZ3 ))
   (( segid "AREF" and resid 70   and name HH2 ))
      2.600     0.800     0.800 peak    97 spectrum    1 weight  0.10000E+01 volume  0.50281E-02 ppm1      7.092 ppm2      7.180 CV     1
 ASSI {   98}
   (  segid "AREF" and resid 60   and name HD% )
   (  segid "AREF" and resid 60   and name HE% )
      2.800     1.000     1.000 peak    98 spectrum    1 weight  0.10000E+01 volume  0.26213E-02 ppm1      7.093 ppm2      6.803 CV     1
 ASSI {   99}
   (  segid "AREF" and resid 60   and name HD% )
   (( segid "AREF" and resid 60   and name HA  ))
      2.800     1.000     1.000 peak    99 spectrum    1 weight  0.10000E+01 volume  0.35717E-02 ppm1      7.091 ppm2      4.528 CV     1
 ASSI {  102}
   (  segid "AREF" and resid 109  and name HE% )
   (  segid "AREF" and resid 136  and name HD% )
      3.200     3.200     2.800 peak   102 spectrum    1 weight  0.10000E+01 volume  0.40469E-02 ppm1      7.030 ppm2      7.217 CV     1
 ASSI {  104}
   (  segid "AREF" and resid 109  and name HE% )
   (( segid "AREF" and resid 91   and name HG  ))
      2.300     0.700     0.700 peak   104 spectrum    1 weight  0.10000E+01 volume  0.36330E-02 ppm1      7.030 ppm2      1.065 CV     1
 ASSI {  105}
   (  segid "AREF" and resid 109  and name HE% )
   (  segid "AREF" and resid 91   and name HD2%)
      3.100     1.200     1.200 peak   105 spectrum    1 weight  0.10000E+01 volume  0.35257E-02 ppm1      7.031 ppm2      0.829 CV     1
 ASSI {  107}
   (  segid "AREF" and resid 109  and name HE% )
   (  segid "AREF" and resid 145  and name HB% )
      2.500     0.800     0.800 peak   107 spectrum    1 weight  0.10000E+01 volume  0.43688E-02 ppm1      7.026 ppm2      1.156 CV     1
 ASSI {  108}
   (  segid "AREF" and resid 109  and name HE% )
   (  segid "AREF" and resid 105  and name HD1%)
      2.800     1.000     1.000 peak   108 spectrum    1 weight  0.10000E+01 volume  0.31578E-02 ppm1      7.023 ppm2      0.731 CV     1
 ASSI {  109}
   (( segid "AREF" and resid 72   and name HD2 ))
   (( segid "AREF" and resid 72   and name HB2 ))
      2.800     1.000     1.000 peak   109 spectrum    1 weight  0.10000E+01 volume  0.37403E-02 ppm1      6.995 ppm2      3.048 CV     1
 ASSI {  110}
   (( segid "AREF" and resid 72   and name HD2 ))
   (( segid "AREF" and resid 72   and name HB1 ))
      3.000     1.100     1.100 peak   110 spectrum    1 weight  0.10000E+01 volume  0.37250E-02 ppm1      6.991 ppm2      2.985 CV     1
 ASSI {  112}
   (  segid "AREF" and resid 122  and name HD% )
   (( segid "AREF" and resid 122  and name HB2 ))
      2.600     0.900     0.900 peak   112 spectrum    1 weight  0.10000E+01 volume  0.32038E-02 ppm1      6.919 ppm2      2.729 CV     1
 OR {  112}
   (  segid "AREF" and resid 122  and name HD% )
   (( segid "AREF" and resid 122  and name HB1 ))
 ASSI {  113}
   (  segid "AREF" and resid 122  and name HD% )
   (( segid "AREF" and resid 120  and name HB  ))
      2.900     2.900     3.100 peak   113 spectrum    1 weight  0.10000E+01 volume  0.31731E-02 ppm1      6.921 ppm2      1.944 CV     1
 ASSI {  114}
   (  segid "AREF" and resid 122  and name HD% )
   (  segid "AREF" and resid 120  and name HG2%)
      3.000     3.000     3.000 peak   114 spectrum    1 weight  0.10000E+01 volume  0.32038E-02 ppm1      6.919 ppm2      0.455 CV     1
 ASSI {  115}
   (  segid "AREF" and resid 122  and name HD% )
   (( segid "AREF" and resid 128  and name HA  ))
      2.800     1.000     1.000 peak   115 spectrum    1 weight  0.10000E+01 volume  0.31578E-02 ppm1      6.918 ppm2      4.079 CV     1
 ASSI {  116}
   (  segid "AREF" and resid 122  and name HD% )
   (( segid "AREF" and resid 122  and name HA  ))
      2.800     1.000     1.000 peak   116 spectrum    1 weight  0.10000E+01 volume  0.34338E-02 ppm1      6.910 ppm2      5.050 CV     1
 ASSI {  118}
   (  segid "AREF" and resid 122  and name HE% )
   (  segid "AREF" and resid 120  and name HG1%)
      2.000     0.500     0.500 peak   118 spectrum    1 weight  0.10000E+01 volume  0.62541E-02 ppm1      6.909 ppm2      0.729 CV     1
 OR {  118}
   (  segid "AREF" and resid 122  and name HD% )
   (  segid "AREF" and resid 120  and name HG1%)
 ASSI {  119}
   (  segid "AREF" and resid 122  and name HE% )
   (( segid "AREF" and resid 120  and name HB  ))
      2.600     2.600     3.400 peak   119 spectrum    1 weight  0.10000E+01 volume  0.38476E-02 ppm1      6.901 ppm2      1.944 CV     1
 OR {  119}
   (  segid "AREF" and resid 122  and name HD% )
   (( segid "AREF" and resid 120  and name HB  ))
 ASSI {  120}
   (  segid "AREF" and resid 122  and name HE% )
   (( segid "AREF" and resid 122  and name HA  ))
      3.600     1.600     1.600 peak   120 spectrum    1 weight  0.10000E+01 volume  0.38016E-02 ppm1      6.894 ppm2      5.055 CV     1
 ASSI {  121}
   (  segid "AREF" and resid 122  and name HE% )
   (( segid "AREF" and resid 122  and name HB2 ))
      3.700     1.700     1.700 peak   121 spectrum    1 weight  0.10000E+01 volume  0.40316E-02 ppm1      6.895 ppm2      2.738 CV     1
 OR {  121}
   (  segid "AREF" and resid 122  and name HE% )
   (( segid "AREF" and resid 122  and name HB1 ))
 ASSI {  122}
   (( segid "AREF" and resid 135  and name HD2 ))
   (( segid "AREF" and resid 135  and name HA  ))
      2.600     0.800     0.800 peak   122 spectrum    1 weight  0.10000E+01 volume  0.31885E-02 ppm1      6.870 ppm2      5.414 CV     1
 ASSI {  123}
   (( segid "AREF" and resid 135  and name HD2 ))
   (( segid "AREF" and resid 90   and name HA  ))
      2.600     0.800     0.800 peak   123 spectrum    1 weight  0.10000E+01 volume  0.34797E-02 ppm1      6.868 ppm2      4.964 CV     1
 ASSI {  124}
   (( segid "AREF" and resid 135  and name HD2 ))
   (( segid "AREF" and resid 90   and name HB2 ))
      2.800     1.000     1.000 peak   124 spectrum    1 weight  0.10000E+01 volume  0.40162E-02 ppm1      6.870 ppm2      1.496 CV     1
 ASSI {  125}
   (( segid "AREF" and resid 135  and name HD2 ))
   (( segid "AREF" and resid 90   and name HB1 ))
      3.500     1.500     1.500 peak   125 spectrum    1 weight  0.10000E+01 volume  0.40623E-02 ppm1      6.868 ppm2      1.346 CV     1
 ASSI {  126}
   (( segid "AREF" and resid 135  and name HD2 ))
   (( segid "AREF" and resid 117  and name HG2 ))
      2.200     2.200     3.800 peak   126 spectrum    1 weight  0.10000E+01 volume  0.34031E-02 ppm1      6.870 ppm2      1.240 CV     1
 ASSI {  127}
   (( segid "AREF" and resid 112  and name HZ  ))
   (  segid "AREF" and resid 109  and name HE% )
      3.300     3.300     2.700 peak   127 spectrum    1 weight  0.10000E+01 volume  0.40009E-02 ppm1      6.865 ppm2      7.037 CV     1
 ASSI {  128}
   (( segid "AREF" and resid 112  and name HZ  ))
   (  segid "AREF" and resid 112  and name HE% )
      2.700     0.900     0.900 peak   128 spectrum    1 weight  0.10000E+01 volume  0.30965E-02 ppm1      6.861 ppm2      7.253 CV     1
 ASSI {  129}
   (( segid "AREF" and resid 112  and name HZ  ))
   (( segid "AREF" and resid 149  and name HA  ))
      2.900     2.900     3.100 peak   129 spectrum    1 weight  0.10000E+01 volume  0.38936E-02 ppm1      6.857 ppm2      4.894 CV     1
 ASSI {  132}
   (  segid "AREF" and resid 149  and name HD% )
   (  segid "AREF" and resid 149  and name HE% )
      2.500     0.800     0.800 peak   132 spectrum    1 weight  0.10000E+01 volume  0.28206E-02 ppm1      6.810 ppm2      6.651 CV     1
 ASSI {  133}
   (  segid "AREF" and resid 149  and name HD% )
   (( segid "AREF" and resid 149  and name HB1 ))
      2.400     0.700     0.700 peak   133 spectrum    1 weight  0.10000E+01 volume  0.41695E-02 ppm1      6.811 ppm2      3.486 CV     1
 OR {  133}
   (  segid "AREF" and resid 149  and name HD% )
   (( segid "AREF" and resid 149  and name HB2 ))
 ASSI {  135}
   (  segid "AREF" and resid 149  and name HD% )
   (( segid "AREF" and resid 149  and name HA  ))
      2.400     0.700     0.700 peak   135 spectrum    1 weight  0.10000E+01 volume  0.36023E-02 ppm1      6.807 ppm2      4.940 CV     1
 ASSI {  136}
   (  segid "AREF" and resid 149  and name HD% )
   (( segid "AREF" and resid 152  and name HB  ))
      2.600     2.600     3.400 peak   136 spectrum    1 weight  0.10000E+01 volume  0.62695E-02 ppm1      6.808 ppm2      2.350 CV     1
 ASSI {  140}
   (  segid "AREF" and resid 149  and name HE% )
   (( segid "AREF" and resid 91   and name HG  ))
      3.100     3.100     2.900 peak   140 spectrum    1 weight  0.10000E+01 volume  0.55644E-02 ppm1      6.658 ppm2      1.063 CV     1
 ASSI {  141}
   (  segid "AREF" and resid 149  and name HE% )
   (  segid "AREF" and resid 112  and name HE% )
      2.700     0.900     0.900 peak   141 spectrum    1 weight  0.10000E+01 volume  0.43995E-02 ppm1      6.655 ppm2      7.250 CV     1
 ASSI {    3}
   (( segid "AREF" and resid 94   and name HA  ))
   (  segid "AREF" and resid 131  and name HG2%)
      2.600     0.800     0.800 peak     3 spectrum    2 weight  0.10000E+01 volume  0.56657E-02 ppm1      5.320 ppm2      1.056 CV     1
 ASSI {    5}
   (( segid "AREF" and resid 101  and name HA  ))
   (( segid "AREF" and resid 101  and name HB2 ))
      2.500     0.800     0.800 peak     5 spectrum    2 weight  0.10000E+01 volume  0.81332E-02 ppm1      4.982 ppm2      4.417 CV     1
 ASSI {    8}
   (( segid "AREF" and resid 92   and name HA  ))
   (  segid "AREF" and resid 92   and name HD1%)
      2.600     0.800     0.800 peak     8 spectrum    2 weight  0.10000E+01 volume  0.42857E-02 ppm1      4.979 ppm2      0.842 CV     1
 OR {    8}
   (( segid "AREF" and resid 92   and name HA  ))
   (  segid "AREF" and resid 92   and name HD2%)
 ASSI {   12}
   (( segid "AREF" and resid 157  and name HA  ))
   (( segid "AREF" and resid 157  and name HB2 ))
      2.300     0.700     0.700 peak    12 spectrum    2 weight  0.10000E+01 volume  0.58117E-02 ppm1      4.991 ppm2      1.856 CV     1
 OR {   12}
   (( segid "AREF" and resid 157  and name HA  ))
   (( segid "AREF" and resid 157  and name HB1 ))
 ASSI {   17}
   (( segid "AREF" and resid 13   and name HA  ))
   (( segid "AREF" and resid 13   and name HB2 ))
      2.600     0.900     0.900 peak    17 spectrum    2 weight  0.10000E+01 volume  0.50001E-02 ppm1      4.869 ppm2      2.780 CV     1
 ASSI {   18}
   (( segid "AREF" and resid 13   and name HA  ))
   (( segid "AREF" and resid 13   and name HB1 ))
      2.400     0.700     0.700 peak    18 spectrum    2 weight  0.10000E+01 volume  0.45617E-02 ppm1      4.864 ppm2      2.576 CV     1
 ASSI {   20}
   (( segid "AREF" and resid 119  and name HA  ))
   (  segid "AREF" and resid 119  and name HB% )
      2.500     0.800     0.800 peak    20 spectrum    2 weight  0.10000E+01 volume  0.50488E-02 ppm1      4.814 ppm2      1.371 CV     1
 ASSI {   28}
   (( segid "AREF" and resid 87   and name HB  ))
   (  segid "AREF" and resid 87   and name HG2%)
      2.600     0.900     0.900 peak    28 spectrum    2 weight  0.10000E+01 volume  0.33929E-02 ppm1      4.404 ppm2      1.251 CV     1
 ASSI {   34}
   (( segid "AREF" and resid 114  and name HB  ))
   (  segid "AREF" and resid 114  and name HG2%)
      2.400     0.700     0.700 peak    34 spectrum    2 weight  0.10000E+01 volume  0.54223E-02 ppm1      4.073 ppm2      1.212 CV     1
 ASSI {   44}
   (( segid "AREF" and resid 22   and name HB1 ))
   (( segid "AREF" and resid 22   and name HA  ))
      2.600     0.800     0.800 peak    44 spectrum    2 weight  0.10000E+01 volume  0.35227E-02 ppm1      3.948 ppm2      4.488 CV     1
 ASSI {   46}
   (( segid "AREF" and resid 125  and name HB1 ))
   (( segid "AREF" and resid 125  and name HN  ))
      2.400     0.700     0.700 peak    46 spectrum    2 weight  0.10000E+01 volume  0.52435E-02 ppm1      3.964 ppm2      8.398 CV     1
 OR {   46}
   (( segid "AREF" and resid 125  and name HB2 ))
   (( segid "AREF" and resid 125  and name HN  ))
 ASSI {   50}
   (( segid "AREF" and resid 166  and name HB1 ))
   (( segid "AREF" and resid 166  and name HA  ))
      2.700     0.900     0.900 peak    50 spectrum    2 weight  0.10000E+01 volume  0.34740E-02 ppm1      3.826 ppm2      4.422 CV     1
 OR {   50}
   (( segid "AREF" and resid 166  and name HB2 ))
   (( segid "AREF" and resid 166  and name HA  ))
 ASSI {   51}
   (( segid "AREF" and resid 61   and name HB2 ))
   (( segid "AREF" and resid 61   and name HA  ))
      2.700     0.900     0.900 peak    51 spectrum    2 weight  0.10000E+01 volume  0.36526E-02 ppm1      3.764 ppm2      4.405 CV     1
 OR {   51}
   (( segid "AREF" and resid 61   and name HB1 ))
   (( segid "AREF" and resid 61   and name HA  ))
 ASSI {   53}
   (( segid "AREF" and resid 100  and name HA  ))
   (( segid "AREF" and resid 101  and name HB2 ))
      3.600     1.600     1.600 peak    53 spectrum    2 weight  0.10000E+01 volume  0.37662E-02 ppm1      3.975 ppm2      4.377 CV     1
 ASSI {   54}
   (( segid "AREF" and resid 166  and name HB2 ))
   (  segid "AREF" and resid 168  and name HG2%)
      2.800     2.800     3.200 peak    54 spectrum    2 weight  0.10000E+01 volume  0.10941E-01 ppm1      3.840 ppm2      0.847 CV     1
 OR {   54}
   (( segid "AREF" and resid 166  and name HB1 ))
   (  segid "AREF" and resid 168  and name HG2%)
 OR {   54}
   (( segid "AREF" and resid 166  and name HB2 ))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI {   56}
   (( segid "AREF" and resid 26   and name HA  ))
   (( segid "AREF" and resid 27   and name HN  ))
      2.300     2.300     3.700 peak    56 spectrum    2 weight  0.10000E+01 volume  0.81496E-02 ppm1      3.896 ppm2      8.085 CV     1
 ASSI {   59}
   (( segid "AREF" and resid 26   and name HA  ))
   (  segid "AREF" and resid 26   and name HG2%)
      2.500     0.800     0.800 peak    59 spectrum    2 weight  0.10000E+01 volume  0.33604E-02 ppm1      3.894 ppm2      0.894 CV     1
 ASSI {   64}
   (( segid "AREF" and resid 42   and name HA  ))
   (( segid "AREF" and resid 42   and name HD1 ))
      2.900     1.000     1.000 peak    64 spectrum    2 weight  0.10000E+01 volume  0.45942E-02 ppm1      4.441 ppm2      3.630 CV     1
 ASSI {   68}
   (( segid "AREF" and resid 59   and name HA  ))
   (( segid "AREF" and resid 60   and name HN  ))
      2.800     1.000     1.000 peak    68 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      4.368 ppm2      8.033 CV     1
 ASSI {   69}
   (( segid "AREF" and resid 67   and name HA  ))
   (( segid "AREF" and resid 67   and name HB1 ))
      2.400     0.700     0.700 peak    69 spectrum    2 weight  0.10000E+01 volume  0.31331E-02 ppm1      4.369 ppm2      2.238 CV     1
 ASSI {   70}
   (( segid "AREF" and resid 67   and name HA  ))
   (( segid "AREF" and resid 67   and name HB2 ))
      2.900     1.000     1.000 peak    70 spectrum    2 weight  0.10000E+01 volume  0.30844E-02 ppm1      4.369 ppm2      1.876 CV     1
 ASSI {   72}
   (( segid "AREF" and resid 27   and name HA  ))
   (( segid "AREF" and resid 27   and name HN  ))
      2.300     0.700     0.700 peak    72 spectrum    2 weight  0.10000E+01 volume  0.45779E-02 ppm1      3.953 ppm2      8.063 CV     1
 ASSI {   73}
   (( segid "AREF" and resid 27   and name HA  ))
   (( segid "AREF" and resid 27   and name HG12))
      2.600     0.800     0.800 peak    73 spectrum    2 weight  0.10000E+01 volume  0.41558E-02 ppm1      3.953 ppm2      1.581 CV     1
 ASSI {   75}
   (( segid "AREF" and resid 27   and name HA  ))
   (( segid "AREF" and resid 27   and name HG11))
      2.200     0.600     0.600 peak    75 spectrum    2 weight  0.10000E+01 volume  0.47078E-02 ppm1      3.944 ppm2      1.223 CV     1
 ASSI {   80}
   (( segid "AREF" and resid 65   and name HA  ))
   (  segid "AREF" and resid 66   and name HD1%)
      3.000     3.000     3.000 peak    80 spectrum    2 weight  0.10000E+01 volume  0.58281E-02 ppm1      4.419 ppm2      0.864 CV     1
 OR {   80}
   (( segid "AREF" and resid 65   and name HA  ))
   (  segid "AREF" and resid 66   and name HD2%)
 ASSI {   81}
   (( segid "AREF" and resid 57   and name HA  ))
   (( segid "AREF" and resid 57   and name HD1 ))
      2.900     1.000     1.000 peak    81 spectrum    2 weight  0.10000E+01 volume  0.37825E-02 ppm1      4.415 ppm2      3.630 CV     1
 ASSI {   83}
   (( segid "AREF" and resid 65   and name HA  ))
   (( segid "AREF" and resid 65   and name HD2 ))
      3.300     1.400     1.400 peak    83 spectrum    2 weight  0.10000E+01 volume  0.35714E-02 ppm1      4.409 ppm2      3.788 CV     1
 ASSI {   85}
   (( segid "AREF" and resid 47   and name HA  ))
   (( segid "AREF" and resid 47   and name HB2 ))
      3.100     1.200     1.200 peak    85 spectrum    2 weight  0.10000E+01 volume  0.25325E-02 ppm1      4.410 ppm2      1.905 CV     1
 ASSI {   86}
   (( segid "AREF" and resid 47   and name HA  ))
   (  segid "AREF" and resid 48   and name HB% )
      3.100     1.200     1.200 peak    86 spectrum    2 weight  0.10000E+01 volume  0.45292E-02 ppm1      4.411 ppm2      1.360 CV     1
 ASSI {   87}
   (( segid "AREF" and resid 63   and name HA  ))
   (( segid "AREF" and resid 64   and name HG2 ))
      3.100     1.200     1.200 peak    87 spectrum    2 weight  0.10000E+01 volume  0.51138E-02 ppm1      4.405 ppm2      1.495 CV     1
 OR {   87}
   (( segid "AREF" and resid 63   and name HA  ))
   (( segid "AREF" and resid 64   and name HG1 ))
 ASSI {   98}
   (( segid "AREF" and resid 164  and name HA  ))
   (( segid "AREF" and resid 165  and name HN  ))
      2.200     0.600     0.600 peak    98 spectrum    2 weight  0.10000E+01 volume  0.46753E-02 ppm1      4.096 ppm2      8.488 CV     1
 ASSI {  101}
   (( segid "AREF" and resid 87   and name HA  ))
   (( segid "AREF" and resid 88   and name HN  ))
      2.300     0.600     0.600 peak   101 spectrum    2 weight  0.10000E+01 volume  0.72565E-02 ppm1      4.494 ppm2      8.827 CV     1
 ASSI {  103}
   (( segid "AREF" and resid 85   and name HA  ))
   (( segid "AREF" and resid 85   and name HN  ))
      2.300     0.600     0.600 peak   103 spectrum    2 weight  0.10000E+01 volume  0.87014E-02 ppm1      4.178 ppm2      7.862 CV     1
 ASSI {  104}
   (( segid "AREF" and resid 85   and name HA  ))
   (  segid "AREF" and resid 85   and name HG1%)
      3.000     1.100     1.100 peak   104 spectrum    2 weight  0.10000E+01 volume  0.32468E-02 ppm1      4.174 ppm2      0.908 CV     1
 OR {  104}
   (( segid "AREF" and resid 85   and name HA  ))
   (  segid "AREF" and resid 85   and name HG2%)
 ASSI {  105}
   (( segid "AREF" and resid 85   and name HA  ))
   (( segid "AREF" and resid 86   and name HN  ))
      2.600     0.900     0.900 peak   105 spectrum    2 weight  0.10000E+01 volume  0.38150E-02 ppm1      4.170 ppm2      8.534 CV     1
 ASSI {  108}
   (( segid "AREF" and resid 164  and name HA  ))
   (( segid "AREF" and resid 90   and name HN  ))
      2.900     2.900     3.100 peak   108 spectrum    2 weight  0.10000E+01 volume  0.42046E-02 ppm1      4.114 ppm2      8.507 CV     1
 ASSI {  114}
   (( segid "AREF" and resid 87   and name HA  ))
   (  segid "AREF" and resid 87   and name HG2%)
      2.900     1.000     1.000 peak   114 spectrum    2 weight  0.10000E+01 volume  0.36364E-02 ppm1      4.491 ppm2      1.249 CV     1
 ASSI {  116}
   (( segid "AREF" and resid 5    and name HA  ))
   (  segid "AREF" and resid 5    and name HG2%)
      2.600     0.800     0.800 peak   116 spectrum    2 weight  0.10000E+01 volume  0.53736E-02 ppm1      4.401 ppm2      1.228 CV     1
 ASSI {  118}
   (( segid "AREF" and resid 85   and name HA  ))
   (( segid "AREF" and resid 85   and name HB  ))
      2.600     0.800     0.800 peak   118 spectrum    2 weight  0.10000E+01 volume  0.36202E-02 ppm1      4.176 ppm2      2.090 CV     1
 ASSI {  122}
   (( segid "AREF" and resid 168  and name HA  ))
   (( segid "AREF" and resid 168  and name HG11))
      3.000     1.100     1.100 peak   122 spectrum    2 weight  0.10000E+01 volume  0.39773E-02 ppm1      4.119 ppm2      1.424 CV     1
 ASSI {  123}
   (( segid "AREF" and resid 168  and name HA  ))
   (( segid "AREF" and resid 168  and name HN  ))
      2.400     0.700     0.700 peak   123 spectrum    2 weight  0.10000E+01 volume  0.45455E-02 ppm1      4.108 ppm2      8.084 CV     1
 ASSI {  127}
   (( segid "AREF" and resid 168  and name HA  ))
   (( segid "AREF" and resid 168  and name HB  ))
      2.500     0.800     0.800 peak   127 spectrum    2 weight  0.10000E+01 volume  0.35227E-02 ppm1      4.117 ppm2      1.823 CV     1
 ASSI {  129}
   (( segid "AREF" and resid 168  and name HA  ))
   (( segid "AREF" and resid 169  and name HN  ))
      2.400     0.700     0.700 peak   129 spectrum    2 weight  0.10000E+01 volume  0.38150E-02 ppm1      4.115 ppm2      8.274 CV     1
 ASSI {  131}
   (( segid "AREF" and resid 49   and name HA  ))
   (( segid "AREF" and resid 49   and name HB  ))
      2.500     0.800     0.800 peak   131 spectrum    2 weight  0.10000E+01 volume  0.36364E-02 ppm1      4.136 ppm2      1.824 CV     1
 ASSI {  133}
   (( segid "AREF" and resid 152  and name HA  ))
   (  segid "AREF" and resid 152  and name HG1%)
      2.600     0.800     0.800 peak   133 spectrum    2 weight  0.10000E+01 volume  0.42370E-02 ppm1      4.318 ppm2      1.084 CV     1
 OR {  133}
   (( segid "AREF" and resid 152  and name HA  ))
   (  segid "AREF" and resid 152  and name HG2%)
 ASSI {  141}
   (( segid "AREF" and resid 112  and name HA  ))
   (  segid "AREF" and resid 112  and name HD% )
      2.100     0.600     0.600 peak   141 spectrum    2 weight  0.10000E+01 volume  0.72729E-02 ppm1      4.317 ppm2      7.516 CV     1
 ASSI {  153}
   (( segid "AREF" and resid 144  and name HA  ))
   (  segid "AREF" and resid 143  and name HD2%)
      2.300     0.700     0.700 peak   153 spectrum    2 weight  0.10000E+01 volume  0.52922E-02 ppm1      3.839 ppm2      0.827 CV     1
 ASSI {  156}
   (( segid "AREF" and resid 77   and name HA  ))
   (( segid "AREF" and resid 77   and name HB2 ))
      2.700     0.900     0.900 peak   156 spectrum    2 weight  0.10000E+01 volume  0.32630E-02 ppm1      4.380 ppm2      3.947 CV     1
 OR {  156}
   (( segid "AREF" and resid 77   and name HA  ))
   (( segid "AREF" and resid 77   and name HB1 ))
 ASSI {  166}
   (( segid "AREF" and resid 125  and name HA  ))
   (( segid "AREF" and resid 125  and name HB2 ))
      2.700     0.900     0.900 peak   166 spectrum    2 weight  0.10000E+01 volume  0.46266E-02 ppm1      4.559 ppm2      3.997 CV     1
 OR {  166}
   (( segid "AREF" and resid 125  and name HA  ))
   (( segid "AREF" and resid 125  and name HB1 ))
 ASSI {  172}
   (( segid "AREF" and resid 22   and name HA  ))
   (( segid "AREF" and resid 23   and name HN  ))
      2.300     0.700     0.700 peak   172 spectrum    2 weight  0.10000E+01 volume  0.42208E-02 ppm1      4.488 ppm2      8.413 CV     1
 ASSI {  180}
   (( segid "AREF" and resid 148  and name HA  ))
   (( segid "AREF" and resid 149  and name HN  ))
      2.700     0.900     0.900 peak   180 spectrum    2 weight  0.10000E+01 volume  0.45455E-02 ppm1      3.953 ppm2      7.572 CV     1
 ASSI {  181}
   (( segid "AREF" and resid 75   and name HA  ))
   (( segid "AREF" and resid 76   and name HN  ))
      2.700     0.900     0.900 peak   181 spectrum    2 weight  0.10000E+01 volume  0.39448E-02 ppm1      4.587 ppm2      8.144 CV     1
 ASSI {  183}
   (( segid "AREF" and resid 22   and name HA  ))
   (( segid "AREF" and resid 23   and name HB1 ))
      3.400     1.500     1.500 peak   183 spectrum    2 weight  0.10000E+01 volume  0.57466E-02 ppm1      4.486 ppm2      1.656 CV     1
 OR {  183}
   (( segid "AREF" and resid 22   and name HA  ))
   (( segid "AREF" and resid 23   and name HG  ))
 OR {  183}
   (( segid "AREF" and resid 22   and name HA  ))
   (( segid "AREF" and resid 23   and name HB2 ))
 ASSI {  191}
   (( segid "AREF" and resid 143  and name HA  ))
   (( segid "AREF" and resid 143  and name HB2 ))
      2.000     0.500     0.500 peak   191 spectrum    2 weight  0.10000E+01 volume  0.60878E-02 ppm1      3.808 ppm2      1.667 CV     1
 OR {  191}
   (( segid "AREF" and resid 143  and name HA  ))
   (( segid "AREF" and resid 143  and name HG  ))
 ASSI {  192}
   (( segid "AREF" and resid 143  and name HA  ))
   (  segid "AREF" and resid 143  and name HD2%)
      3.200     1.300     1.300 peak   192 spectrum    2 weight  0.10000E+01 volume  0.43020E-02 ppm1      3.805 ppm2      0.809 CV     1
 OR {  192}
   (( segid "AREF" and resid 143  and name HA  ))
   (  segid "AREF" and resid 143  and name HD1%)
 ASSI {  194}
   (( segid "AREF" and resid 75   and name HA  ))
   (  segid "AREF" and resid 75   and name HD% )
      2.600     0.800     0.800 peak   194 spectrum    2 weight  0.10000E+01 volume  0.39448E-02 ppm1      4.591 ppm2      7.226 CV     1
 ASSI {  195}
   (( segid "AREF" and resid 75   and name HA  ))
   (( segid "AREF" and resid 75   and name HB2 ))
      2.600     0.800     0.800 peak   195 spectrum    2 weight  0.10000E+01 volume  0.34091E-02 ppm1      4.587 ppm2      3.170 CV     1
 ASSI {  198}
   (( segid "AREF" and resid 31   and name HA  ))
   (( segid "AREF" and resid 31   and name HD1 ))
      3.500     1.600     1.600 peak   198 spectrum    2 weight  0.10000E+01 volume  0.43507E-02 ppm1      4.186 ppm2      3.198 CV     1
 OR {  198}
   (( segid "AREF" and resid 31   and name HA  ))
   (( segid "AREF" and resid 31   and name HD2 ))
 ASSI {  199}
   (( segid "AREF" and resid 31   and name HA  ))
   (( segid "AREF" and resid 31   and name HB2 ))
      2.700     0.900     0.900 peak   199 spectrum    2 weight  0.10000E+01 volume  0.26786E-02 ppm1      4.187 ppm2      1.885 CV     1
 ASSI {  201}
   (( segid "AREF" and resid 28   and name HA  ))
   (  segid "AREF" and resid 27   and name HG2%)
      2.800     1.000     1.000 peak   201 spectrum    2 weight  0.10000E+01 volume  0.49673E-02 ppm1      4.134 ppm2      0.874 CV     1
 ASSI {  211}
   (( segid "AREF" and resid 70   and name HA  ))
   (( segid "AREF" and resid 70   and name HB1 ))
      2.800     0.900     0.900 peak   211 spectrum    2 weight  0.10000E+01 volume  0.32630E-02 ppm1      4.639 ppm2      3.249 CV     1
 OR {  211}
   (( segid "AREF" and resid 70   and name HA  ))
   (( segid "AREF" and resid 70   and name HB2 ))
 ASSI {  224}
   (( segid "AREF" and resid 70   and name HA  ))
   (( segid "AREF" and resid 70   and name HD1 ))
      2.800     2.800     3.200 peak   224 spectrum    2 weight  0.10000E+01 volume  0.97563E-02 ppm1      4.638 ppm2      7.228 CV     1
 ASSI {  226}
   (( segid "AREF" and resid 171  and name HA  ))
   (( segid "AREF" and resid 171  and name HN  ))
      2.300     0.700     0.700 peak   226 spectrum    2 weight  0.10000E+01 volume  0.41721E-02 ppm1      4.135 ppm2      8.204 CV     1
 ASSI {  227}
   (( segid "AREF" and resid 171  and name HA  ))
   (( segid "AREF" and resid 171  and name HG1 ))
      2.700     0.900     0.900 peak   227 spectrum    2 weight  0.10000E+01 volume  0.37338E-02 ppm1      4.137 ppm2      2.143 CV     1
 ASSI {  231}
   (( segid "AREF" and resid 83   and name HA  ))
   (( segid "AREF" and resid 84   and name HN  ))
      2.600     0.900     0.900 peak   231 spectrum    2 weight  0.10000E+01 volume  0.40098E-02 ppm1      4.307 ppm2      8.477 CV     1
 ASSI {  232}
   (( segid "AREF" and resid 23   and name HA  ))
   (( segid "AREF" and resid 26   and name HA  ))
      3.600     1.600     1.600 peak   232 spectrum    2 weight  0.10000E+01 volume  0.44643E-02 ppm1      4.227 ppm2      3.927 CV     1
 ASSI {  237}
   (( segid "AREF" and resid 86   and name HA  ))
   (  segid "AREF" and resid 87   and name HG2%)
      2.700     2.700     3.300 peak   237 spectrum    2 weight  0.10000E+01 volume  0.10958E-01 ppm1      4.465 ppm2      1.235 CV     1
 ASSI {  239}
   (( segid "AREF" and resid 38   and name HA  ))
   (( segid "AREF" and resid 37   and name HB1 ))
      2.600     2.600     3.400 peak   239 spectrum    2 weight  0.10000E+01 volume  0.47403E-02 ppm1      4.339 ppm2      2.779 CV     1
 ASSI {  242}
   (( segid "AREF" and resid 83   and name HA  ))
   (( segid "AREF" and resid 83   and name HB2 ))
      2.900     1.000     1.000 peak   242 spectrum    2 weight  0.10000E+01 volume  0.28572E-02 ppm1      4.300 ppm2      2.074 CV     1
 ASSI {  247}
   (( segid "AREF" and resid 117  and name HA  ))
   (( segid "AREF" and resid 118  and name HN  ))
      2.200     0.600     0.600 peak   247 spectrum    2 weight  0.10000E+01 volume  0.52435E-02 ppm1      4.237 ppm2      8.689 CV     1
 ASSI {  249}
   (( segid "AREF" and resid 69   and name HA  ))
   (( segid "AREF" and resid 70   and name HN  ))
      2.400     0.700     0.700 peak   249 spectrum    2 weight  0.10000E+01 volume  0.38799E-02 ppm1      4.172 ppm2      8.008 CV     1
 ASSI {  256}
   (( segid "AREF" and resid 86   and name HA  ))
   (( segid "AREF" and resid 86   and name HG2 ))
      2.500     0.800     0.800 peak   256 spectrum    2 weight  0.10000E+01 volume  0.64449E-02 ppm1      4.445 ppm2      2.332 CV     1
 OR {  256}
   (( segid "AREF" and resid 86   and name HA  ))
   (( segid "AREF" and resid 86   and name HG1 ))
 ASSI {  261}
   (( segid "AREF" and resid 167  and name HA  ))
   (( segid "AREF" and resid 168  and name HG12))
      2.900     2.900     3.100 peak   261 spectrum    2 weight  0.10000E+01 volume  0.44318E-02 ppm1      4.336 ppm2      1.165 CV     1
 ASSI {  265}
   (( segid "AREF" and resid 141  and name HA  ))
   (( segid "AREF" and resid 141  and name HB1 ))
      2.500     0.800     0.800 peak   265 spectrum    2 weight  0.10000E+01 volume  0.48052E-02 ppm1      4.294 ppm2      2.793 CV     1
 ASSI {  266}
   (( segid "AREF" and resid 132  and name HA  ))
   (( segid "AREF" and resid 121  and name HB2 ))
      2.600     0.800     0.800 peak   266 spectrum    2 weight  0.10000E+01 volume  0.34253E-02 ppm1      4.291 ppm2      2.389 CV     1
 ASSI {  267}
   (( segid "AREF" and resid 132  and name HA  ))
   (  segid "AREF" and resid 132  and name HB% )
      2.300     0.700     0.700 peak   267 spectrum    2 weight  0.10000E+01 volume  0.34578E-02 ppm1      4.285 ppm2      0.899 CV     1
 ASSI {  272}
   (( segid "AREF" and resid 117  and name HA  ))
   (( segid "AREF" and resid 135  and name HB2 ))
      3.200     1.300     1.300 peak   272 spectrum    2 weight  0.10000E+01 volume  0.43994E-02 ppm1      4.228 ppm2      2.869 CV     1
 OR {  272}
   (( segid "AREF" and resid 117  and name HA  ))
   (( segid "AREF" and resid 135  and name HB1 ))
 ASSI {  279}
   (( segid "AREF" and resid 24   and name HA  ))
   (( segid "AREF" and resid 27   and name HG11))
      2.900     1.100     1.100 peak   279 spectrum    2 weight  0.10000E+01 volume  0.72888E-02 ppm1      4.445 ppm2      1.259 CV     1
 ASSI {  281}
   (( segid "AREF" and resid 24   and name HA  ))
   (( segid "AREF" and resid 24   and name HN  ))
      2.500     0.800     0.800 peak   281 spectrum    2 weight  0.10000E+01 volume  0.37338E-02 ppm1      4.430 ppm2      8.131 CV     1
 ASSI {  285}
   (( segid "AREF" and resid 167  and name HA  ))
   (  segid "AREF" and resid 168  and name HG2%)
      3.600     1.600     1.600 peak   285 spectrum    2 weight  0.10000E+01 volume  0.31981E-02 ppm1      4.344 ppm2      0.871 CV     1
 OR {  285}
   (( segid "AREF" and resid 167  and name HA  ))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI {  294}
   (( segid "AREF" and resid 21   and name HA  ))
   (( segid "AREF" and resid 18   and name HA  ))
      2.200     2.200     3.800 peak   294 spectrum    2 weight  0.10000E+01 volume  0.81168E-02 ppm1      4.511 ppm2      4.261 CV     1
 ASSI {  295}
   (( segid "AREF" and resid 25   and name HA  ))
   (( segid "AREF" and resid 28   and name HB2 ))
      2.600     0.900     0.900 peak   295 spectrum    2 weight  0.10000E+01 volume  0.32955E-02 ppm1      4.505 ppm2      1.858 CV     1
 OR {  295}
   (( segid "AREF" and resid 25   and name HA  ))
   (( segid "AREF" and resid 28   and name HB1 ))
 ASSI {  305}
   (( segid "AREF" and resid 170  and name HA  ))
   (( segid "AREF" and resid 170  and name HN  ))
      2.600     0.900     0.900 peak   305 spectrum    2 weight  0.10000E+01 volume  0.31006E-02 ppm1      4.214 ppm2      8.116 CV     1
 ASSI {  306}
   (( segid "AREF" and resid 74   and name HA  ))
   (( segid "AREF" and resid 72   and name HB2 ))
      2.000     2.000     4.000 peak   306 spectrum    2 weight  0.10000E+01 volume  0.58117E-02 ppm1      4.209 ppm2      3.040 CV     1
 ASSI {  310}
   (( segid "AREF" and resid 140  and name HA  ))
   (  segid "AREF" and resid 140  and name HB% )
      2.500     0.800     0.800 peak   310 spectrum    2 weight  0.10000E+01 volume  0.37338E-02 ppm1      3.937 ppm2      1.406 CV     1
 ASSI {  313}
   (( segid "AREF" and resid 127  and name HA  ))
   (( segid "AREF" and resid 127  and name HG2 ))
      2.900     1.100     1.100 peak   313 spectrum    2 weight  0.10000E+01 volume  0.35227E-02 ppm1      4.489 ppm2      1.600 CV     1
 OR {  313}
   (( segid "AREF" and resid 127  and name HA  ))
   (( segid "AREF" and resid 127  and name HG1 ))
 ASSI {  314}
   (( segid "AREF" and resid 129  and name HA  ))
   (  segid "AREF" and resid 129  and name HD2%)
      3.200     1.300     1.300 peak   314 spectrum    2 weight  0.10000E+01 volume  0.37987E-02 ppm1      4.402 ppm2      0.924 CV     1
 ASSI {  316}
   (( segid "AREF" and resid 103  and name HA  ))
   (  segid "AREF" and resid 103  and name HB% )
      2.500     0.800     0.800 peak   316 spectrum    2 weight  0.10000E+01 volume  0.42046E-02 ppm1      4.075 ppm2      1.401 CV     1
 ASSI {  318}
   (( segid "AREF" and resid 140  and name HA  ))
   (  segid "AREF" and resid 143  and name HD2%)
      3.000     1.100     1.100 peak   318 spectrum    2 weight  0.10000E+01 volume  0.58604E-02 ppm1      3.925 ppm2      0.831 CV     1
 ASSI {  322}
   (( segid "AREF" and resid 169  and name HA  ))
   (  segid "AREF" and resid 170  and name HD1%)
      3.300     1.400     1.400 peak   322 spectrum    2 weight  0.10000E+01 volume  0.64772E-02 ppm1      4.591 ppm2      0.774 CV     1
 ASSI {  324}
   (( segid "AREF" and resid 68   and name HA  ))
   (( segid "AREF" and resid 69   and name HN  ))
      2.500     0.800     0.800 peak   324 spectrum    2 weight  0.10000E+01 volume  0.40260E-02 ppm1      4.506 ppm2      8.104 CV     1
 ASSI {  325}
   (( segid "AREF" and resid 68   and name HA  ))
   (( segid "AREF" and resid 68   and name HB2 ))
      2.900     1.000     1.000 peak   325 spectrum    2 weight  0.10000E+01 volume  0.28247E-02 ppm1      4.502 ppm2      2.598 CV     1
 OR {  325}
   (( segid "AREF" and resid 68   and name HA  ))
   (( segid "AREF" and resid 68   and name HB1 ))
 ASSI {  326}
   (( segid "AREF" and resid 68   and name HA  ))
   (( segid "AREF" and resid 68   and name HN  ))
      2.300     0.700     0.700 peak   326 spectrum    2 weight  0.10000E+01 volume  0.46266E-02 ppm1      4.496 ppm2      8.281 CV     1
 ASSI {  329}
   (( segid "AREF" and resid 110  and name HA  ))
   (  segid "AREF" and resid 115  and name HD2%)
      3.100     1.200     1.200 peak   329 spectrum    2 weight  0.10000E+01 volume  0.53736E-02 ppm1      4.410 ppm2      0.733 CV     1
 ASSI {  335}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 33   and name HN  ))
      3.000     1.100     1.100 peak   335 spectrum    2 weight  0.10000E+01 volume  0.29546E-02 ppm1      4.624 ppm2      8.166 CV     1
 ASSI {  337}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 33   and name HG1 ))
      2.600     0.800     0.800 peak   337 spectrum    2 weight  0.10000E+01 volume  0.57630E-02 ppm1      4.621 ppm2      2.365 CV     1
 OR {  337}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 33   and name HG2 ))
 ASSI {  338}
   (( segid "AREF" and resid 20   and name HA  ))
   (  segid "AREF" and resid 23   and name HD2%)
      2.900     2.900     3.100 peak   338 spectrum    2 weight  0.10000E+01 volume  0.37013E-02 ppm1      4.616 ppm2      0.854 CV     1
 ASSI {  344}
   (( segid "AREF" and resid 56   and name HA  ))
   (( segid "AREF" and resid 56   and name HB2 ))
      2.200     0.600     0.600 peak   344 spectrum    2 weight  0.10000E+01 volume  0.52271E-02 ppm1      4.663 ppm2      1.884 CV     1
 ASSI {  346}
   (( segid "AREF" and resid 30   and name HA  ))
   (  segid "AREF" and resid 26   and name HG2%)
      3.400     1.400     1.400 peak   346 spectrum    2 weight  0.10000E+01 volume  0.35065E-02 ppm1      4.629 ppm2      0.868 CV     1
 ASSI {  347}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 33   and name HA  ))
      3.200     3.200     2.800 peak   347 spectrum    2 weight  0.10000E+01 volume  0.62662E-02 ppm1      4.626 ppm2      4.259 CV     1
 ASSI {  348}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 31   and name HB2 ))
      3.700     1.700     1.700 peak   348 spectrum    2 weight  0.10000E+01 volume  0.28896E-02 ppm1      4.623 ppm2      1.839 CV     1
 OR {  348}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 31   and name HB1 ))
 ASSI {  350}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 33   and name HB2 ))
      2.400     0.700     0.700 peak   350 spectrum    2 weight  0.10000E+01 volume  0.31981E-02 ppm1      4.617 ppm2      2.006 CV     1
 ASSI {  356}
   (( segid "AREF" and resid 62   and name HA  ))
   (( segid "AREF" and resid 63   and name HD2 ))
      2.300     0.700     0.700 peak   356 spectrum    2 weight  0.10000E+01 volume  0.29221E-02 ppm1      4.570 ppm2      3.618 CV     1
 OR {  356}
   (( segid "AREF" and resid 62   and name HA  ))
   (( segid "AREF" and resid 63   and name HD1 ))
 ASSI {  364}
   (( segid "AREF" and resid 76   and name HA  ))
   (  segid "AREF" and resid 74   and name HD2%)
      1.900     1.900     4.100 peak   364 spectrum    2 weight  0.10000E+01 volume  0.62989E-02 ppm1      4.682 ppm2      0.800 CV     1
 OR {  364}
   (( segid "AREF" and resid 76   and name HA  ))
   (  segid "AREF" and resid 74   and name HD1%)
 ASSI {  365}
   (( segid "AREF" and resid 64   and name HA  ))
   (( segid "AREF" and resid 65   and name HD2 ))
      2.500     0.800     0.800 peak   365 spectrum    2 weight  0.10000E+01 volume  0.28084E-02 ppm1      4.570 ppm2      3.808 CV     1
 ASSI {  367}
   (( segid "AREF" and resid 55   and name HA  ))
   (( segid "AREF" and resid 55   and name HB1 ))
      2.800     1.000     1.000 peak   367 spectrum    2 weight  0.10000E+01 volume  0.30357E-02 ppm1      4.682 ppm2      2.781 CV     1
 OR {  367}
   (( segid "AREF" and resid 55   and name HA  ))
   (( segid "AREF" and resid 55   and name HB2 ))
 ASSI {  368}
   (( segid "AREF" and resid 55   and name HA  ))
   (( segid "AREF" and resid 56   and name HB1 ))
      3.200     3.200     2.800 peak   368 spectrum    2 weight  0.10000E+01 volume  0.50975E-02 ppm1      4.682 ppm2      1.698 CV     1
 ASSI {  373}
   (( segid "AREF" and resid 66   and name HA  ))
   (( segid "AREF" and resid 66   and name HB1 ))
      2.400     0.700     0.700 peak   373 spectrum    2 weight  0.10000E+01 volume  0.34903E-02 ppm1      4.572 ppm2      1.539 CV     1
 OR {  373}
   (( segid "AREF" and resid 66   and name HA  ))
   (( segid "AREF" and resid 66   and name HB2 ))
 ASSI {  374}
   (( segid "AREF" and resid 66   and name HA  ))
   (  segid "AREF" and resid 66   and name HD2%)
      3.400     1.400     1.400 peak   374 spectrum    2 weight  0.10000E+01 volume  0.35552E-02 ppm1      4.572 ppm2      0.884 CV     1
 OR {  374}
   (( segid "AREF" and resid 66   and name HA  ))
   (  segid "AREF" and resid 66   and name HD1%)
 ASSI {  376}
   (( segid "AREF" and resid 16   and name HA  ))
   (( segid "AREF" and resid 17   and name HN  ))
      2.300     0.700     0.700 peak   376 spectrum    2 weight  0.10000E+01 volume  0.49837E-02 ppm1      4.245 ppm2      8.160 CV     1
 ASSI {  381}
   (( segid "AREF" and resid 165  and name HA  ))
   (  segid "AREF" and resid 168  and name HG2%)
      2.500     0.800     0.800 peak   381 spectrum    2 weight  0.10000E+01 volume  0.50165E-02 ppm1      4.419 ppm2      0.858 CV     1
 OR {  381}
   (( segid "AREF" and resid 165  and name HA  ))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI {  382}
   (( segid "AREF" and resid 50   and name HA  ))
   (  segid "AREF" and resid 50   and name HB% )
      2.700     0.900     0.900 peak   382 spectrum    2 weight  0.10000E+01 volume  0.31981E-02 ppm1      4.362 ppm2      1.379 CV     1
 ASSI {  384}
   (( segid "AREF" and resid 48   and name HA  ))
   (  segid "AREF" and resid 49   and name HG2%)
      3.000     1.100     1.100 peak   384 spectrum    2 weight  0.10000E+01 volume  0.10958E-01 ppm1      4.294 ppm2      0.867 CV     1
 OR {  384}
   (( segid "AREF" and resid 48   and name HA  ))
   (  segid "AREF" and resid 49   and name HD1%)
 ASSI {  388}
   (( segid "AREF" and resid 165  and name HA  ))
   (  segid "AREF" and resid 165  and name HB% )
      2.600     0.800     0.800 peak   388 spectrum    2 weight  0.10000E+01 volume  0.32955E-02 ppm1      4.427 ppm2      1.395 CV     1
 ASSI {  390}
   (( segid "AREF" and resid 89   and name HA  ))
   (  segid "AREF" and resid 89   and name HB% )
      2.100     0.600     0.600 peak   390 spectrum    2 weight  0.10000E+01 volume  0.45130E-02 ppm1      4.589 ppm2      1.243 CV     1
 ASSI {  399}
   (( segid "AREF" and resid 59   and name HD2 ))
   (( segid "AREF" and resid 59   and name HA  ))
      2.700     0.900     0.900 peak   399 spectrum    2 weight  0.10000E+01 volume  0.67534E-02 ppm1      3.740 ppm2      4.359 CV     1
 OR {  399}
   (( segid "AREF" and resid 59   and name HD1 ))
   (( segid "AREF" and resid 59   and name HA  ))
 ASSI {  401}
   (( segid "AREF" and resid 58   and name HA  ))
   (( segid "AREF" and resid 59   and name HG2 ))
      3.600     1.600     1.600 peak   401 spectrum    2 weight  0.10000E+01 volume  0.50652E-02 ppm1      4.550 ppm2      1.967 CV     1
 OR {  401}
   (( segid "AREF" and resid 58   and name HA  ))
   (( segid "AREF" and resid 59   and name HG1 ))
 ASSI {  414}
   (( segid "AREF" and resid 63   and name HD1 ))
   (( segid "AREF" and resid 62   and name HB1 ))
      2.800     1.000     1.000 peak   414 spectrum    2 weight  0.10000E+01 volume  0.33929E-02 ppm1      3.628 ppm2      1.697 CV     1
 OR {  414}
   (( segid "AREF" and resid 63   and name HD2 ))
   (( segid "AREF" and resid 62   and name HB1 ))
 ASSI {  418}
   (( segid "AREF" and resid 65   and name HD1 ))
   (( segid "AREF" and resid 66   and name HB2 ))
      3.700     1.700     1.700 peak   418 spectrum    2 weight  0.10000E+01 volume  0.40423E-02 ppm1      3.578 ppm2      1.544 CV     1
 OR {  418}
   (( segid "AREF" and resid 65   and name HD1 ))
   (( segid "AREF" and resid 66   and name HB1 ))
 ASSI {  420}
   (( segid "AREF" and resid 58   and name HA  ))
   (( segid "AREF" and resid 59   and name HD2 ))
      2.200     0.600     0.600 peak   420 spectrum    2 weight  0.10000E+01 volume  0.32792E-02 ppm1      4.544 ppm2      3.743 CV     1
 OR {  420}
   (( segid "AREF" and resid 58   and name HA  ))
   (( segid "AREF" and resid 59   and name HD1 ))
 ASSI {  421}
   (( segid "AREF" and resid 58   and name HA  ))
   (( segid "AREF" and resid 63   and name HD2 ))
      2.600     0.900     0.900 peak   421 spectrum    2 weight  0.10000E+01 volume  0.36526E-02 ppm1      4.545 ppm2      3.614 CV     1
 OR {  421}
   (( segid "AREF" and resid 58   and name HA  ))
   (( segid "AREF" and resid 63   and name HD1 ))
 ASSI {  422}
   (( segid "AREF" and resid 58   and name HA  ))
   (  segid "AREF" and resid 58   and name HB% )
      2.400     0.700     0.700 peak   422 spectrum    2 weight  0.10000E+01 volume  0.34091E-02 ppm1      4.545 ppm2      1.319 CV     1
 ASSI {  423}
   (( segid "AREF" and resid 57   and name HD2 ))
   (  segid "AREF" and resid 58   and name HB% )
      3.200     1.300     1.300 peak   423 spectrum    2 weight  0.10000E+01 volume  0.44481E-02 ppm1      3.752 ppm2      1.330 CV     1
 ASSI {  427}
   (( segid "AREF" and resid 57   and name HD1 ))
   (  segid "AREF" and resid 58   and name HB% )
      3.900     1.900     1.900 peak   427 spectrum    2 weight  0.10000E+01 volume  0.41721E-02 ppm1      3.600 ppm2      1.325 CV     1
 ASSI {  428}
   (( segid "AREF" and resid 65   and name HD1 ))
   (  segid "AREF" and resid 66   and name HD1%)
      3.600     1.600     1.600 peak   428 spectrum    2 weight  0.10000E+01 volume  0.43020E-02 ppm1      3.575 ppm2      0.882 CV     1
 OR {  428}
   (( segid "AREF" and resid 65   and name HD1 ))
   (  segid "AREF" and resid 66   and name HD2%)
 ASSI {  442}
   (( segid "AREF" and resid 151  and name HA2 ))
   (( segid "AREF" and resid 151  and name HA1 ))
      2.000     0.500     0.500 peak   442 spectrum    2 weight  0.10000E+01 volume  0.42857E-02 ppm1      4.249 ppm2      3.631 CV     1
 ASSI {  443}
   (( segid "AREF" and resid 40   and name HA1 ))
   (( segid "AREF" and resid 38   and name HG1 ))
      2.100     2.100     3.900 peak   443 spectrum    2 weight  0.10000E+01 volume  0.41397E-02 ppm1      4.001 ppm2      1.683 CV     1
 OR {  443}
   (( segid "AREF" and resid 40   and name HA2 ))
   (( segid "AREF" and resid 38   and name HG1 ))
 OR {  443}
   (( segid "AREF" and resid 40   and name HA1 ))
   (( segid "AREF" and resid 38   and name HG2 ))
 OR {  443}
   (( segid "AREF" and resid 40   and name HA2 ))
   (( segid "AREF" and resid 38   and name HG2 ))
 ASSI {  444}
   (( segid "AREF" and resid 80   and name HA1 ))
   (  segid "AREF" and resid 75   and name HE% )
      1.900     1.900     4.100 peak   444 spectrum    2 weight  0.10000E+01 volume  0.80845E-02 ppm1      3.980 ppm2      7.273 CV     1
 OR {  444}
   (( segid "AREF" and resid 80   and name HA2 ))
   (  segid "AREF" and resid 75   and name HE% )
 OR {  444}
   (( segid "AREF" and resid 80   and name HA1 ))
   (( segid "AREF" and resid 75   and name HZ  ))
 OR {  444}
   (( segid "AREF" and resid 80   and name HA2 ))
   (( segid "AREF" and resid 75   and name HZ  ))
 ASSI {  445}
   (( segid "AREF" and resid 82   and name HA2 ))
   (  segid "AREF" and resid 85   and name HG2%)
      3.200     1.300     1.300 peak   445 spectrum    2 weight  0.10000E+01 volume  0.35877E-02 ppm1      3.979 ppm2      0.891 CV     1
 OR {  445}
   (( segid "AREF" and resid 82   and name HA2 ))
   (  segid "AREF" and resid 85   and name HG1%)
 OR {  445}
   (( segid "AREF" and resid 82   and name HA1 ))
   (  segid "AREF" and resid 85   and name HG2%)
 OR {  445}
   (( segid "AREF" and resid 82   and name HA1 ))
   (  segid "AREF" and resid 85   and name HG1%)
 ASSI {  446}
   (( segid "AREF" and resid 82   and name HA2 ))
   (( segid "AREF" and resid 85   and name HN  ))
      3.100     3.100     2.900 peak   446 spectrum    2 weight  0.10000E+01 volume  0.36202E-02 ppm1      3.974 ppm2      7.862 CV     1
 OR {  446}
   (( segid "AREF" and resid 82   and name HA1 ))
   (( segid "AREF" and resid 85   and name HN  ))
 ASSI {  447}
   (( segid "AREF" and resid 53   and name HA2 ))
   (( segid "AREF" and resid 54   and name HG1 ))
      3.200     1.300     1.300 peak   447 spectrum    2 weight  0.10000E+01 volume  0.48052E-02 ppm1      3.978 ppm2      1.634 CV     1
 OR {  447}
   (( segid "AREF" and resid 53   and name HA1 ))
   (( segid "AREF" and resid 54   and name HG1 ))
 OR {  447}
   (( segid "AREF" and resid 53   and name HA2 ))
   (( segid "AREF" and resid 54   and name HG2 ))
 OR {  447}
   (( segid "AREF" and resid 53   and name HA1 ))
   (( segid "AREF" and resid 54   and name HG2 ))
 ASSI {  448}
   (( segid "AREF" and resid 11   and name HA2 ))
   (( segid "AREF" and resid 12   and name HB2 ))
      2.900     1.100     1.100 peak   448 spectrum    2 weight  0.10000E+01 volume  0.53249E-02 ppm1      3.967 ppm2      1.827 CV     1
 OR {  448}
   (( segid "AREF" and resid 11   and name HA1 ))
   (( segid "AREF" and resid 12   and name HB2 ))
 ASSI {  453}
   (( segid "AREF" and resid 156  and name HA1 ))
   (( segid "AREF" and resid 156  and name HA2 ))
      2.000     0.500     0.500 peak   453 spectrum    2 weight  0.10000E+01 volume  0.47890E-02 ppm1      3.618 ppm2      4.221 CV     1
 ASSI {  466}
   (( segid "AREF" and resid 82   and name HA2 ))
   (( segid "AREF" and resid 83   and name HG1 ))
      3.600     1.600     1.600 peak   466 spectrum    2 weight  0.10000E+01 volume  0.52435E-02 ppm1      3.980 ppm2      2.299 CV     1
 OR {  466}
   (( segid "AREF" and resid 82   and name HA1 ))
   (( segid "AREF" and resid 83   and name HG1 ))
 OR {  466}
   (( segid "AREF" and resid 82   and name HA2 ))
   (( segid "AREF" and resid 83   and name HG2 ))
 OR {  466}
   (( segid "AREF" and resid 82   and name HA1 ))
   (( segid "AREF" and resid 83   and name HG2 ))
 ASSI {  469}
   (( segid "AREF" and resid 82   and name HA2 ))
   (( segid "AREF" and resid 83   and name HB2 ))
      3.300     1.400     1.400 peak   469 spectrum    2 weight  0.10000E+01 volume  0.42208E-02 ppm1      3.973 ppm2      2.072 CV     1
 OR {  469}
   (( segid "AREF" and resid 82   and name HA1 ))
   (( segid "AREF" and resid 83   and name HB2 ))
 ASSI {  470}
   (( segid "AREF" and resid 82   and name HA1 ))
   (  segid "AREF" and resid 87   and name HG2%)
      2.700     2.700     3.300 peak   470 spectrum    2 weight  0.10000E+01 volume  0.72242E-02 ppm1      3.969 ppm2      1.272 CV     1
 OR {  470}
   (( segid "AREF" and resid 82   and name HA2 ))
   (  segid "AREF" and resid 87   and name HG2%)
 ASSI {  471}
   (( segid "AREF" and resid 11   and name HA2 ))
   (( segid "AREF" and resid 12   and name HN  ))
      2.600     0.800     0.800 peak   471 spectrum    2 weight  0.10000E+01 volume  0.57953E-02 ppm1      3.966 ppm2      8.101 CV     1
 OR {  471}
   (( segid "AREF" and resid 11   and name HA1 ))
   (( segid "AREF" and resid 12   and name HN  ))
 ASSI {  472}
   (( segid "AREF" and resid 52   and name HA2 ))
   (  segid "AREF" and resid 50   and name HB% )
      1.900     1.900     4.100 peak   472 spectrum    2 weight  0.10000E+01 volume  0.72401E-02 ppm1      3.967 ppm2      1.365 CV     1
 OR {  472}
   (( segid "AREF" and resid 52   and name HA1 ))
   (  segid "AREF" and resid 50   and name HB% )
 ASSI {  485}
   (( segid "AREF" and resid 41   and name HA2 ))
   (( segid "AREF" and resid 42   and name HD1 ))
      3.200     1.200     1.200 peak   485 spectrum    2 weight  0.10000E+01 volume  0.30520E-02 ppm1      4.116 ppm2      3.629 CV     1
 OR {  485}
   (( segid "AREF" and resid 41   and name HA1 ))
   (( segid "AREF" and resid 42   and name HD1 ))
 ASSI {  506}
   (( segid "AREF" and resid 56   and name HD2 ))
   (( segid "AREF" and resid 57   and name HD2 ))
      3.900     1.900     1.900 peak   506 spectrum    2 weight  0.10000E+01 volume  0.44968E-02 ppm1      3.207 ppm2      3.701 CV     1
 OR {  506}
   (( segid "AREF" and resid 56   and name HD1 ))
   (( segid "AREF" and resid 57   and name HD2 ))
 ASSI {  507}
   (( segid "AREF" and resid 34   and name HD1 ))
   (( segid "AREF" and resid 34   and name HN  ))
      2.700     0.900     0.900 peak   507 spectrum    2 weight  0.10000E+01 volume  0.48700E-02 ppm1      3.198 ppm2      8.156 CV     1
 OR {  507}
   (( segid "AREF" and resid 34   and name HD2 ))
   (( segid "AREF" and resid 34   and name HN  ))
 ASSI {  511}
   (( segid "AREF" and resid 31   and name HD1 ))
   (( segid "AREF" and resid 28   and name HG1 ))
      2.100     2.100     3.900 peak   511 spectrum    2 weight  0.10000E+01 volume  0.38799E-02 ppm1      3.198 ppm2      1.416 CV     1
 ASSI {  513}
   (( segid "AREF" and resid 31   and name HD2 ))
   (( segid "AREF" and resid 28   and name HA  ))
      2.100     0.600     0.600 peak   513 spectrum    2 weight  0.10000E+01 volume  0.37662E-02 ppm1      3.194 ppm2      4.105 CV     1
 OR {  513}
   (( segid "AREF" and resid 31   and name HD1 ))
   (( segid "AREF" and resid 28   and name HA  ))
 ASSI {  514}
   (( segid "AREF" and resid 31   and name HD1 ))
   (  segid "AREF" and resid 27   and name HG2%)
      2.400     0.700     0.700 peak   514 spectrum    2 weight  0.10000E+01 volume  0.34416E-02 ppm1      3.198 ppm2      0.868 CV     1
 OR {  514}
   (( segid "AREF" and resid 31   and name HD2 ))
   (  segid "AREF" and resid 27   and name HG2%)
 ASSI {  526}
   (( segid "AREF" and resid 31   and name HD1 ))
   (( segid "AREF" and resid 27   and name HA  ))
      2.900     1.100     1.100 peak   526 spectrum    2 weight  0.10000E+01 volume  0.40584E-02 ppm1      3.195 ppm2      3.973 CV     1
 OR {  526}
   (( segid "AREF" and resid 31   and name HD2 ))
   (( segid "AREF" and resid 27   and name HA  ))
 ASSI {  531}
   (( segid "AREF" and resid 144  and name HE1 ))
   (( segid "AREF" and resid 144  and name HD1 ))
      2.600     0.800     0.800 peak   531 spectrum    2 weight  0.10000E+01 volume  0.34416E-02 ppm1      3.094 ppm2      1.661 CV     1
 OR {  531}
   (( segid "AREF" and resid 144  and name HE2 ))
   (( segid "AREF" and resid 144  and name HD2 ))
 OR {  531}
   (( segid "AREF" and resid 144  and name HE2 ))
   (( segid "AREF" and resid 144  and name HD1 ))
 OR {  531}
   (( segid "AREF" and resid 144  and name HE1 ))
   (( segid "AREF" and resid 144  and name HD2 ))
 OR {  531}
   (( segid "AREF" and resid 144  and name HE1 ))
   (( segid "AREF" and resid 144  and name HG1 ))
 ASSI {  534}
   (( segid "AREF" and resid 144  and name HE1 ))
   (( segid "AREF" and resid 144  and name HN  ))
      2.700     2.700     3.300 peak   534 spectrum    2 weight  0.10000E+01 volume  0.53895E-02 ppm1      3.088 ppm2      7.281 CV     1
 ASSI {  535}
   (( segid "AREF" and resid 144  and name HE1 ))
   (( segid "AREF" and resid 141  and name HA  ))
      2.200     2.200     3.800 peak   535 spectrum    2 weight  0.10000E+01 volume  0.75650E-02 ppm1      3.087 ppm2      4.326 CV     1
 ASSI {  537}
   (( segid "AREF" and resid 28   and name HE1 ))
   (( segid "AREF" and resid 28   and name HB1 ))
      3.300     1.400     1.400 peak   537 spectrum    2 weight  0.10000E+01 volume  0.37500E-02 ppm1      2.986 ppm2      1.882 CV     1
 OR {  537}
   (( segid "AREF" and resid 28   and name HE2 ))
   (( segid "AREF" and resid 28   and name HB1 ))
 OR {  537}
   (( segid "AREF" and resid 28   and name HE2 ))
   (( segid "AREF" and resid 28   and name HB2 ))
 OR {  537}
   (( segid "AREF" and resid 28   and name HE1 ))
   (( segid "AREF" and resid 28   and name HB2 ))
 ASSI {  544}
   (( segid "AREF" and resid 64   and name HE1 ))
   (  segid "AREF" and resid 66   and name HD1%)
      2.600     0.800     0.800 peak   544 spectrum    2 weight  0.10000E+01 volume  0.45130E-02 ppm1      2.990 ppm2      0.890 CV     1
 OR {  544}
   (( segid "AREF" and resid 64   and name HE2 ))
   (  segid "AREF" and resid 66   and name HD1%)
 OR {  544}
   (( segid "AREF" and resid 64   and name HE2 ))
   (  segid "AREF" and resid 66   and name HD2%)
 ASSI {  545}
   (( segid "AREF" and resid 28   and name HE2 ))
   (( segid "AREF" and resid 25   and name HA  ))
      1.900     1.900     4.100 peak   545 spectrum    2 weight  0.10000E+01 volume  0.64936E-02 ppm1      2.986 ppm2      4.508 CV     1
 OR {  545}
   (( segid "AREF" and resid 28   and name HE1 ))
   (( segid "AREF" and resid 25   and name HA  ))
 ASSI {  550}
   (( segid "AREF" and resid 147  and name HE2 ))
   (  segid "AREF" and resid 143  and name HD2%)
      2.600     0.900     0.900 peak   550 spectrum    2 weight  0.10000E+01 volume  0.51297E-02 ppm1      2.955 ppm2      0.806 CV     1
 OR {  550}
   (( segid "AREF" and resid 147  and name HE1 ))
   (  segid "AREF" and resid 143  and name HD2%)
 OR {  550}
   (( segid "AREF" and resid 147  and name HE2 ))
   (  segid "AREF" and resid 143  and name HD1%)
 OR {  550}
   (( segid "AREF" and resid 147  and name HE1 ))
   (  segid "AREF" and resid 143  and name HD1%)
 ASSI {  551}
   (( segid "AREF" and resid 147  and name HE1 ))
   (( segid "AREF" and resid 147  and name HA  ))
      3.500     1.600     1.600 peak   551 spectrum    2 weight  0.10000E+01 volume  0.52271E-02 ppm1      2.942 ppm2      3.946 CV     1
 OR {  551}
   (( segid "AREF" and resid 147  and name HE2 ))
   (( segid "AREF" and resid 147  and name HA  ))
 ASSI {  552}
   (( segid "AREF" and resid 147  and name HE1 ))
   (( segid "AREF" and resid 147  and name HB1 ))
      3.000     1.100     1.100 peak   552 spectrum    2 weight  0.10000E+01 volume  0.43344E-02 ppm1      2.943 ppm2      1.867 CV     1
 OR {  552}
   (( segid "AREF" and resid 147  and name HE1 ))
   (( segid "AREF" and resid 147  and name HB2 ))
 OR {  552}
   (( segid "AREF" and resid 147  and name HE2 ))
   (( segid "AREF" and resid 147  and name HB2 ))
 ASSI {  553}
   (( segid "AREF" and resid 147  and name HE2 ))
   (( segid "AREF" and resid 147  and name HD1 ))
      2.400     0.700     0.700 peak   553 spectrum    2 weight  0.10000E+01 volume  0.29870E-02 ppm1      2.944 ppm2      1.661 CV     1
 OR {  553}
   (( segid "AREF" and resid 147  and name HE1 ))
   (( segid "AREF" and resid 147  and name HD1 ))
 OR {  553}
   (( segid "AREF" and resid 147  and name HE2 ))
   (( segid "AREF" and resid 147  and name HD2 ))
 OR {  553}
   (( segid "AREF" and resid 147  and name HE1 ))
   (( segid "AREF" and resid 147  and name HD2 ))
 ASSI {  554}
   (( segid "AREF" and resid 147  and name HE1 ))
   (( segid "AREF" and resid 147  and name HG2 ))
      2.500     0.800     0.800 peak   554 spectrum    2 weight  0.10000E+01 volume  0.33117E-02 ppm1      2.944 ppm2      1.449 CV     1
 OR {  554}
   (( segid "AREF" and resid 147  and name HE2 ))
   (( segid "AREF" and resid 147  and name HG2 ))
 OR {  554}
   (( segid "AREF" and resid 147  and name HE1 ))
   (( segid "AREF" and resid 147  and name HG1 ))
 OR {  554}
   (( segid "AREF" and resid 147  and name HE2 ))
   (( segid "AREF" and resid 147  and name HG1 ))
 ASSI {  555}
   (( segid "AREF" and resid 147  and name HE2 ))
   (  segid "AREF" and resid 143  and name HD2%)
      2.600     0.800     0.800 peak   555 spectrum    2 weight  0.10000E+01 volume  0.49187E-02 ppm1      2.940 ppm2      0.835 CV     1
 OR {  555}
   (( segid "AREF" and resid 147  and name HE1 ))
   (  segid "AREF" and resid 143  and name HD2%)
 ASSI {  556}
   (( segid "AREF" and resid 69   and name HE2 ))
   (( segid "AREF" and resid 69   and name HD1 ))
      2.600     0.800     0.800 peak   556 spectrum    2 weight  0.10000E+01 volume  0.33279E-02 ppm1      2.870 ppm2      1.579 CV     1
 OR {  556}
   (( segid "AREF" and resid 69   and name HE1 ))
   (( segid "AREF" and resid 69   and name HD2 ))
 OR {  556}
   (( segid "AREF" and resid 69   and name HE2 ))
   (( segid "AREF" and resid 69   and name HD2 ))
 OR {  556}
   (( segid "AREF" and resid 69   and name HE1 ))
   (( segid "AREF" and resid 69   and name HD1 ))
 ASSI {  564}
   (( segid "AREF" and resid 13   and name HB2 ))
   (( segid "AREF" and resid 17   and name HN  ))
      2.900     2.900     3.100 peak   564 spectrum    2 weight  0.10000E+01 volume  0.76300E-02 ppm1      2.779 ppm2      8.144 CV     1
 ASSI {  570}
   (( segid "AREF" and resid 20   and name HB2 ))
   (( segid "AREF" and resid 21   and name HN  ))
      2.500     0.800     0.800 peak   570 spectrum    2 weight  0.10000E+01 volume  0.38799E-02 ppm1      2.742 ppm2      8.148 CV     1
 ASSI {  571}
   (( segid "AREF" and resid 20   and name HB2 ))
   (  segid "AREF" and resid 26   and name HD1%)
      3.100     1.200     1.200 peak   571 spectrum    2 weight  0.10000E+01 volume  0.42046E-02 ppm1      2.740 ppm2      0.850 CV     1
 ASSI {  575}
   (( segid "AREF" and resid 25   and name HB2 ))
   (( segid "AREF" and resid 28   and name HG1 ))
      3.200     3.200     2.800 peak   575 spectrum    2 weight  0.10000E+01 volume  0.68021E-02 ppm1      2.722 ppm2      1.409 CV     1
 OR {  575}
   (( segid "AREF" and resid 25   and name HB1 ))
   (( segid "AREF" and resid 28   and name HG1 ))
 ASSI {  594}
   (( segid "AREF" and resid 75   and name HB2 ))
   (( segid "AREF" and resid 75   and name HN  ))
      2.100     0.600     0.600 peak   594 spectrum    2 weight  0.10000E+01 volume  0.54059E-02 ppm1      3.157 ppm2      8.070 CV     1
 ASSI {  597}
   (( segid "AREF" and resid 75   and name HB1 ))
   (( segid "AREF" and resid 75   and name HN  ))
      2.700     0.900     0.900 peak   597 spectrum    2 weight  0.10000E+01 volume  0.44643E-02 ppm1      2.991 ppm2      8.086 CV     1
 ASSI {  598}
   (( segid "AREF" and resid 75   and name HB1 ))
   (( segid "AREF" and resid 75   and name HB2 ))
      2.000     0.500     0.500 peak   598 spectrum    2 weight  0.10000E+01 volume  0.26624E-02 ppm1      2.992 ppm2      3.164 CV     1
 ASSI {  599}
   (( segid "AREF" and resid 75   and name HB1 ))
   (  segid "AREF" and resid 75   and name HD% )
      2.500     0.800     0.800 peak   599 spectrum    2 weight  0.10000E+01 volume  0.43344E-02 ppm1      2.987 ppm2      7.218 CV     1
 ASSI {  601}
   (( segid "AREF" and resid 75   and name HB1 ))
   (( segid "AREF" and resid 75   and name HA  ))
      2.800     1.000     1.000 peak   601 spectrum    2 weight  0.10000E+01 volume  0.38961E-02 ppm1      2.990 ppm2      4.582 CV     1
 ASSI {  607}
   (( segid "AREF" and resid 60   and name HB2 ))
   (( segid "AREF" and resid 60   and name HN  ))
      2.500     0.800     0.800 peak   607 spectrum    2 weight  0.10000E+01 volume  0.72079E-02 ppm1      3.022 ppm2      8.040 CV     1
 OR {  607}
   (( segid "AREF" and resid 60   and name HB1 ))
   (( segid "AREF" and resid 60   and name HN  ))
 ASSI {  608}
   (( segid "AREF" and resid 60   and name HB2 ))
   (  segid "AREF" and resid 60   and name HD% )
      2.700     0.900     0.900 peak   608 spectrum    2 weight  0.10000E+01 volume  0.34416E-02 ppm1      3.026 ppm2      7.110 CV     1
 OR {  608}
   (( segid "AREF" and resid 60   and name HB1 ))
   (  segid "AREF" and resid 60   and name HD% )
 ASSI {  609}
   (( segid "AREF" and resid 60   and name HB2 ))
   (( segid "AREF" and resid 60   and name HA  ))
      2.700     0.900     0.900 peak   609 spectrum    2 weight  0.10000E+01 volume  0.33766E-02 ppm1      3.020 ppm2      4.554 CV     1
 OR {  609}
   (( segid "AREF" and resid 60   and name HB1 ))
   (( segid "AREF" and resid 60   and name HA  ))
 ASSI {  611}
   (( segid "AREF" and resid 37   and name HB2 ))
   (  segid "AREF" and resid 36   and name HG1%)
      3.100     3.100     2.900 peak   611 spectrum    2 weight  0.10000E+01 volume  0.67534E-02 ppm1      2.873 ppm2      0.891 CV     1
 OR {  611}
   (( segid "AREF" and resid 37   and name HB2 ))
   (  segid "AREF" and resid 36   and name HG2%)
 ASSI {  613}
   (( segid "AREF" and resid 60   and name HB2 ))
   (  segid "AREF" and resid 60   and name HE% )
      3.200     1.300     1.300 peak   613 spectrum    2 weight  0.10000E+01 volume  0.10941E-01 ppm1      3.017 ppm2      6.822 CV     1
 OR {  613}
   (( segid "AREF" and resid 60   and name HB1 ))
   (  segid "AREF" and resid 60   and name HE% )
 ASSI {  627}
   (( segid "AREF" and resid 70   and name HB1 ))
   (( segid "AREF" and resid 70   and name HN  ))
      2.700     0.900     0.900 peak   627 spectrum    2 weight  0.10000E+01 volume  0.67857E-02 ppm1      3.211 ppm2      7.995 CV     1
 ASSI {  628}
   (( segid "AREF" and resid 70   and name HB2 ))
   (( segid "AREF" and resid 70   and name HA  ))
      2.800     1.000     1.000 peak   628 spectrum    2 weight  0.10000E+01 volume  0.38636E-02 ppm1      3.279 ppm2      4.647 CV     1
 ASSI {  631}
   (( segid "AREF" and resid 70   and name HB1 ))
   (( segid "AREF" and resid 70   and name HA  ))
      2.600     0.800     0.800 peak   631 spectrum    2 weight  0.10000E+01 volume  0.39286E-02 ppm1      3.215 ppm2      4.644 CV     1
 ASSI {  633}
   (( segid "AREF" and resid 70   and name HB1 ))
   (( segid "AREF" and resid 70   and name HD1 ))
      2.700     0.900     0.900 peak   633 spectrum    2 weight  0.10000E+01 volume  0.81655E-02 ppm1      3.218 ppm2      7.203 CV     1
 ASSI {  642}
   (( segid "AREF" and resid 79   and name HB1 ))
   (( segid "AREF" and resid 79   and name HA  ))
      2.700     0.900     0.900 peak   642 spectrum    2 weight  0.10000E+01 volume  0.37987E-02 ppm1      2.947 ppm2      4.548 CV     1
 OR {  642}
   (( segid "AREF" and resid 79   and name HB2 ))
   (( segid "AREF" and resid 79   and name HA  ))
 ASSI {  643}
   (( segid "AREF" and resid 79   and name HB2 ))
   (( segid "AREF" and resid 80   and name HA2 ))
      2.900     1.000     1.000 peak   643 spectrum    2 weight  0.10000E+01 volume  0.76787E-02 ppm1      2.945 ppm2      3.982 CV     1
 OR {  643}
   (( segid "AREF" and resid 79   and name HB2 ))
   (( segid "AREF" and resid 80   and name HA1 ))
 OR {  643}
   (( segid "AREF" and resid 79   and name HB1 ))
   (( segid "AREF" and resid 80   and name HA2 ))
 OR {  643}
   (( segid "AREF" and resid 79   and name HB1 ))
   (( segid "AREF" and resid 80   and name HA1 ))
 ASSI {  664}
   (( segid "AREF" and resid 73   and name HB2 ))
   (( segid "AREF" and resid 74   and name HB1 ))
      3.800     1.800     1.800 peak   664 spectrum    2 weight  0.10000E+01 volume  0.31656E-02 ppm1      2.625 ppm2      1.353 CV     1
 OR {  664}
   (( segid "AREF" and resid 73   and name HB1 ))
   (( segid "AREF" and resid 74   and name HB1 ))
 ASSI {  665}
   (( segid "AREF" and resid 20   and name HB1 ))
   (  segid "AREF" and resid 26   and name HD1%)
      2.400     0.700     0.700 peak   665 spectrum    2 weight  0.10000E+01 volume  0.31006E-02 ppm1      2.623 ppm2      0.870 CV     1
 ASSI {  668}
   (( segid "AREF" and resid 13   and name HB1 ))
   (( segid "AREF" and resid 13   and name HB2 ))
      2.000     0.500     0.500 peak   668 spectrum    2 weight  0.10000E+01 volume  0.31981E-02 ppm1      2.568 ppm2      2.782 CV     1
 ASSI {  671}
   (( segid "AREF" and resid 169  and name HB1 ))
   (( segid "AREF" and resid 170  and name HG  ))
      3.200     1.300     1.300 peak   671 spectrum    2 weight  0.10000E+01 volume  0.43020E-02 ppm1      2.631 ppm2      1.599 CV     1
 OR {  671}
   (( segid "AREF" and resid 169  and name HB1 ))
   (( segid "AREF" and resid 170  and name HB2 ))
 ASSI {  675}
   (( segid "AREF" and resid 24   and name HB2 ))
   (  segid "AREF" and resid 27   and name HD1%)
      3.500     1.500     1.500 peak   675 spectrum    2 weight  0.10000E+01 volume  0.58440E-02 ppm1      2.569 ppm2      0.855 CV     1
 OR {  675}
   (( segid "AREF" and resid 24   and name HB1 ))
   (  segid "AREF" and resid 27   and name HD1%)
 ASSI {  677}
   (( segid "AREF" and resid 76   and name HB2 ))
   (( segid "AREF" and resid 79   and name HA  ))
      3.200     1.300     1.300 peak   677 spectrum    2 weight  0.10000E+01 volume  0.36202E-02 ppm1      2.682 ppm2      4.512 CV     1
 ASSI {  678}
   (( segid "AREF" and resid 76   and name HB2 ))
   (( segid "AREF" and resid 79   and name HB2 ))
      2.500     0.800     0.800 peak   678 spectrum    2 weight  0.10000E+01 volume  0.59741E-02 ppm1      2.682 ppm2      2.938 CV     1
 OR {  678}
   (( segid "AREF" and resid 76   and name HB2 ))
   (( segid "AREF" and resid 79   and name HB1 ))
 ASSI {  679}
   (( segid "AREF" and resid 17   and name HB2 ))
   (  segid "AREF" and resid 15   and name HE% )
      2.300     0.600     0.600 peak   679 spectrum    2 weight  0.10000E+01 volume  0.87014E-02 ppm1      2.682 ppm2      2.088 CV     1
 ASSI {  680}
   (( segid "AREF" and resid 17   and name HB2 ))
   (  segid "AREF" and resid 23   and name HD2%)
      3.100     3.100     2.900 peak   680 spectrum    2 weight  0.10000E+01 volume  0.31169E-02 ppm1      2.682 ppm2      0.891 CV     1
 ASSI {  683}
   (( segid "AREF" and resid 17   and name HB1 ))
   (( segid "AREF" and resid 18   and name HB2 ))
      2.900     2.900     3.100 peak   683 spectrum    2 weight  0.10000E+01 volume  0.86691E-02 ppm1      2.609 ppm2      1.841 CV     1
 ASSI {  701}
   (( segid "AREF" and resid 86   and name HG1 ))
   (( segid "AREF" and resid 86   and name HB2 ))
      2.700     0.900     0.900 peak   701 spectrum    2 weight  0.10000E+01 volume  0.31818E-02 ppm1      2.318 ppm2      2.090 CV     1
 OR {  701}
   (( segid "AREF" and resid 86   and name HG2 ))
   (( segid "AREF" and resid 86   and name HB1 ))
 OR {  701}
   (( segid "AREF" and resid 86   and name HG1 ))
   (( segid "AREF" and resid 86   and name HB1 ))
 OR {  701}
   (( segid "AREF" and resid 86   and name HG2 ))
   (( segid "AREF" and resid 86   and name HB2 ))
 ASSI {  703}
   (( segid "AREF" and resid 171  and name HG1 ))
   (( segid "AREF" and resid 171  and name HN  ))
      2.300     0.700     0.700 peak   703 spectrum    2 weight  0.10000E+01 volume  0.58926E-02 ppm1      2.122 ppm2      8.225 CV     1
 ASSI {  708}
   (( segid "AREF" and resid 86   and name HG2 ))
   (( segid "AREF" and resid 82   and name HA2 ))
      2.100     2.100     3.900 peak   708 spectrum    2 weight  0.10000E+01 volume  0.42046E-02 ppm1      2.305 ppm2      3.998 CV     1
 OR {  708}
   (( segid "AREF" and resid 86   and name HG2 ))
   (( segid "AREF" and resid 82   and name HA1 ))
 OR {  708}
   (( segid "AREF" and resid 86   and name HG1 ))
   (( segid "AREF" and resid 82   and name HA2 ))
 OR {  708}
   (( segid "AREF" and resid 86   and name HG1 ))
   (( segid "AREF" and resid 82   and name HA1 ))
 ASSI {  710}
   (( segid "AREF" and resid 83   and name HG2 ))
   (( segid "AREF" and resid 83   and name HA  ))
      2.700     0.900     0.900 peak   710 spectrum    2 weight  0.10000E+01 volume  0.41072E-02 ppm1      2.277 ppm2      4.301 CV     1
 OR {  710}
   (( segid "AREF" and resid 83   and name HG1 ))
   (( segid "AREF" and resid 83   and name HA  ))
 ASSI {  711}
   (( segid "AREF" and resid 83   and name HG1 ))
   (( segid "AREF" and resid 82   and name HA2 ))
      2.100     2.100     3.900 peak   711 spectrum    2 weight  0.10000E+01 volume  0.39935E-02 ppm1      2.280 ppm2      3.986 CV     1
 OR {  711}
   (( segid "AREF" and resid 83   and name HG1 ))
   (( segid "AREF" and resid 82   and name HA1 ))
 OR {  711}
   (( segid "AREF" and resid 83   and name HG2 ))
   (( segid "AREF" and resid 82   and name HA2 ))
 ASSI {  712}
   (( segid "AREF" and resid 83   and name HG2 ))
   (( segid "AREF" and resid 83   and name HB2 ))
      2.700     0.900     0.900 peak   712 spectrum    2 weight  0.10000E+01 volume  0.30520E-02 ppm1      2.275 ppm2      2.058 CV     1
 OR {  712}
   (( segid "AREF" and resid 83   and name HG1 ))
   (( segid "AREF" and resid 83   and name HB2 ))
 ASSI {  714}
   (( segid "AREF" and resid 171  and name HG2 ))
   (( segid "AREF" and resid 171  and name HB2 ))
      2.700     0.900     0.900 peak   714 spectrum    2 weight  0.10000E+01 volume  0.33279E-02 ppm1      2.207 ppm2      1.892 CV     1
 OR {  714}
   (( segid "AREF" and resid 171  and name HG2 ))
   (( segid "AREF" and resid 171  and name HB1 ))
 ASSI {  715}
   (( segid "AREF" and resid 171  and name HG2 ))
   (( segid "AREF" and resid 171  and name HA  ))
      2.400     0.700     0.700 peak   715 spectrum    2 weight  0.10000E+01 volume  0.53085E-02 ppm1      2.201 ppm2      4.128 CV     1
 ASSI {  717}
   (( segid "AREF" and resid 171  and name HG1 ))
   (( segid "AREF" and resid 171  and name HG2 ))
      2.100     0.600     0.600 peak   717 spectrum    2 weight  0.10000E+01 volume  0.23701E-02 ppm1      2.123 ppm2      2.184 CV     1
 ASSI {  735}
   (( segid "AREF" and resid 159  and name HG2 ))
   (  segid "AREF" and resid 161  and name HD1%)
      2.200     0.600     0.600 peak   735 spectrum    2 weight  0.10000E+01 volume  0.49673E-02 ppm1      2.403 ppm2      0.734 CV     1
 OR {  735}
   (( segid "AREF" and resid 159  and name HG1 ))
   (  segid "AREF" and resid 161  and name HD1%)
 ASSI {  739}
   (( segid "AREF" and resid 159  and name HG2 ))
   (  segid "AREF" and resid 149  and name HD% )
      2.300     2.300     3.700 peak   739 spectrum    2 weight  0.10000E+01 volume  0.87178E-02 ppm1      2.413 ppm2      6.800 CV     1
 OR {  739}
   (( segid "AREF" and resid 159  and name HG1 ))
   (  segid "AREF" and resid 149  and name HD% )
 ASSI {  741}
   (( segid "AREF" and resid 159  and name HG1 ))
   (( segid "AREF" and resid 159  and name HA  ))
      3.200     1.300     1.300 peak   741 spectrum    2 weight  0.10000E+01 volume  0.38150E-02 ppm1      2.405 ppm2      4.292 CV     1
 OR {  741}
   (( segid "AREF" and resid 159  and name HG2 ))
   (( segid "AREF" and resid 159  and name HA  ))
 ASSI {  743}
   (( segid "AREF" and resid 159  and name HG2 ))
   (  segid "AREF" and resid 161  and name HG2%)
      2.500     0.800     0.800 peak   743 spectrum    2 weight  0.10000E+01 volume  0.68185E-02 ppm1      2.391 ppm2      0.894 CV     1
 OR {  743}
   (( segid "AREF" and resid 159  and name HG1 ))
   (  segid "AREF" and resid 161  and name HG2%)
 ASSI {  754}
   (( segid "AREF" and resid 162  and name HG2 ))
   (( segid "AREF" and resid 92   and name HB1 ))
      1.900     1.900     4.100 peak   754 spectrum    2 weight  0.10000E+01 volume  0.59577E-02 ppm1      2.279 ppm2      1.440 CV     1
 OR {  754}
   (( segid "AREF" and resid 162  and name HG1 ))
   (( segid "AREF" and resid 92   and name HB1 ))
 ASSI {  756}
   (( segid "AREF" and resid 21   and name HB2 ))
   (( segid "AREF" and resid 21   and name HA  ))
      2.600     0.800     0.800 peak   756 spectrum    2 weight  0.10000E+01 volume  0.44643E-02 ppm1      2.135 ppm2      4.519 CV     1
 ASSI {  759}
   (( segid "AREF" and resid 10   and name HB2 ))
   (( segid "AREF" and resid 10   and name HA  ))
      2.600     0.900     0.900 peak   759 spectrum    2 weight  0.10000E+01 volume  0.56170E-02 ppm1      2.118 ppm2      4.468 CV     1
 ASSI {  766}
   (( segid "AREF" and resid 152  and name HB  ))
   (  segid "AREF" and resid 152  and name HG2%)
      2.400     0.700     0.700 peak   766 spectrum    2 weight  0.10000E+01 volume  0.46266E-02 ppm1      2.374 ppm2      1.076 CV     1
 OR {  766}
   (( segid "AREF" and resid 152  and name HB  ))
   (  segid "AREF" and resid 152  and name HG1%)
 ASSI {  775}
   (( segid "AREF" and resid 10   and name HB2 ))
   (( segid "AREF" and resid 10   and name HG1 ))
      2.500     0.800     0.800 peak   775 spectrum    2 weight  0.10000E+01 volume  0.42370E-02 ppm1      2.118 ppm2      2.582 CV     1
 OR {  775}
   (( segid "AREF" and resid 10   and name HB2 ))
   (( segid "AREF" and resid 10   and name HG2 ))
 ASSI {  776}
   (( segid "AREF" and resid 21   and name HG2 ))
   (( segid "AREF" and resid 21   and name HA  ))
      2.400     0.700     0.700 peak   776 spectrum    2 weight  0.10000E+01 volume  0.48052E-02 ppm1      2.611 ppm2      4.525 CV     1
 ASSI {  777}
   (( segid "AREF" and resid 21   and name HG1 ))
   (( segid "AREF" and resid 21   and name HA  ))
      2.700     0.900     0.900 peak   777 spectrum    2 weight  0.10000E+01 volume  0.46429E-02 ppm1      2.552 ppm2      4.527 CV     1
 ASSI {  779}
   (( segid "AREF" and resid 42   and name HB1 ))
   (( segid "AREF" and resid 42   and name HD1 ))
      3.000     1.100     1.100 peak   779 spectrum    2 weight  0.10000E+01 volume  0.33442E-02 ppm1      2.275 ppm2      3.615 CV     1
 ASSI {  781}
   (( segid "AREF" and resid 47   and name HB1 ))
   (( segid "AREF" and resid 47   and name HB2 ))
      2.100     0.500     0.500 peak   781 spectrum    2 weight  0.10000E+01 volume  0.20455E-02 ppm1      2.272 ppm2      1.910 CV     1
 ASSI {  783}
   (( segid "AREF" and resid 42   and name HB1 ))
   (( segid "AREF" and resid 42   and name HD2 ))
      3.500     1.600     1.600 peak   783 spectrum    2 weight  0.10000E+01 volume  0.32955E-02 ppm1      2.267 ppm2      3.802 CV     1
 ASSI {  813}
   (( segid "AREF" and resid 106  and name HB1 ))
   (  segid "AREF" and resid 110  and name HB% )
      3.100     3.100     2.900 peak   813 spectrum    2 weight  0.10000E+01 volume  0.72242E-02 ppm1      2.134 ppm2      1.588 CV     1
 OR {  813}
   (( segid "AREF" and resid 106  and name HB2 ))
   (  segid "AREF" and resid 110  and name HB% )
 ASSI {  827}
   (( segid "AREF" and resid 92   and name HB2 ))
   (( segid "AREF" and resid 92   and name HB1 ))
      1.700     0.400     0.500 peak   827 spectrum    2 weight  0.10000E+01 volume  0.32468E-02 ppm1      1.662 ppm2      1.428 CV     1
 ASSI {  828}
   (( segid "AREF" and resid 92   and name HB1 ))
   (( segid "AREF" and resid 92   and name HG  ))
      2.600     0.900     0.900 peak   828 spectrum    2 weight  0.10000E+01 volume  0.34578E-02 ppm1      1.416 ppm2      1.598 CV     1
 ASSI {  829}
   (( segid "AREF" and resid 92   and name HB1 ))
   (  segid "AREF" and resid 92   and name HD2%)
      2.600     0.900     0.900 peak   829 spectrum    2 weight  0.10000E+01 volume  0.32955E-02 ppm1      1.408 ppm2      0.822 CV     1
 OR {  829}
   (( segid "AREF" and resid 92   and name HB1 ))
   (  segid "AREF" and resid 92   and name HD1%)
 ASSI {  832}
   (( segid "AREF" and resid 163  and name HB2 ))
   (( segid "AREF" and resid 163  and name HA  ))
      2.400     0.700     0.700 peak   832 spectrum    2 weight  0.10000E+01 volume  0.46591E-02 ppm1      1.673 ppm2      4.746 CV     1
 ASSI {  840}
   (( segid "AREF" and resid 170  and name HB2 ))
   (  segid "AREF" and resid 168  and name HG2%)
      2.300     2.300     3.700 peak   840 spectrum    2 weight  0.10000E+01 volume  0.23701E-02 ppm1      1.622 ppm2      0.865 CV     1
 OR {  840}
   (( segid "AREF" and resid 170  and name HB2 ))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI {  844}
   (( segid "AREF" and resid 170  and name HB1 ))
   (( segid "AREF" and resid 170  and name HA  ))
      2.400     0.700     0.700 peak   844 spectrum    2 weight  0.10000E+01 volume  0.40423E-02 ppm1      1.541 ppm2      4.218 CV     1
 ASSI {  846}
   (( segid "AREF" and resid 74   and name HB2 ))
   (  segid "AREF" and resid 74   and name HD2%)
      2.900     1.000     1.000 peak   846 spectrum    2 weight  0.10000E+01 volume  0.34416E-02 ppm1      1.472 ppm2      0.817 CV     1
 ASSI {  847}
   (( segid "AREF" and resid 74   and name HB2 ))
   (( segid "AREF" and resid 74   and name HA  ))
      2.700     0.900     0.900 peak   847 spectrum    2 weight  0.10000E+01 volume  0.41558E-02 ppm1      1.469 ppm2      4.211 CV     1
 ASSI {  848}
   (( segid "AREF" and resid 74   and name HB2 ))
   (( segid "AREF" and resid 75   and name HN  ))
      2.000     0.500     0.500 peak   848 spectrum    2 weight  0.10000E+01 volume  0.47890E-02 ppm1      1.464 ppm2      8.058 CV     1
 ASSI {  850}
   (( segid "AREF" and resid 74   and name HB1 ))
   (( segid "AREF" and resid 74   and name HA  ))
      2.300     0.700     0.700 peak   850 spectrum    2 weight  0.10000E+01 volume  0.43182E-02 ppm1      1.382 ppm2      4.209 CV     1
 ASSI {  851}
   (( segid "AREF" and resid 74   and name HB1 ))
   (( segid "AREF" and resid 74   and name HB2 ))
      2.000     0.500     0.500 peak   851 spectrum    2 weight  0.10000E+01 volume  0.25000E-02 ppm1      1.378 ppm2      1.431 CV     1
 OR {  851}
   (( segid "AREF" and resid 74   and name HB1 ))
   (( segid "AREF" and resid 74   and name HG  ))
 ASSI {  858}
   (( segid "AREF" and resid 29   and name HB2 ))
   (( segid "AREF" and resid 29   and name HN  ))
      2.100     0.600     0.600 peak   858 spectrum    2 weight  0.10000E+01 volume  0.55196E-02 ppm1      1.641 ppm2      7.962 CV     1
 OR {  858}
   (( segid "AREF" and resid 29   and name HB1 ))
   (( segid "AREF" and resid 29   and name HN  ))
 ASSI {  860}
   (( segid "AREF" and resid 170  and name HB2 ))
   (( segid "AREF" and resid 171  and name HN  ))
      2.100     0.600     0.600 peak   860 spectrum    2 weight  0.10000E+01 volume  0.41558E-02 ppm1      1.595 ppm2      8.212 CV     1
 ASSI {  864}
   (( segid "AREF" and resid 170  and name HB1 ))
   (( segid "AREF" and resid 171  and name HN  ))
      2.900     1.000     1.000 peak   864 spectrum    2 weight  0.10000E+01 volume  0.42695E-02 ppm1      1.538 ppm2      8.191 CV     1
 ASSI {  865}
   (( segid "AREF" and resid 74   and name HB1 ))
   (( segid "AREF" and resid 75   and name HN  ))
      2.200     0.600     0.600 peak   865 spectrum    2 weight  0.10000E+01 volume  0.55032E-02 ppm1      1.380 ppm2      8.066 CV     1
 ASSI {  866}
   (( segid "AREF" and resid 23   and name HB1 ))
   (( segid "AREF" and resid 23   and name HN  ))
      2.300     0.600     0.600 peak   866 spectrum    2 weight  0.10000E+01 volume  0.54869E-02 ppm1      1.652 ppm2      8.386 CV     1
 OR {  866}
   (( segid "AREF" and resid 23   and name HB2 ))
   (( segid "AREF" and resid 23   and name HN  ))
 ASSI {  868}
   (( segid "AREF" and resid 66   and name HB2 ))
   (( segid "AREF" and resid 66   and name HN  ))
      2.700     0.900     0.900 peak   868 spectrum    2 weight  0.10000E+01 volume  0.39124E-02 ppm1      1.577 ppm2      8.233 CV     1
 ASSI {  869}
   (( segid "AREF" and resid 66   and name HB2 ))
   (( segid "AREF" and resid 66   and name HA  ))
      2.400     0.700     0.700 peak   869 spectrum    2 weight  0.10000E+01 volume  0.46104E-02 ppm1      1.568 ppm2      4.577 CV     1
 ASSI {  871}
   (( segid "AREF" and resid 66   and name HB1 ))
   (( segid "AREF" and resid 66   and name HA  ))
      2.200     0.600     0.600 peak   871 spectrum    2 weight  0.10000E+01 volume  0.42370E-02 ppm1      1.526 ppm2      4.578 CV     1
 ASSI {  872}
   (( segid "AREF" and resid 143  and name HB1 ))
   (( segid "AREF" and resid 143  and name HB2 ))
      1.600     0.300     0.600 peak   872 spectrum    2 weight  0.10000E+01 volume  0.63312E-02 ppm1      1.451 ppm2      1.682 CV     1
 OR {  872}
   (( segid "AREF" and resid 143  and name HB1 ))
   (( segid "AREF" and resid 143  and name HG  ))
 ASSI {  877}
   (( segid "AREF" and resid 168  and name HB  ))
   (( segid "AREF" and resid 168  and name HN  ))
      3.000     1.200     1.200 peak   877 spectrum    2 weight  0.10000E+01 volume  0.43020E-02 ppm1      1.810 ppm2      8.062 CV     1
 ASSI {  880}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 26   and name HG11))
      2.100     0.600     0.600 peak   880 spectrum    2 weight  0.10000E+01 volume  0.46266E-02 ppm1      1.987 ppm2      1.608 CV     1
 ASSI {  881}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 26   and name HG12))
      2.400     0.700     0.700 peak   881 spectrum    2 weight  0.10000E+01 volume  0.64122E-02 ppm1      1.981 ppm2      1.192 CV     1
 ASSI {  882}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 23   and name HA  ))
      2.100     2.100     3.900 peak   882 spectrum    2 weight  0.10000E+01 volume  0.77438E-02 ppm1      1.979 ppm2      4.234 CV     1
 ASSI {  884}
   (( segid "AREF" and resid 26   and name HB  ))
   (  segid "AREF" and resid 26   and name HG2%)
      2.400     0.700     0.700 peak   884 spectrum    2 weight  0.10000E+01 volume  0.31006E-02 ppm1      1.979 ppm2      0.889 CV     1
 OR {  884}
   (( segid "AREF" and resid 26   and name HB  ))
   (  segid "AREF" and resid 26   and name HD1%)
 ASSI {  885}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 26   and name HN  ))
      2.300     0.700     0.700 peak   885 spectrum    2 weight  0.10000E+01 volume  0.40260E-02 ppm1      1.970 ppm2      7.940 CV     1
 ASSI {  887}
   (( segid "AREF" and resid 26   and name HB  ))
   (  segid "AREF" and resid 26   and name HG2%)
      2.300     0.700     0.700 peak   887 spectrum    2 weight  0.10000E+01 volume  0.34903E-02 ppm1      1.967 ppm2      0.895 CV     1
 ASSI {  888}
   (( segid "AREF" and resid 27   and name HB  ))
   (( segid "AREF" and resid 27   and name HG12))
      2.600     0.800     0.800 peak   888 spectrum    2 weight  0.10000E+01 volume  0.41397E-02 ppm1      1.954 ppm2      1.599 CV     1
 ASSI {  889}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 27   and name HN  ))
      1.800     0.400     0.400 peak   889 spectrum    2 weight  0.10000E+01 volume  0.54223E-02 ppm1      1.993 ppm2      8.061 CV     1
 ASSI {  890}
   (( segid "AREF" and resid 27   and name HB  ))
   (( segid "AREF" and resid 27   and name HA  ))
      2.400     0.700     0.700 peak   890 spectrum    2 weight  0.10000E+01 volume  0.53572E-02 ppm1      1.955 ppm2      3.940 CV     1
 ASSI {  891}
   (( segid "AREF" and resid 27   and name HB  ))
   (( segid "AREF" and resid 27   and name HG11))
      2.300     0.600     0.600 peak   891 spectrum    2 weight  0.10000E+01 volume  0.53249E-02 ppm1      1.951 ppm2      1.218 CV     1
 ASSI {  892}
   (( segid "AREF" and resid 27   and name HB  ))
   (( segid "AREF" and resid 27   and name HN  ))
      2.300     0.600     0.600 peak   892 spectrum    2 weight  0.10000E+01 volume  0.39610E-02 ppm1      1.950 ppm2      8.066 CV     1
 ASSI {  893}
   (( segid "AREF" and resid 27   and name HB  ))
   (  segid "AREF" and resid 27   and name HD1%)
      2.300     0.600     0.600 peak   893 spectrum    2 weight  0.10000E+01 volume  0.37987E-02 ppm1      1.950 ppm2      0.889 CV     1
 OR {  893}
   (( segid "AREF" and resid 27   and name HB  ))
   (  segid "AREF" and resid 27   and name HG2%)
 ASSI {  895}
   (( segid "AREF" and resid 27   and name HB  ))
   (( segid "AREF" and resid 28   and name HN  ))
      1.900     0.500     0.500 peak   895 spectrum    2 weight  0.10000E+01 volume  0.61365E-02 ppm1      1.936 ppm2      7.913 CV     1
 ASSI {  910}
   (( segid "AREF" and resid 117  and name HB2 ))
   (( segid "AREF" and resid 117  and name HD2 ))
      2.700     0.900     0.900 peak   910 spectrum    2 weight  0.10000E+01 volume  0.33766E-02 ppm1      1.661 ppm2      1.630 CV     1
 OR {  910}
   (( segid "AREF" and resid 117  and name HB2 ))
   (( segid "AREF" and resid 117  and name HD1 ))
 OR {  910}
   (( segid "AREF" and resid 117  and name HB1 ))
   (( segid "AREF" and resid 117  and name HD2 ))
 OR {  910}
   (( segid "AREF" and resid 117  and name HB1 ))
   (( segid "AREF" and resid 117  and name HD1 ))
 ASSI {  915}
   (( segid "AREF" and resid 90   and name HB2 ))
   (( segid "AREF" and resid 90   and name HB1 ))
      1.500     0.300     0.700 peak   915 spectrum    2 weight  0.10000E+01 volume  0.72401E-02 ppm1      1.526 ppm2      1.337 CV     1
 ASSI {  917}
   (( segid "AREF" and resid 90   and name HB2 ))
   (  segid "AREF" and resid 92   and name HD2%)
      2.800     2.800     3.200 peak   917 spectrum    2 weight  0.10000E+01 volume  0.81655E-02 ppm1      1.532 ppm2      0.867 CV     1
 ASSI {  919}
   (( segid "AREF" and resid 21   and name HB1 ))
   (( segid "AREF" and resid 21   and name HA  ))
      2.400     0.700     0.700 peak   919 spectrum    2 weight  0.10000E+01 volume  0.48700E-02 ppm1      2.016 ppm2      4.509 CV     1
 ASSI {  926}
   (( segid "AREF" and resid 85   and name HB  ))
   (( segid "AREF" and resid 85   and name HN  ))
      2.700     0.900     0.900 peak   926 spectrum    2 weight  0.10000E+01 volume  0.44968E-02 ppm1      2.090 ppm2      7.863 CV     1
 ASSI {  927}
   (( segid "AREF" and resid 85   and name HB  ))
   (( segid "AREF" and resid 86   and name HA  ))
      3.100     3.100     2.900 peak   927 spectrum    2 weight  0.10000E+01 volume  0.45455E-02 ppm1      2.083 ppm2      4.433 CV     1
 ASSI {  933}
   (( segid "AREF" and resid 144  and name HB2 ))
   (( segid "AREF" and resid 148  and name HE22))
      3.000     3.000     3.000 peak   933 spectrum    2 weight  0.10000E+01 volume  0.57307E-02 ppm1      1.985 ppm2      6.875 CV     1
 ASSI {  934}
   (( segid "AREF" and resid 144  and name HB2 ))
   (  segid "AREF" and resid 145  and name HB% )
      3.800     1.800     1.800 peak   934 spectrum    2 weight  0.10000E+01 volume  0.49027E-02 ppm1      1.976 ppm2      1.118 CV     1
 ASSI {  935}
   (( segid "AREF" and resid 144  and name HB2 ))
   (( segid "AREF" and resid 145  and name HN  ))
      2.400     0.700     0.700 peak   935 spectrum    2 weight  0.10000E+01 volume  0.39773E-02 ppm1      1.972 ppm2      7.546 CV     1
 OR {  935}
   (( segid "AREF" and resid 144  and name HB1 ))
   (( segid "AREF" and resid 145  and name HN  ))
 ASSI {  936}
   (( segid "AREF" and resid 144  and name HB1 ))
   (( segid "AREF" and resid 144  and name HG2 ))
      2.500     0.800     0.800 peak   936 spectrum    2 weight  0.10000E+01 volume  0.29383E-02 ppm1      1.970 ppm2      1.521 CV     1
 OR {  936}
   (( segid "AREF" and resid 144  and name HB2 ))
   (( segid "AREF" and resid 144  and name HG2 ))
 ASSI {  937}
   (( segid "AREF" and resid 144  and name HB1 ))
   (  segid "AREF" and resid 143  and name HD2%)
      3.000     1.100     1.100 peak   937 spectrum    2 weight  0.10000E+01 volume  0.28572E-02 ppm1      1.950 ppm2      0.853 CV     1
 OR {  937}
   (( segid "AREF" and resid 144  and name HB2 ))
   (  segid "AREF" and resid 143  and name HD2%)
 ASSI {  941}
   (( segid "AREF" and resid 85   and name HB  ))
   (( segid "AREF" and resid 86   and name HN  ))
      2.900     2.900     3.100 peak   941 spectrum    2 weight  0.10000E+01 volume  0.49514E-02 ppm1      2.090 ppm2      8.546 CV     1
 ASSI {  943}
   (( segid "AREF" and resid 19   and name HB2 ))
   (( segid "AREF" and resid 19   and name HA  ))
      2.600     0.800     0.800 peak   943 spectrum    2 weight  0.10000E+01 volume  0.47565E-02 ppm1      2.061 ppm2      4.462 CV     1
 OR {  943}
   (( segid "AREF" and resid 19   and name HB1 ))
   (( segid "AREF" and resid 19   and name HA  ))
 ASSI {  946}
   (( segid "AREF" and resid 150  and name HB2 ))
   (  segid "AREF" and resid 145  and name HB% )
      2.900     2.900     3.100 peak   946 spectrum    2 weight  0.10000E+01 volume  0.52758E-02 ppm1      2.010 ppm2      1.143 CV     1
 ASSI {  948}
   (( segid "AREF" and resid 144  and name HB2 ))
   (( segid "AREF" and resid 144  and name HN  ))
      2.100     0.600     0.600 peak   948 spectrum    2 weight  0.10000E+01 volume  0.49187E-02 ppm1      1.975 ppm2      7.302 CV     1
 OR {  948}
   (( segid "AREF" and resid 144  and name HB1 ))
   (( segid "AREF" and resid 144  and name HN  ))
 ASSI {  951}
   (( segid "AREF" and resid 144  and name HB1 ))
   (  segid "AREF" and resid 145  and name HB% )
      2.900     2.900     3.100 peak   951 spectrum    2 weight  0.10000E+01 volume  0.59418E-02 ppm1      1.945 ppm2      1.128 CV     1
 ASSI {  958}
   (( segid "AREF" and resid 28   and name HB1 ))
   (( segid "AREF" and resid 28   and name HA  ))
      2.400     0.700     0.700 peak   958 spectrum    2 weight  0.10000E+01 volume  0.33929E-02 ppm1      1.860 ppm2      4.134 CV     1
 OR {  958}
   (( segid "AREF" and resid 28   and name HB2 ))
   (( segid "AREF" and resid 28   and name HA  ))
 ASSI {  961}
   (( segid "AREF" and resid 28   and name HB2 ))
   (( segid "AREF" and resid 30   and name HD21))
      3.500     3.500     2.500 peak   961 spectrum    2 weight  0.10000E+01 volume  0.42046E-02 ppm1      1.851 ppm2      7.557 CV     1
 OR {  961}
   (( segid "AREF" and resid 28   and name HB1 ))
   (( segid "AREF" and resid 30   and name HD21))
 ASSI {  965}
   (( segid "AREF" and resid 64   and name HB2 ))
   (( segid "AREF" and resid 64   and name HA  ))
      2.500     0.800     0.800 peak   965 spectrum    2 weight  0.10000E+01 volume  0.42046E-02 ppm1      1.811 ppm2      4.552 CV     1
 ASSI {  966}
   (( segid "AREF" and resid 64   and name HB2 ))
   (( segid "AREF" and resid 64   and name HG1 ))
      2.600     0.800     0.800 peak   966 spectrum    2 weight  0.10000E+01 volume  0.27598E-02 ppm1      1.810 ppm2      1.472 CV     1
 OR {  966}
   (( segid "AREF" and resid 64   and name HB2 ))
   (( segid "AREF" and resid 64   and name HG2 ))
 ASSI {  971}
   (( segid "AREF" and resid 64   and name HB1 ))
   (( segid "AREF" and resid 64   and name HA  ))
      2.100     0.600     0.600 peak   971 spectrum    2 weight  0.10000E+01 volume  0.53249E-02 ppm1      1.693 ppm2      4.568 CV     1
 ASSI {  974}
   (( segid "AREF" and resid 69   and name HB1 ))
   (( segid "AREF" and resid 69   and name HA  ))
      2.600     0.800     0.800 peak   974 spectrum    2 weight  0.10000E+01 volume  0.36364E-02 ppm1      1.653 ppm2      4.174 CV     1
 OR {  974}
   (( segid "AREF" and resid 69   and name HB2 ))
   (( segid "AREF" and resid 69   and name HA  ))
 ASSI {  978}
   (( segid "AREF" and resid 10   and name HB1 ))
   (( segid "AREF" and resid 12   and name HG2 ))
      2.500     0.800     0.800 peak   978 spectrum    2 weight  0.10000E+01 volume  0.37500E-02 ppm1      2.025 ppm2      1.639 CV     1
 OR {  978}
   (( segid "AREF" and resid 10   and name HB1 ))
   (( segid "AREF" and resid 12   and name HG1 ))
 ASSI {  983}
   (( segid "AREF" and resid 150  and name HB1 ))
   (( segid "AREF" and resid 150  and name HA  ))
      2.500     0.800     0.800 peak   983 spectrum    2 weight  0.10000E+01 volume  0.34903E-02 ppm1      1.961 ppm2      3.893 CV     1
 ASSI {  987}
   (( segid "AREF" and resid 28   and name HB1 ))
   (( segid "AREF" and resid 29   and name HA  ))
      2.800     1.000     1.000 peak   987 spectrum    2 weight  0.10000E+01 volume  0.46591E-02 ppm1      1.833 ppm2      4.174 CV     1
 OR {  987}
   (( segid "AREF" and resid 28   and name HB2 ))
   (( segid "AREF" and resid 29   and name HA  ))
 ASSI {  992}
   (( segid "AREF" and resid 64   and name HB1 ))
   (( segid "AREF" and resid 64   and name HN  ))
      2.600     2.600     3.400 peak   992 spectrum    2 weight  0.10000E+01 volume  0.64609E-02 ppm1      1.694 ppm2      8.288 CV     1
 ASSI {  994}
   (( segid "AREF" and resid 150  and name HB1 ))
   (( segid "AREF" and resid 162  and name HG1 ))
      3.300     3.300     2.700 peak   994 spectrum    2 weight  0.10000E+01 volume  0.30357E-02 ppm1      1.986 ppm2      2.303 CV     1
 OR {  994}
   (( segid "AREF" and resid 150  and name HB1 ))
   (( segid "AREF" and resid 162  and name HG2 ))
 OR {  994}
   (( segid "AREF" and resid 150  and name HB2 ))
   (( segid "AREF" and resid 162  and name HG1 ))
 OR {  994}
   (( segid "AREF" and resid 150  and name HB2 ))
   (( segid "AREF" and resid 162  and name HG2 ))
 ASSI {  999}
   (( segid "AREF" and resid 147  and name HB1 ))
   (( segid "AREF" and resid 144  and name HA  ))
      2.300     0.700     0.700 peak   999 spectrum    2 weight  0.10000E+01 volume  0.27273E-02 ppm1      1.864 ppm2      3.830 CV     1
 OR {  999}
   (( segid "AREF" and resid 147  and name HB2 ))
   (( segid "AREF" and resid 144  and name HA  ))
 ASSI { 1000}
   (( segid "AREF" and resid 64   and name HB2 ))
   (( segid "AREF" and resid 65   and name HD2 ))
      2.800     2.800     3.200 peak  1000 spectrum    2 weight  0.10000E+01 volume  0.35227E-02 ppm1      1.822 ppm2      3.770 CV     1
 ASSI { 1001}
   (( segid "AREF" and resid 69   and name HB2 ))
   (( segid "AREF" and resid 69   and name HN  ))
      2.100     0.500     0.500 peak  1001 spectrum    2 weight  0.10000E+01 volume  0.61852E-02 ppm1      1.656 ppm2      8.087 CV     1
 ASSI { 1005}
   (( segid "AREF" and resid 59   and name HB2 ))
   (( segid "AREF" and resid 64   and name HN  ))
      3.200     3.200     2.800 peak  1005 spectrum    2 weight  0.10000E+01 volume  0.53895E-02 ppm1      1.812 ppm2      8.274 CV     1
 ASSI { 1006}
   (( segid "AREF" and resid 59   and name HB2 ))
   (( segid "AREF" and resid 63   and name HD2 ))
      3.600     3.600     2.400 peak  1006 spectrum    2 weight  0.10000E+01 volume  0.44481E-02 ppm1      1.812 ppm2      3.618 CV     1
 OR { 1006}
   (( segid "AREF" and resid 59   and name HB2 ))
   (( segid "AREF" and resid 63   and name HD1 ))
 ASSI { 1010}
   (( segid "AREF" and resid 86   and name HB1 ))
   (( segid "AREF" and resid 86   and name HA  ))
      2.600     0.800     0.800 peak  1010 spectrum    2 weight  0.10000E+01 volume  0.53895E-02 ppm1      2.072 ppm2      4.467 CV     1
 ASSI { 1017}
   (( segid "AREF" and resid 62   and name HB2 ))
   (( segid "AREF" and resid 63   and name HD1 ))
      3.300     1.400     1.400 peak  1017 spectrum    2 weight  0.10000E+01 volume  0.37013E-02 ppm1      1.835 ppm2      3.623 CV     1
 OR { 1017}
   (( segid "AREF" and resid 62   and name HB2 ))
   (( segid "AREF" and resid 63   and name HD2 ))
 ASSI { 1021}
   (( segid "AREF" and resid 83   and name HB1 ))
   (( segid "AREF" and resid 83   and name HA  ))
      2.800     1.000     1.000 peak  1021 spectrum    2 weight  0.10000E+01 volume  0.33117E-02 ppm1      1.957 ppm2      4.305 CV     1
 ASSI { 1024}
   (( segid "AREF" and resid 171  and name HB1 ))
   (( segid "AREF" and resid 171  and name HN  ))
      2.800     1.000     1.000 peak  1024 spectrum    2 weight  0.10000E+01 volume  0.35227E-02 ppm1      1.891 ppm2      8.211 CV     1
 OR { 1024}
   (( segid "AREF" and resid 171  and name HB2 ))
   (( segid "AREF" and resid 171  and name HN  ))
 ASSI { 1026}
   (( segid "AREF" and resid 56   and name HB1 ))
   (( segid "AREF" and resid 57   and name HD1 ))
      1.700     0.400     0.500 peak  1026 spectrum    2 weight  0.10000E+01 volume  0.43020E-02 ppm1      1.721 ppm2      3.618 CV     1
 ASSI { 1027}
   (( segid "AREF" and resid 83   and name HB2 ))
   (  segid "AREF" and resid 85   and name HG2%)
      2.600     0.900     0.900 peak  1027 spectrum    2 weight  0.10000E+01 volume  0.64122E-02 ppm1      2.090 ppm2      0.886 CV     1
 OR { 1027}
   (( segid "AREF" and resid 83   and name HB2 ))
   (  segid "AREF" and resid 85   and name HG1%)
 ASSI { 1028}
   (( segid "AREF" and resid 86   and name HB1 ))
   (( segid "AREF" and resid 86   and name HN  ))
      2.700     0.900     0.900 peak  1028 spectrum    2 weight  0.10000E+01 volume  0.72401E-02 ppm1      2.064 ppm2      8.526 CV     1
 ASSI { 1030}
   (( segid "AREF" and resid 171  and name HB2 ))
   (( segid "AREF" and resid 171  and name HA  ))
      2.700     0.900     0.900 peak  1030 spectrum    2 weight  0.10000E+01 volume  0.30682E-02 ppm1      1.891 ppm2      4.138 CV     1
 OR { 1030}
   (( segid "AREF" and resid 171  and name HB1 ))
   (( segid "AREF" and resid 171  and name HA  ))
 ASSI { 1031}
   (( segid "AREF" and resid 171  and name HB1 ))
   (( segid "AREF" and resid 171  and name HG1 ))
      2.700     0.900     0.900 peak  1031 spectrum    2 weight  0.10000E+01 volume  0.36202E-02 ppm1      1.890 ppm2      2.137 CV     1
 OR { 1031}
   (( segid "AREF" and resid 171  and name HB2 ))
   (( segid "AREF" and resid 171  and name HG1 ))
 ASSI { 1032}
   (( segid "AREF" and resid 31   and name HB2 ))
   (  segid "AREF" and resid 27   and name HG2%)
      3.300     1.400     1.400 peak  1032 spectrum    2 weight  0.10000E+01 volume  0.51948E-02 ppm1      1.868 ppm2      0.887 CV     1
 ASSI { 1033}
   (( segid "AREF" and resid 111  and name HB2 ))
   (( segid "AREF" and resid 111  and name HA  ))
      2.600     0.800     0.800 peak  1033 spectrum    2 weight  0.10000E+01 volume  0.38799E-02 ppm1      1.800 ppm2      3.981 CV     1
 ASSI { 1034}
   (( segid "AREF" and resid 51   and name HB2 ))
   (  segid "AREF" and resid 49   and name HG2%)
      2.000     2.000     4.000 peak  1034 spectrum    2 weight  0.10000E+01 volume  0.53895E-02 ppm1      1.800 ppm2      0.871 CV     1
 OR { 1034}
   (( segid "AREF" and resid 51   and name HB1 ))
   (  segid "AREF" and resid 49   and name HG2%)
 ASSI { 1035}
   (( segid "AREF" and resid 56   and name HB1 ))
   (( segid "AREF" and resid 57   and name HD2 ))
      2.200     2.200     3.800 peak  1035 spectrum    2 weight  0.10000E+01 volume  0.10958E-01 ppm1      1.703 ppm2      3.764 CV     1
 ASSI { 1036}
   (( segid "AREF" and resid 111  and name HB1 ))
   (( segid "AREF" and resid 111  and name HB2 ))
      1.800     0.400     0.400 peak  1036 spectrum    2 weight  0.10000E+01 volume  0.36202E-02 ppm1      1.618 ppm2      1.808 CV     1
 ASSI { 1037}
   (( segid "AREF" and resid 111  and name HB1 ))
   (( segid "AREF" and resid 111  and name HN  ))
      2.600     0.800     0.800 peak  1037 spectrum    2 weight  0.10000E+01 volume  0.80681E-02 ppm1      1.601 ppm2      7.288 CV     1
 ASSI { 1039}
   (( segid "AREF" and resid 167  and name HB2 ))
   (( segid "AREF" and resid 167  and name HG1 ))
      2.800     1.000     1.000 peak  1039 spectrum    2 weight  0.10000E+01 volume  0.25650E-02 ppm1      2.090 ppm2      2.324 CV     1
 OR { 1039}
   (( segid "AREF" and resid 167  and name HB2 ))
   (( segid "AREF" and resid 167  and name HG2 ))
 ASSI { 1054}
   (( segid "AREF" and resid 71   and name HB1 ))
   (  segid "AREF" and resid 74   and name HD2%)
      3.000     3.000     3.000 peak  1054 spectrum    2 weight  0.10000E+01 volume  0.53736E-02 ppm1      1.809 ppm2      0.839 CV     1
 ASSI { 1055}
   (( segid "AREF" and resid 111  and name HB2 ))
   (( segid "AREF" and resid 111  and name HN  ))
      2.000     0.500     0.500 peak  1055 spectrum    2 weight  0.10000E+01 volume  0.52271E-02 ppm1      1.807 ppm2      7.297 CV     1
 ASSI { 1056}
   (( segid "AREF" and resid 111  and name HB1 ))
   (( segid "AREF" and resid 111  and name HA  ))
      2.600     0.900     0.900 peak  1056 spectrum    2 weight  0.10000E+01 volume  0.53085E-02 ppm1      1.600 ppm2      3.981 CV     1
 ASSI { 1063}
   (( segid "AREF" and resid 18   and name HD2 ))
   (( segid "AREF" and resid 18   and name HB2 ))
      2.600     0.800     0.800 peak  1063 spectrum    2 weight  0.10000E+01 volume  0.40260E-02 ppm1      1.671 ppm2      1.903 CV     1
 OR { 1063}
   (( segid "AREF" and resid 18   and name HD1 ))
   (( segid "AREF" and resid 18   and name HB2 ))
 ASSI { 1069}
   (( segid "AREF" and resid 107  and name HB2 ))
   (( segid "AREF" and resid 107  and name HN  ))
      2.200     0.600     0.600 peak  1069 spectrum    2 weight  0.10000E+01 volume  0.64609E-02 ppm1      2.072 ppm2      7.909 CV     1
 OR { 1069}
   (( segid "AREF" and resid 107  and name HB1 ))
   (( segid "AREF" and resid 107  and name HN  ))
 ASSI { 1071}
   (( segid "AREF" and resid 71   and name HB2 ))
   (( segid "AREF" and resid 74   and name HG  ))
      3.300     3.300     2.700 peak  1071 spectrum    2 weight  0.10000E+01 volume  0.40423E-02 ppm1      1.930 ppm2      1.485 CV     1
 OR { 1071}
   (( segid "AREF" and resid 71   and name HB2 ))
   (( segid "AREF" and resid 74   and name HB2 ))
 ASSI { 1072}
   (( segid "AREF" and resid 28   and name HD2 ))
   (( segid "AREF" and resid 28   and name HA  ))
      1.800     0.400     0.400 peak  1072 spectrum    2 weight  0.10000E+01 volume  0.10958E-01 ppm1      1.696 ppm2      4.125 CV     1
 OR { 1072}
   (( segid "AREF" and resid 28   and name HD1 ))
   (( segid "AREF" and resid 28   and name HA  ))
 ASSI { 1073}
   (( segid "AREF" and resid 64   and name HD1 ))
   (( segid "AREF" and resid 64   and name HG2 ))
      2.700     0.900     0.900 peak  1073 spectrum    2 weight  0.10000E+01 volume  0.23214E-02 ppm1      1.694 ppm2      1.465 CV     1
 OR { 1073}
   (( segid "AREF" and resid 64   and name HD2 ))
   (( segid "AREF" and resid 64   and name HG2 ))
 OR { 1073}
   (( segid "AREF" and resid 64   and name HD1 ))
   (( segid "AREF" and resid 64   and name HG1 ))
 OR { 1073}
   (( segid "AREF" and resid 64   and name HD2 ))
   (( segid "AREF" and resid 64   and name HG1 ))
 ASSI { 1075}
   (( segid "AREF" and resid 28   and name HD1 ))
   (( segid "AREF" and resid 27   and name HA  ))
      3.200     3.200     2.800 peak  1075 spectrum    2 weight  0.10000E+01 volume  0.43507E-02 ppm1      1.673 ppm2      3.941 CV     1
 ASSI { 1076}
   (( segid "AREF" and resid 147  and name HD2 ))
   (( segid "AREF" and resid 147  and name HA  ))
      2.500     0.800     0.800 peak  1076 spectrum    2 weight  0.10000E+01 volume  0.40260E-02 ppm1      1.652 ppm2      3.958 CV     1
 OR { 1076}
   (( segid "AREF" and resid 147  and name HD1 ))
   (( segid "AREF" and resid 147  and name HA  ))
 ASSI { 1077}
   (( segid "AREF" and resid 147  and name HD1 ))
   (( segid "AREF" and resid 147  and name HN  ))
      2.100     0.600     0.600 peak  1077 spectrum    2 weight  0.10000E+01 volume  0.87014E-02 ppm1      1.642 ppm2      7.771 CV     1
 OR { 1077}
   (( segid "AREF" and resid 147  and name HD2 ))
   (( segid "AREF" and resid 147  and name HN  ))
 ASSI { 1081}
   (( segid "AREF" and resid 28   and name HD1 ))
   (( segid "AREF" and resid 27   and name HB  ))
      2.800     2.800     3.200 peak  1081 spectrum    2 weight  0.10000E+01 volume  0.32792E-02 ppm1      1.691 ppm2      1.916 CV     1
 ASSI { 1083}
   (( segid "AREF" and resid 69   and name HD2 ))
   (( segid "AREF" and resid 69   and name HA  ))
      2.400     0.700     0.700 peak  1083 spectrum    2 weight  0.10000E+01 volume  0.59254E-02 ppm1      1.560 ppm2      4.179 CV     1
 OR { 1083}
   (( segid "AREF" and resid 69   and name HD1 ))
   (( segid "AREF" and resid 69   and name HA  ))
 ASSI { 1092}
   (( segid "AREF" and resid 26   and name HG11))
   (( segid "AREF" and resid 26   and name HN  ))
      1.800     0.400     0.400 peak  1092 spectrum    2 weight  0.10000E+01 volume  0.49673E-02 ppm1      1.593 ppm2      7.938 CV     1
 ASSI { 1107}
   (( segid "AREF" and resid 26   and name HG11))
   (( segid "AREF" and resid 26   and name HA  ))
      2.700     0.900     0.900 peak  1107 spectrum    2 weight  0.10000E+01 volume  0.38474E-02 ppm1      1.588 ppm2      3.930 CV     1
 ASSI { 1113}
   (( segid "AREF" and resid 26   and name HG12))
   (( segid "AREF" and resid 26   and name HA  ))
      2.200     0.600     0.600 peak  1113 spectrum    2 weight  0.10000E+01 volume  0.55683E-02 ppm1      1.208 ppm2      3.909 CV     1
 ASSI { 1118}
   (( segid "AREF" and resid 26   and name HG11))
   (  segid "AREF" and resid 26   and name HD1%)
      2.600     0.800     0.800 peak  1118 spectrum    2 weight  0.10000E+01 volume  0.26948E-02 ppm1      1.589 ppm2      0.872 CV     1
 OR { 1118}
   (( segid "AREF" and resid 26   and name HG11))
   (  segid "AREF" and resid 26   and name HG2%)
 ASSI { 1123}
   (( segid "AREF" and resid 65   and name HG2 ))
   (  segid "AREF" and resid 66   and name HD1%)
      3.400     1.500     1.500 peak  1123 spectrum    2 weight  0.10000E+01 volume  0.46429E-02 ppm1      1.989 ppm2      0.881 CV     1
 OR { 1123}
   (( segid "AREF" and resid 65   and name HG2 ))
   (  segid "AREF" and resid 66   and name HD2%)
 OR { 1123}
   (( segid "AREF" and resid 65   and name HG1 ))
   (  segid "AREF" and resid 66   and name HD1%)
 OR { 1123}
   (( segid "AREF" and resid 65   and name HG1 ))
   (  segid "AREF" and resid 66   and name HD2%)
 ASSI { 1128}
   (( segid "AREF" and resid 168  and name HG11))
   (( segid "AREF" and resid 167  and name HB2 ))
      3.000     3.000     3.000 peak  1128 spectrum    2 weight  0.10000E+01 volume  0.54869E-02 ppm1      1.451 ppm2      2.068 CV     1
 ASSI { 1135}
   (( segid "AREF" and resid 42   and name HG2 ))
   (( segid "AREF" and resid 41   and name HA2 ))
      3.500     1.500     1.500 peak  1135 spectrum    2 weight  0.10000E+01 volume  0.86527E-02 ppm1      2.000 ppm2      4.123 CV     1
 OR { 1135}
   (( segid "AREF" and resid 42   and name HG1 ))
   (( segid "AREF" and resid 41   and name HA2 ))
 OR { 1135}
   (( segid "AREF" and resid 42   and name HG2 ))
   (( segid "AREF" and resid 41   and name HA1 ))
 OR { 1135}
   (( segid "AREF" and resid 42   and name HG1 ))
   (( segid "AREF" and resid 41   and name HA1 ))
 ASSI { 1138}
   (( segid "AREF" and resid 67   and name HG1 ))
   (( segid "AREF" and resid 68   and name HN  ))
      2.000     0.500     0.500 peak  1138 spectrum    2 weight  0.10000E+01 volume  0.86527E-02 ppm1      1.993 ppm2      8.269 CV     1
 OR { 1138}
   (( segid "AREF" and resid 67   and name HG2 ))
   (( segid "AREF" and resid 68   and name HN  ))
 ASSI { 1144}
   (( segid "AREF" and resid 67   and name HG1 ))
   (  segid "AREF" and resid 66   and name HD2%)
      2.000     2.000     4.000 peak  1144 spectrum    2 weight  0.10000E+01 volume  0.52599E-02 ppm1      1.966 ppm2      0.873 CV     1
 OR { 1144}
   (( segid "AREF" and resid 67   and name HG2 ))
   (  segid "AREF" and resid 66   and name HD2%)
 OR { 1144}
   (( segid "AREF" and resid 67   and name HG2 ))
   (  segid "AREF" and resid 66   and name HD1%)
 ASSI { 1152}
   (( segid "AREF" and resid 49   and name HG11))
   (( segid "AREF" and resid 49   and name HA  ))
      2.200     0.600     0.600 peak  1152 spectrum    2 weight  0.10000E+01 volume  0.49514E-02 ppm1      1.461 ppm2      4.146 CV     1
 ASSI { 1156}
   (( segid "AREF" and resid 49   and name HG12))
   (( segid "AREF" and resid 49   and name HA  ))
      2.800     1.000     1.000 peak  1156 spectrum    2 weight  0.10000E+01 volume  0.75650E-02 ppm1      1.172 ppm2      4.137 CV     1
 ASSI { 1158}
   (( segid "AREF" and resid 168  and name HG12))
   (( segid "AREF" and resid 168  and name HA  ))
      2.800     1.000     1.000 peak  1158 spectrum    2 weight  0.10000E+01 volume  0.86363E-02 ppm1      1.149 ppm2      4.144 CV     1
 ASSI { 1159}
   (( segid "AREF" and resid 168  and name HG12))
   (( segid "AREF" and resid 168  and name HB  ))
      2.500     0.800     0.800 peak  1159 spectrum    2 weight  0.10000E+01 volume  0.61688E-02 ppm1      1.148 ppm2      1.817 CV     1
 ASSI { 1160}
   (( segid "AREF" and resid 124  and name HG1 ))
   (( segid "AREF" and resid 124  and name HB2 ))
      2.600     0.800     0.800 peak  1160 spectrum    2 weight  0.10000E+01 volume  0.30520E-02 ppm1      1.758 ppm2      1.939 CV     1
 OR { 1160}
   (( segid "AREF" and resid 124  and name HG2 ))
   (( segid "AREF" and resid 124  and name HB1 ))
 OR { 1160}
   (( segid "AREF" and resid 124  and name HG1 ))
   (( segid "AREF" and resid 124  and name HB1 ))
 OR { 1160}
   (( segid "AREF" and resid 124  and name HG2 ))
   (( segid "AREF" and resid 124  and name HB2 ))
 ASSI { 1161}
   (( segid "AREF" and resid 124  and name HG2 ))
   (( segid "AREF" and resid 124  and name HA  ))
      2.600     0.900     0.900 peak  1161 spectrum    2 weight  0.10000E+01 volume  0.38799E-02 ppm1      1.751 ppm2      4.175 CV     1
 OR { 1161}
   (( segid "AREF" and resid 124  and name HG1 ))
   (( segid "AREF" and resid 124  and name HA  ))
 ASSI { 1162}
   (( segid "AREF" and resid 66   and name HG  ))
   (( segid "AREF" and resid 66   and name HN  ))
      2.400     0.700     0.700 peak  1162 spectrum    2 weight  0.10000E+01 volume  0.47565E-02 ppm1      1.706 ppm2      8.226 CV     1
 ASSI { 1177}
   (( segid "AREF" and resid 74   and name HG  ))
   (( segid "AREF" and resid 74   and name HA  ))
      2.200     0.600     0.600 peak  1177 spectrum    2 weight  0.10000E+01 volume  0.54382E-02 ppm1      1.479 ppm2      4.243 CV     1
 ASSI { 1183}
   (( segid "AREF" and resid 143  and name HG  ))
   (( segid "AREF" and resid 143  and name HA  ))
      2.200     0.600     0.600 peak  1183 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      1.658 ppm2      3.814 CV     1
 ASSI { 1189}
   (( segid "AREF" and resid 66   and name HG  ))
   (( segid "AREF" and resid 67   and name HD1 ))
      3.100     1.200     1.200 peak  1189 spectrum    2 weight  0.10000E+01 volume  0.86527E-02 ppm1      1.703 ppm2      3.634 CV     1
 ASSI { 1190}
   (( segid "AREF" and resid 143  and name HG  ))
   (( segid "AREF" and resid 144  and name HA  ))
      2.900     2.900     3.100 peak  1190 spectrum    2 weight  0.10000E+01 volume  0.44643E-02 ppm1      1.681 ppm2      3.841 CV     1
 ASSI { 1196}
   (  segid "AREF" and resid 115  and name HD2%)
   (  segid "AREF" and resid 115  and name HD1%)
      2.400     0.700     0.700 peak  1196 spectrum    2 weight  0.10000E+01 volume  0.42370E-02 ppm1      0.722 ppm2     -0.051 CV     1
 ASSI { 1197}
   (  segid "AREF" and resid 115  and name HD2%)
   (  segid "AREF" and resid 118  and name HB% )
      2.300     0.700     0.700 peak  1197 spectrum    2 weight  0.10000E+01 volume  0.41234E-02 ppm1      0.718 ppm2      1.246 CV     1
 ASSI { 1198}
   (  segid "AREF" and resid 115  and name HD2%)
   (  segid "AREF" and resid 134  and name HG1%)
      2.600     0.900     0.900 peak  1198 spectrum    2 weight  0.10000E+01 volume  0.60064E-02 ppm1      0.715 ppm2      0.298 CV     1
 OR { 1198}
   (  segid "AREF" and resid 115  and name HD2%)
   (  segid "AREF" and resid 134  and name HG2%)
 ASSI { 1202}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 115  and name HN  ))
      3.300     1.300     1.300 peak  1202 spectrum    2 weight  0.10000E+01 volume  0.49837E-02 ppm1      0.714 ppm2      8.786 CV     1
 ASSI { 1203}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 115  and name HA  ))
      2.600     2.600     3.400 peak  1203 spectrum    2 weight  0.10000E+01 volume  0.38474E-02 ppm1      0.715 ppm2      4.429 CV     1
 ASSI { 1205}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 106  and name HA  ))
      2.400     0.700     0.700 peak  1205 spectrum    2 weight  0.10000E+01 volume  0.77761E-02 ppm1      0.719 ppm2      3.688 CV     1
 ASSI { 1206}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 136  and name HB2 ))
      3.200     3.200     2.800 peak  1206 spectrum    2 weight  0.10000E+01 volume  0.44318E-02 ppm1      0.715 ppm2      2.719 CV     1
 OR { 1206}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 136  and name HB1 ))
 ASSI { 1207}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 115  and name HB2 ))
      2.600     0.900     0.900 peak  1207 spectrum    2 weight  0.10000E+01 volume  0.31006E-02 ppm1      0.715 ppm2      1.577 CV     1
 OR { 1207}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 115  and name HB1 ))
 ASSI { 1209}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 109  and name HB1 ))
      2.300     0.700     0.700 peak  1209 spectrum    2 weight  0.10000E+01 volume  0.64609E-02 ppm1      0.709 ppm2      3.457 CV     1
 OR { 1209}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 109  and name HB2 ))
 ASSI { 1210}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 106  and name HG2 ))
      2.800     1.000     1.000 peak  1210 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      0.713 ppm2      2.423 CV     1
 OR { 1210}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 106  and name HG1 ))
 ASSI { 1211}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 106  and name HB2 ))
      2.800     1.000     1.000 peak  1211 spectrum    2 weight  0.10000E+01 volume  0.10974E-01 ppm1      0.710 ppm2      2.166 CV     1
 OR { 1211}
   (  segid "AREF" and resid 115  and name HD2%)
   (( segid "AREF" and resid 106  and name HB1 ))
 ASSI { 1212}
   (  segid "AREF" and resid 115  and name HD2%)
   (  segid "AREF" and resid 132  and name HB% )
      3.700     1.700     1.700 peak  1212 spectrum    2 weight  0.10000E+01 volume  0.27598E-02 ppm1      0.713 ppm2      0.918 CV     1
 ASSI { 1216}
   (( segid "AREF" and resid 144  and name HG2 ))
   (( segid "AREF" and resid 144  and name HE2 ))
      2.600     0.800     0.800 peak  1216 spectrum    2 weight  0.10000E+01 volume  0.43507E-02 ppm1      1.509 ppm2      3.101 CV     1
 OR { 1216}
   (( segid "AREF" and resid 144  and name HG2 ))
   (( segid "AREF" and resid 144  and name HE1 ))
 ASSI { 1222}
   (( segid "AREF" and resid 92   and name HG  ))
   (( segid "AREF" and resid 164  and name HB  ))
      2.400     2.400     3.600 peak  1222 spectrum    2 weight  0.10000E+01 volume  0.77761E-02 ppm1      1.627 ppm2      1.995 CV     1
 ASSI { 1223}
   (( segid "AREF" and resid 28   and name HG2 ))
   (( segid "AREF" and resid 28   and name HE2 ))
      2.700     0.900     0.900 peak  1223 spectrum    2 weight  0.10000E+01 volume  0.39773E-02 ppm1      1.521 ppm2      2.979 CV     1
 OR { 1223}
   (( segid "AREF" and resid 28   and name HG2 ))
   (( segid "AREF" and resid 28   and name HE1 ))
 ASSI { 1230}
   (  segid "AREF" and resid 66   and name HD1%)
   (( segid "AREF" and resid 66   and name HN  ))
      3.200     1.200     1.200 peak  1230 spectrum    2 weight  0.10000E+01 volume  0.43669E-02 ppm1      0.900 ppm2      8.237 CV     1
 OR { 1230}
   (  segid "AREF" and resid 66   and name HD2%)
   (( segid "AREF" and resid 66   and name HN  ))
 ASSI { 1234}
   (  segid "AREF" and resid 143  and name HD2%)
   (( segid "AREF" and resid 143  and name HN  ))
      3.500     1.600     1.600 peak  1234 spectrum    2 weight  0.10000E+01 volume  0.43182E-02 ppm1      0.830 ppm2      7.846 CV     1
 ASSI { 1235}
   (  segid "AREF" and resid 143  and name HD2%)
   (( segid "AREF" and resid 144  and name HN  ))
      2.500     0.800     0.800 peak  1235 spectrum    2 weight  0.10000E+01 volume  0.39448E-02 ppm1      0.829 ppm2      7.272 CV     1
 ASSI { 1240}
   (  segid "AREF" and resid 74   and name HD1%)
   (( segid "AREF" and resid 71   and name HG1 ))
      2.700     0.900     0.900 peak  1240 spectrum    2 weight  0.10000E+01 volume  0.34416E-02 ppm1      0.776 ppm2      2.064 CV     1
 OR { 1240}
   (  segid "AREF" and resid 74   and name HD1%)
   (( segid "AREF" and resid 71   and name HG2 ))
 ASSI { 1246}
   (( segid "AREF" and resid 144  and name HG1 ))
   (( segid "AREF" and resid 144  and name HG2 ))
      1.700     0.300     0.500 peak  1246 spectrum    2 weight  0.10000E+01 volume  0.49514E-02 ppm1      1.656 ppm2      1.485 CV     1
 ASSI { 1247}
   (( segid "AREF" and resid 144  and name HG1 ))
   (( segid "AREF" and resid 144  and name HB2 ))
      2.200     0.600     0.600 peak  1247 spectrum    2 weight  0.10000E+01 volume  0.55519E-02 ppm1      1.646 ppm2      1.989 CV     1
 OR { 1247}
   (( segid "AREF" and resid 144  and name HG1 ))
   (( segid "AREF" and resid 144  and name HB1 ))
 ASSI { 1250}
   (( segid "AREF" and resid 64   and name HG1 ))
   (( segid "AREF" and resid 64   and name HE2 ))
      2.700     0.900     0.900 peak  1250 spectrum    2 weight  0.10000E+01 volume  0.42695E-02 ppm1      1.473 ppm2      2.982 CV     1
 OR { 1250}
   (( segid "AREF" and resid 64   and name HG1 ))
   (( segid "AREF" and resid 64   and name HE1 ))
 OR { 1250}
   (( segid "AREF" and resid 64   and name HG2 ))
   (( segid "AREF" and resid 64   and name HE1 ))
 OR { 1250}
   (( segid "AREF" and resid 64   and name HG2 ))
   (( segid "AREF" and resid 64   and name HE2 ))
 ASSI { 1251}
   (( segid "AREF" and resid 147  and name HG1 ))
   (( segid "AREF" and resid 147  and name HA  ))
      2.000     0.500     0.500 peak  1251 spectrum    2 weight  0.10000E+01 volume  0.10941E-01 ppm1      1.439 ppm2      3.947 CV     1
 OR { 1251}
   (( segid "AREF" and resid 147  and name HG2 ))
   (( segid "AREF" and resid 147  and name HA  ))
 ASSI { 1252}
   (( segid "AREF" and resid 18   and name HG2 ))
   (( segid "AREF" and resid 18   and name HD1 ))
      2.600     0.900     0.900 peak  1252 spectrum    2 weight  0.10000E+01 volume  0.27273E-02 ppm1      1.419 ppm2      1.678 CV     1
 OR { 1252}
   (( segid "AREF" and resid 18   and name HG1 ))
   (( segid "AREF" and resid 18   and name HD2 ))
 OR { 1252}
   (( segid "AREF" and resid 18   and name HG1 ))
   (( segid "AREF" and resid 18   and name HD1 ))
 OR { 1252}
   (( segid "AREF" and resid 18   and name HG2 ))
   (( segid "AREF" and resid 18   and name HD2 ))
 ASSI { 1255}
   (( segid "AREF" and resid 28   and name HG1 ))
   (( segid "AREF" and resid 28   and name HA  ))
      2.900     1.000     1.000 peak  1255 spectrum    2 weight  0.10000E+01 volume  0.63148E-02 ppm1      1.395 ppm2      4.129 CV     1
 ASSI { 1264}
   (  segid "AREF" and resid 66   and name HD1%)
   (( segid "AREF" and resid 67   and name HA  ))
      2.200     2.200     3.800 peak  1264 spectrum    2 weight  0.10000E+01 volume  0.30844E-02 ppm1      0.890 ppm2      4.354 CV     1
 OR { 1264}
   (  segid "AREF" and resid 66   and name HD2%)
   (( segid "AREF" and resid 67   and name HA  ))
 ASSI { 1266}
   (  segid "AREF" and resid 143  and name HD2%)
   (( segid "AREF" and resid 145  and name HN  ))
      3.200     3.200     2.800 peak  1266 spectrum    2 weight  0.10000E+01 volume  0.60551E-02 ppm1      0.835 ppm2      7.531 CV     1
 ASSI { 1288}
   (( segid "AREF" and resid 64   and name HG2 ))
   (( segid "AREF" and resid 64   and name HB1 ))
      2.700     0.900     0.900 peak  1288 spectrum    2 weight  0.10000E+01 volume  0.21916E-02 ppm1      1.493 ppm2      1.692 CV     1
 OR { 1288}
   (( segid "AREF" and resid 64   and name HG2 ))
   (( segid "AREF" and resid 64   and name HD1 ))
 OR { 1288}
   (( segid "AREF" and resid 64   and name HG2 ))
   (( segid "AREF" and resid 64   and name HD2 ))
 OR { 1288}
   (( segid "AREF" and resid 64   and name HG1 ))
   (( segid "AREF" and resid 64   and name HD1 ))
 OR { 1288}
   (( segid "AREF" and resid 64   and name HG1 ))
   (( segid "AREF" and resid 64   and name HD2 ))
 OR { 1288}
   (( segid "AREF" and resid 64   and name HG1 ))
   (( segid "AREF" and resid 64   and name HB1 ))
 ASSI { 1294}
   (  segid "AREF" and resid 66   and name HD1%)
   (( segid "AREF" and resid 64   and name HE1 ))
      2.300     0.700     0.700 peak  1294 spectrum    2 weight  0.10000E+01 volume  0.56820E-02 ppm1      0.882 ppm2      3.008 CV     1
 OR { 1294}
   (  segid "AREF" and resid 66   and name HD1%)
   (( segid "AREF" and resid 64   and name HE2 ))
 ASSI { 1296}
   (  segid "AREF" and resid 143  and name HD2%)
   (( segid "AREF" and resid 141  and name HN  ))
      3.300     3.300     2.700 peak  1296 spectrum    2 weight  0.10000E+01 volume  0.62339E-02 ppm1      0.830 ppm2      6.729 CV     1
 ASSI { 1298}
   (  segid "AREF" and resid 74   and name HD2%)
   (( segid "AREF" and resid 71   and name HG1 ))
      2.900     1.100     1.100 peak  1298 spectrum    2 weight  0.10000E+01 volume  0.32143E-02 ppm1      0.828 ppm2      2.055 CV     1
 OR { 1298}
   (  segid "AREF" and resid 74   and name HD2%)
   (( segid "AREF" and resid 71   and name HG2 ))
 ASSI { 1301}
   (  segid "AREF" and resid 170  and name HD2%)
   (( segid "AREF" and resid 167  and name HG2 ))
      2.100     2.100     3.900 peak  1301 spectrum    2 weight  0.10000E+01 volume  0.38961E-02 ppm1      0.822 ppm2      2.292 CV     1
 OR { 1301}
   (  segid "AREF" and resid 170  and name HD2%)
   (( segid "AREF" and resid 167  and name HG1 ))
 ASSI { 1308}
   (( segid "AREF" and resid 69   and name HG2 ))
   (( segid "AREF" and resid 69   and name HE1 ))
      2.700     0.900     0.900 peak  1308 spectrum    2 weight  0.10000E+01 volume  0.39773E-02 ppm1      1.206 ppm2      2.864 CV     1
 OR { 1308}
   (( segid "AREF" and resid 69   and name HG1 ))
   (( segid "AREF" and resid 69   and name HE1 ))
 OR { 1308}
   (( segid "AREF" and resid 69   and name HG2 ))
   (( segid "AREF" and resid 69   and name HE2 ))
 OR { 1308}
   (( segid "AREF" and resid 69   and name HG1 ))
   (( segid "AREF" and resid 69   and name HE2 ))
 ASSI { 1309}
   (( segid "AREF" and resid 69   and name HG2 ))
   (( segid "AREF" and resid 69   and name HB1 ))
      2.600     0.800     0.800 peak  1309 spectrum    2 weight  0.10000E+01 volume  0.29058E-02 ppm1      1.196 ppm2      1.620 CV     1
 OR { 1309}
   (( segid "AREF" and resid 69   and name HG1 ))
   (( segid "AREF" and resid 69   and name HB2 ))
 OR { 1309}
   (( segid "AREF" and resid 69   and name HG2 ))
   (( segid "AREF" and resid 69   and name HB2 ))
 OR { 1309}
   (( segid "AREF" and resid 69   and name HG1 ))
   (( segid "AREF" and resid 69   and name HB1 ))
 ASSI { 1310}
   (( segid "AREF" and resid 69   and name HG1 ))
   (( segid "AREF" and resid 69   and name HA  ))
      2.600     0.800     0.800 peak  1310 spectrum    2 weight  0.10000E+01 volume  0.45942E-02 ppm1      1.191 ppm2      4.188 CV     1
 OR { 1310}
   (( segid "AREF" and resid 69   and name HG2 ))
   (( segid "AREF" and resid 69   and name HA  ))
 ASSI { 1319}
   (  segid "AREF" and resid 74   and name HD2%)
   (( segid "AREF" and resid 75   and name HN  ))
      3.600     1.600     1.600 peak  1319 spectrum    2 weight  0.10000E+01 volume  0.41558E-02 ppm1      0.829 ppm2      8.081 CV     1
 ASSI { 1350}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 143  and name HB1 ))
      3.000     1.100     1.100 peak  1350 spectrum    2 weight  0.10000E+01 volume  0.26624E-02 ppm1      0.773 ppm2      1.445 CV     1
 ASSI { 1359}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 109  and name HZ  ))
      3.200     3.200     2.800 peak  1359 spectrum    2 weight  0.10000E+01 volume  0.59577E-02 ppm1     -0.068 ppm2      7.136 CV     1
 ASSI { 1360}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 122  and name HA  ))
      2.700     0.900     0.900 peak  1360 spectrum    2 weight  0.10000E+01 volume  0.61201E-02 ppm1      0.942 ppm2      5.034 CV     1
 ASSI { 1361}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 123  and name HN  ))
      2.600     0.900     0.900 peak  1361 spectrum    2 weight  0.10000E+01 volume  0.48377E-02 ppm1      0.938 ppm2      8.993 CV     1
 ASSI { 1362}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 129  and name HN  ))
      2.700     2.700     3.300 peak  1362 spectrum    2 weight  0.10000E+01 volume  0.52922E-02 ppm1      0.938 ppm2      8.760 CV     1
 ASSI { 1364}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 94   and name HB2 ))
      3.000     3.000     3.000 peak  1364 spectrum    2 weight  0.10000E+01 volume  0.44968E-02 ppm1      0.937 ppm2      3.972 CV     1
 ASSI { 1365}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 130  and name HA1 ))
      3.500     1.500     1.500 peak  1365 spectrum    2 weight  0.10000E+01 volume  0.53085E-02 ppm1      0.937 ppm2      3.429 CV     1
 ASSI { 1366}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 123  and name HB1 ))
      3.100     1.200     1.200 peak  1366 spectrum    2 weight  0.10000E+01 volume  0.37662E-02 ppm1      0.939 ppm2      2.695 CV     1
 ASSI { 1367}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 129  and name HG  ))
      2.700     0.900     0.900 peak  1367 spectrum    2 weight  0.10000E+01 volume  0.30357E-02 ppm1      0.940 ppm2      1.528 CV     1
 OR { 1367}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 129  and name HB2 ))
 ASSI { 1370}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 126  and name HN  ))
      2.100     2.100     3.900 peak  1370 spectrum    2 weight  0.10000E+01 volume  0.42208E-02 ppm1      0.933 ppm2      8.201 CV     1
 ASSI { 1380}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 143  and name HN  ))
      3.800     1.800     1.800 peak  1380 spectrum    2 weight  0.10000E+01 volume  0.43182E-02 ppm1      0.778 ppm2      7.838 CV     1
 ASSI { 1381}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 144  and name HN  ))
      3.900     1.900     1.900 peak  1381 spectrum    2 weight  0.10000E+01 volume  0.41883E-02 ppm1      0.777 ppm2      7.264 CV     1
 ASSI { 1383}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 143  and name HA  ))
      3.400     1.500     1.500 peak  1383 spectrum    2 weight  0.10000E+01 volume  0.33766E-02 ppm1      0.778 ppm2      3.817 CV     1
 ASSI { 1384}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 147  and name HE2 ))
      2.800     1.000     1.000 peak  1384 spectrum    2 weight  0.10000E+01 volume  0.46266E-02 ppm1      0.777 ppm2      2.950 CV     1
 OR { 1384}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 147  and name HE1 ))
 ASSI { 1385}
   (  segid "AREF" and resid 170  and name HD1%)
   (( segid "AREF" and resid 169  and name HB1 ))
      2.600     0.800     0.800 peak  1385 spectrum    2 weight  0.10000E+01 volume  0.48700E-02 ppm1      0.777 ppm2      2.625 CV     1
 ASSI { 1386}
   (  segid "AREF" and resid 170  and name HD1%)
   (( segid "AREF" and resid 167  and name HB2 ))
      2.200     2.200     3.800 peak  1386 spectrum    2 weight  0.10000E+01 volume  0.30357E-02 ppm1      0.777 ppm2      2.065 CV     1
 ASSI { 1390}
   (  segid "AREF" and resid 170  and name HD1%)
   (( segid "AREF" and resid 171  and name HB1 ))
      3.900     1.900     1.900 peak  1390 spectrum    2 weight  0.10000E+01 volume  0.35065E-02 ppm1      0.774 ppm2      1.893 CV     1
 OR { 1390}
   (  segid "AREF" and resid 170  and name HD1%)
   (( segid "AREF" and resid 171  and name HB2 ))
 ASSI { 1391}
   (  segid "AREF" and resid 170  and name HD1%)
   (( segid "AREF" and resid 170  and name HN  ))
      2.800     1.000     1.000 peak  1391 spectrum    2 weight  0.10000E+01 volume  0.39610E-02 ppm1      0.770 ppm2      8.098 CV     1
 ASSI { 1394}
   (  segid "AREF" and resid 170  and name HD1%)
   (( segid "AREF" and resid 170  and name HA  ))
      2.900     1.000     1.000 peak  1394 spectrum    2 weight  0.10000E+01 volume  0.33279E-02 ppm1      0.770 ppm2      4.208 CV     1
 ASSI { 1397}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 136  and name HA  ))
      2.500     2.500     3.500 peak  1397 spectrum    2 weight  0.10000E+01 volume  0.48541E-02 ppm1     -0.059 ppm2      4.875 CV     1
 ASSI { 1398}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 115  and name HA  ))
      2.600     0.800     0.800 peak  1398 spectrum    2 weight  0.10000E+01 volume  0.41234E-02 ppm1     -0.059 ppm2      4.476 CV     1
 ASSI { 1402}
   (  segid "AREF" and resid 115  and name HD1%)
   (  segid "AREF" and resid 134  and name HG2%)
      2.600     0.900     0.900 peak  1402 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1     -0.059 ppm2      0.304 CV     1
 OR { 1402}
   (  segid "AREF" and resid 115  and name HD1%)
   (  segid "AREF" and resid 134  and name HG1%)
 ASSI { 1403}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 116  and name HN  ))
      2.800     1.000     1.000 peak  1403 spectrum    2 weight  0.10000E+01 volume  0.49187E-02 ppm1     -0.064 ppm2      8.877 CV     1
 ASSI { 1404}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 117  and name HN  ))
      2.500     0.800     0.800 peak  1404 spectrum    2 weight  0.10000E+01 volume  0.52758E-02 ppm1     -0.063 ppm2      7.434 CV     1
 ASSI { 1405}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 115  and name HG  ))
      2.400     0.700     0.700 peak  1405 spectrum    2 weight  0.10000E+01 volume  0.35390E-02 ppm1     -0.062 ppm2      1.618 CV     1
 OR { 1405}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 115  and name HB1 ))
 OR { 1405}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 115  and name HB2 ))
 ASSI { 1416}
   (  segid "AREF" and resid 129  and name HD2%)
   (( segid "AREF" and resid 132  and name HN  ))
      3.400     3.400     2.600 peak  1416 spectrum    2 weight  0.10000E+01 volume  0.53085E-02 ppm1      0.927 ppm2      9.164 CV     1
 ASSI { 1417}
   (  segid "AREF" and resid 129  and name HD2%)
   (  segid "AREF" and resid 96   and name HD1%)
      2.100     2.100     3.900 peak  1417 spectrum    2 weight  0.10000E+01 volume  0.37500E-02 ppm1      0.928 ppm2      0.507 CV     1
 ASSI { 1421}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 146  and name HG2 ))
      3.600     1.600     1.600 peak  1421 spectrum    2 weight  0.10000E+01 volume  0.50975E-02 ppm1      0.770 ppm2      2.408 CV     1
 OR { 1421}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 146  and name HG1 ))
 ASSI { 1436}
   (  segid "AREF" and resid 120  and name HG1%)
   (  segid "AREF" and resid 120  and name HG2%)
      2.700     0.900     0.900 peak  1436 spectrum    2 weight  0.10000E+01 volume  0.31656E-02 ppm1      0.745 ppm2      0.495 CV     1
 ASSI { 1437}
   (  segid "AREF" and resid 119  and name HB% )
   (  segid "AREF" and resid 132  and name HB% )
      3.100     1.200     1.200 peak  1437 spectrum    2 weight  0.10000E+01 volume  0.68185E-02 ppm1      1.382 ppm2      0.909 CV     1
 ASSI { 1438}
   (  segid "AREF" and resid 119  and name HB% )
   (( segid "AREF" and resid 117  and name HA  ))
      3.300     3.300     2.700 peak  1438 spectrum    2 weight  0.10000E+01 volume  0.47403E-02 ppm1      1.380 ppm2      4.221 CV     1
 ASSI { 1439}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 136  and name HN  ))
      2.000     0.500     0.500 peak  1439 spectrum    2 weight  0.10000E+01 volume  0.10974E-01 ppm1      1.238 ppm2      9.242 CV     1
 ASSI { 1442}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 90   and name HN  ))
      3.000     1.200     1.200 peak  1442 spectrum    2 weight  0.10000E+01 volume  0.47890E-02 ppm1      1.235 ppm2      8.550 CV     1
 ASSI { 1443}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 89   and name HN  ))
      2.300     0.700     0.700 peak  1443 spectrum    2 weight  0.10000E+01 volume  0.47240E-02 ppm1      1.235 ppm2      8.069 CV     1
 ASSI { 1444}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 139  and name HA  ))
      2.100     0.600     0.600 peak  1444 spectrum    2 weight  0.10000E+01 volume  0.44481E-02 ppm1      1.236 ppm2      3.678 CV     1
 ASSI { 1445}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 139  and name HB1 ))
      3.300     1.400     1.400 peak  1445 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      1.236 ppm2      1.823 CV     1
 OR { 1445}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 139  and name HB2 ))
 ASSI { 1447}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 138  and name HB1 ))
      3.100     1.200     1.200 peak  1447 spectrum    2 weight  0.10000E+01 volume  0.44643E-02 ppm1      1.212 ppm2      1.955 CV     1
 OR { 1447}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 138  and name HB2 ))
 ASSI { 1450}
   (  segid "AREF" and resid 120  and name HG1%)
   (( segid "AREF" and resid 133  and name HN  ))
      3.900     1.900     1.900 peak  1450 spectrum    2 weight  0.10000E+01 volume  0.40584E-02 ppm1      0.744 ppm2      8.190 CV     1
 ASSI { 1451}
   (  segid "AREF" and resid 120  and name HG1%)
   (( segid "AREF" and resid 102  and name HA  ))
      2.700     0.900     0.900 peak  1451 spectrum    2 weight  0.10000E+01 volume  0.36851E-02 ppm1      0.745 ppm2      4.166 CV     1
 ASSI { 1454}
   (  segid "AREF" and resid 134  and name HG2%)
   (( segid "AREF" and resid 135  and name HN  ))
      2.300     2.300     3.700 peak  1454 spectrum    2 weight  0.10000E+01 volume  0.72565E-02 ppm1      0.306 ppm2      9.203 CV     1
 ASSI { 1456}
   (  segid "AREF" and resid 134  and name HG2%)
   (  segid "AREF" and resid 118  and name HB% )
      3.300     1.400     1.400 peak  1456 spectrum    2 weight  0.10000E+01 volume  0.36526E-02 ppm1      0.307 ppm2      1.247 CV     1
 ASSI { 1457}
   (  segid "AREF" and resid 134  and name HG2%)
   (  segid "AREF" and resid 91   and name HD1%)
      2.200     0.600     0.600 peak  1457 spectrum    2 weight  0.10000E+01 volume  0.32955E-02 ppm1      0.308 ppm2      0.767 CV     1
 ASSI { 1458}
   (  segid "AREF" and resid 134  and name HG2%)
   (  segid "AREF" and resid 115  and name HD1%)
      2.500     0.800     0.800 peak  1458 spectrum    2 weight  0.10000E+01 volume  0.45779E-02 ppm1      0.307 ppm2     -0.062 CV     1
 ASSI { 1459}
   (  segid "AREF" and resid 134  and name HG2%)
   (( segid "AREF" and resid 134  and name HN  ))
      1.800     1.800     4.200 peak  1459 spectrum    2 weight  0.10000E+01 volume  0.10958E-01 ppm1      0.300 ppm2      8.235 CV     1
 ASSI { 1460}
   (  segid "AREF" and resid 134  and name HG2%)
   (( segid "AREF" and resid 118  and name HA  ))
      3.100     1.200     1.200 peak  1460 spectrum    2 weight  0.10000E+01 volume  0.60714E-02 ppm1      0.302 ppm2      4.912 CV     1
 ASSI { 1461}
   (  segid "AREF" and resid 119  and name HB% )
   (( segid "AREF" and resid 120  and name HN  ))
      2.700     0.900     0.900 peak  1461 spectrum    2 weight  0.10000E+01 volume  0.45292E-02 ppm1      1.381 ppm2      9.260 CV     1
 ASSI { 1464}
   (  segid "AREF" and resid 119  and name HB% )
   (( segid "AREF" and resid 133  and name HN  ))
      2.800     1.000     1.000 peak  1464 spectrum    2 weight  0.10000E+01 volume  0.40584E-02 ppm1      1.379 ppm2      8.176 CV     1
 ASSI { 1468}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 88   and name HN  ))
      3.200     3.200     2.800 peak  1468 spectrum    2 weight  0.10000E+01 volume  0.41721E-02 ppm1      1.210 ppm2      8.843 CV     1
 ASSI { 1471}
   (  segid "AREF" and resid 93   and name HG1%)
   (( segid "AREF" and resid 92   and name HB1 ))
      3.200     3.200     2.800 peak  1471 spectrum    2 weight  0.10000E+01 volume  0.53736E-02 ppm1      1.060 ppm2      1.424 CV     1
 ASSI { 1472}
   (  segid "AREF" and resid 93   and name HG1%)
   (  segid "AREF" and resid 120  and name HG2%)
      3.600     1.700     1.700 peak  1472 spectrum    2 weight  0.10000E+01 volume  0.40098E-02 ppm1      1.057 ppm2      0.506 CV     1
 ASSI { 1479}
   (  segid "AREF" and resid 134  and name HG2%)
   (( segid "AREF" and resid 109  and name HZ  ))
      3.000     1.100     1.100 peak  1479 spectrum    2 weight  0.10000E+01 volume  0.49187E-02 ppm1      0.305 ppm2      7.116 CV     1
 ASSI { 1480}
   (  segid "AREF" and resid 119  and name HB% )
   (  segid "AREF" and resid 120  and name HG2%)
      3.200     1.300     1.300 peak  1480 spectrum    2 weight  0.10000E+01 volume  0.97563E-02 ppm1      1.382 ppm2      0.507 CV     1
 ASSI { 1481}
   (  segid "AREF" and resid 119  and name HB% )
   (( segid "AREF" and resid 133  and name HB1 ))
      3.000     3.000     3.000 peak  1481 spectrum    2 weight  0.10000E+01 volume  0.72242E-02 ppm1      1.376 ppm2      2.553 CV     1
 ASSI { 1484}
   (  segid "AREF" and resid 93   and name HG1%)
   (( segid "AREF" and resid 160  and name HB1 ))
      3.400     3.400     2.600 peak  1484 spectrum    2 weight  0.10000E+01 volume  0.45455E-02 ppm1      1.054 ppm2      2.474 CV     1
 ASSI { 1486}
   (  segid "AREF" and resid 93   and name HG1%)
   (  segid "AREF" and resid 118  and name HB% )
      3.600     1.600     1.600 peak  1486 spectrum    2 weight  0.10000E+01 volume  0.44968E-02 ppm1      1.048 ppm2      1.258 CV     1
 ASSI { 1503}
   (  segid "AREF" and resid 93   and name HG2%)
   (( segid "AREF" and resid 109  and name HZ  ))
      3.500     1.500     1.500 peak  1503 spectrum    2 weight  0.10000E+01 volume  0.47565E-02 ppm1      0.751 ppm2      7.081 CV     1
 ASSI { 1504}
   (  segid "AREF" and resid 93   and name HG2%)
   (( segid "AREF" and resid 93   and name HN  ))
      2.300     2.300     3.700 peak  1504 spectrum    2 weight  0.10000E+01 volume  0.49187E-02 ppm1      0.746 ppm2      8.976 CV     1
 ASSI { 1506}
   (  segid "AREF" and resid 87   and name HG2%)
   (  segid "AREF" and resid 85   and name HG2%)
      2.100     2.100     3.900 peak  1506 spectrum    2 weight  0.10000E+01 volume  0.34416E-02 ppm1      1.254 ppm2      0.887 CV     1
 ASSI { 1524}
   (  segid "AREF" and resid 36   and name HG2%)
   (( segid "AREF" and resid 36   and name HB  ))
      2.700     0.900     0.900 peak  1524 spectrum    2 weight  0.10000E+01 volume  0.25812E-02 ppm1      0.916 ppm2      2.077 CV     1
 OR { 1524}
   (  segid "AREF" and resid 36   and name HG1%)
   (( segid "AREF" and resid 36   and name HB  ))
 ASSI { 1525}
   (  segid "AREF" and resid 36   and name HG1%)
   (( segid "AREF" and resid 38   and name HG2 ))
      3.000     1.100     1.100 peak  1525 spectrum    2 weight  0.10000E+01 volume  0.39610E-02 ppm1      0.914 ppm2      1.650 CV     1
 OR { 1525}
   (  segid "AREF" and resid 36   and name HG2%)
   (( segid "AREF" and resid 38   and name HG2 ))
 OR { 1525}
   (  segid "AREF" and resid 36   and name HG1%)
   (( segid "AREF" and resid 38   and name HG1 ))
 OR { 1525}
   (  segid "AREF" and resid 36   and name HG2%)
   (( segid "AREF" and resid 38   and name HG1 ))
 ASSI { 1542}
   (  segid "AREF" and resid 152  and name HG1%)
   (( segid "AREF" and resid 158  and name HB2 ))
      3.400     3.400     2.600 peak  1542 spectrum    2 weight  0.10000E+01 volume  0.36851E-02 ppm1      1.070 ppm2      1.868 CV     1
 ASSI { 1547}
   (  segid "AREF" and resid 36   and name HG1%)
   (( segid "AREF" and resid 38   and name HD2 ))
      2.600     0.900     0.900 peak  1547 spectrum    2 weight  0.10000E+01 volume  0.61037E-02 ppm1      0.920 ppm2      3.176 CV     1
 OR { 1547}
   (  segid "AREF" and resid 36   and name HG2%)
   (( segid "AREF" and resid 38   and name HD2 ))
 OR { 1547}
   (  segid "AREF" and resid 36   and name HG1%)
   (( segid "AREF" and resid 38   and name HD1 ))
 OR { 1547}
   (  segid "AREF" and resid 36   and name HG2%)
   (( segid "AREF" and resid 38   and name HD1 ))
 ASSI { 1551}
   (  segid "AREF" and resid 85   and name HG2%)
   (( segid "AREF" and resid 86   and name HN  ))
      3.000     1.100     1.100 peak  1551 spectrum    2 weight  0.10000E+01 volume  0.36039E-02 ppm1      0.896 ppm2      8.525 CV     1
 OR { 1551}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 86   and name HN  ))
 ASSI { 1552}
   (  segid "AREF" and resid 164  and name HG1%)
   (( segid "AREF" and resid 163  and name HA  ))
      2.000     2.000     4.000 peak  1552 spectrum    2 weight  0.10000E+01 volume  0.49350E-02 ppm1      0.802 ppm2      4.741 CV     1
 OR { 1552}
   (  segid "AREF" and resid 164  and name HG2%)
   (( segid "AREF" and resid 163  and name HA  ))
 ASSI { 1554}
   (  segid "AREF" and resid 120  and name HG2%)
   (( segid "AREF" and resid 120  and name HN  ))
      2.200     0.600     0.600 peak  1554 spectrum    2 weight  0.10000E+01 volume  0.72401E-02 ppm1      0.477 ppm2      9.263 CV     1
 ASSI { 1563}
   (  segid "AREF" and resid 152  and name HG1%)
   (( segid "AREF" and resid 112  and name HZ  ))
      1.900     1.900     4.100 peak  1563 spectrum    2 weight  0.10000E+01 volume  0.67857E-02 ppm1      1.069 ppm2      6.862 CV     1
 ASSI { 1568}
   (  segid "AREF" and resid 85   and name HG2%)
   (( segid "AREF" and resid 85   and name HN  ))
      2.800     1.000     1.000 peak  1568 spectrum    2 weight  0.10000E+01 volume  0.38150E-02 ppm1      0.899 ppm2      7.861 CV     1
 OR { 1568}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 85   and name HN  ))
 ASSI { 1574}
   (  segid "AREF" and resid 120  and name HG2%)
   (( segid "AREF" and resid 121  and name HN  ))
      3.000     1.100     1.100 peak  1574 spectrum    2 weight  0.10000E+01 volume  0.57466E-02 ppm1      0.484 ppm2      8.443 CV     1
 ASSI { 1575}
   (  segid "AREF" and resid 120  and name HG2%)
   (  segid "AREF" and resid 122  and name HE% )
      2.500     2.500     3.500 peak  1575 spectrum    2 weight  0.10000E+01 volume  0.68021E-02 ppm1      0.485 ppm2      6.936 CV     1
 OR { 1575}
   (  segid "AREF" and resid 120  and name HG2%)
   (  segid "AREF" and resid 122  and name HD% )
 ASSI { 1577}
   (  segid "AREF" and resid 120  and name HG2%)
   (( segid "AREF" and resid 120  and name HA  ))
      2.600     0.800     0.800 peak  1577 spectrum    2 weight  0.10000E+01 volume  0.50001E-02 ppm1      0.483 ppm2      3.942 CV     1
 ASSI { 1578}
   (  segid "AREF" and resid 120  and name HG2%)
   (( segid "AREF" and resid 120  and name HB  ))
      2.300     0.700     0.700 peak  1578 spectrum    2 weight  0.10000E+01 volume  0.46753E-02 ppm1      0.482 ppm2      1.960 CV     1
 ASSI { 1579}
   (  segid "AREF" and resid 120  and name HG2%)
   (  segid "AREF" and resid 93   and name HG2%)
      3.800     1.800     1.800 peak  1579 spectrum    2 weight  0.10000E+01 volume  0.35065E-02 ppm1      0.482 ppm2      0.772 CV     1
 ASSI { 1581}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 106  and name HA  ))
      2.100     0.600     0.600 peak  1581 spectrum    2 weight  0.10000E+01 volume  0.58281E-02 ppm1      1.256 ppm2      3.687 CV     1
 ASSI { 1582}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 118  and name HN  ))
      2.300     0.700     0.700 peak  1582 spectrum    2 weight  0.10000E+01 volume  0.45942E-02 ppm1      1.253 ppm2      8.664 CV     1
 ASSI { 1583}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 119  and name HN  ))
      2.900     1.000     1.000 peak  1583 spectrum    2 weight  0.10000E+01 volume  0.42533E-02 ppm1      1.252 ppm2      8.172 CV     1
 ASSI { 1585}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 118  and name HA  ))
      2.100     0.500     0.500 peak  1585 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      1.255 ppm2      4.908 CV     1
 ASSI { 1586}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 106  and name HG2 ))
      2.400     0.700     0.700 peak  1586 spectrum    2 weight  0.10000E+01 volume  0.38799E-02 ppm1      1.253 ppm2      2.427 CV     1
 OR { 1586}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 106  and name HG1 ))
 ASSI { 1590}
   (  segid "AREF" and resid 85   and name HG2%)
   (( segid "AREF" and resid 83   and name HG2 ))
      2.100     2.100     3.900 peak  1590 spectrum    2 weight  0.10000E+01 volume  0.38312E-02 ppm1      0.881 ppm2      2.256 CV     1
 OR { 1590}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 83   and name HG2 ))
 OR { 1590}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 83   and name HG1 ))
 ASSI { 1594}
   (  segid "AREF" and resid 118  and name HB% )
   (  segid "AREF" and resid 134  and name HG1%)
      2.200     0.600     0.600 peak  1594 spectrum    2 weight  0.10000E+01 volume  0.39448E-02 ppm1      1.253 ppm2      0.286 CV     1
 OR { 1594}
   (  segid "AREF" and resid 118  and name HB% )
   (  segid "AREF" and resid 134  and name HG2%)
 ASSI { 1596}
   (  segid "AREF" and resid 118  and name HB% )
   (  segid "AREF" and resid 115  and name HD1%)
      2.200     0.600     0.600 peak  1596 spectrum    2 weight  0.10000E+01 volume  0.54869E-02 ppm1      1.249 ppm2     -0.064 CV     1
 ASSI { 1597}
   (  segid "AREF" and resid 165  and name HB% )
   (( segid "AREF" and resid 165  and name HN  ))
      2.800     1.000     1.000 peak  1597 spectrum    2 weight  0.10000E+01 volume  0.34253E-02 ppm1      1.398 ppm2      8.485 CV     1
 ASSI { 1602}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 145  and name HA  ))
      2.200     0.600     0.600 peak  1602 spectrum    2 weight  0.10000E+01 volume  0.41558E-02 ppm1      1.157 ppm2      2.432 CV     1
 ASSI { 1603}
   (  segid "AREF" and resid 165  and name HB% )
   (  segid "AREF" and resid 168  and name HG2%)
      3.600     1.600     1.600 peak  1603 spectrum    2 weight  0.10000E+01 volume  0.28734E-02 ppm1      1.390 ppm2      0.876 CV     1
 ASSI { 1604}
   (  segid "AREF" and resid 48   and name HB% )
   (( segid "AREF" and resid 46   and name HN  ))
      2.100     2.100     3.900 peak  1604 spectrum    2 weight  0.10000E+01 volume  0.34416E-02 ppm1      1.383 ppm2      8.189 CV     1
 ASSI { 1609}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 109  and name HZ  ))
      2.300     0.600     0.600 peak  1609 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      1.159 ppm2      7.097 CV     1
 ASSI { 1610}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 141  and name HA  ))
      2.000     2.000     4.000 peak  1610 spectrum    2 weight  0.10000E+01 volume  0.53249E-02 ppm1      1.155 ppm2      4.316 CV     1
 ASSI { 1613}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 146  and name HN  ))
      2.200     0.600     0.600 peak  1613 spectrum    2 weight  0.10000E+01 volume  0.64449E-02 ppm1      1.148 ppm2      8.079 CV     1
 ASSI { 1615}
   (  segid "AREF" and resid 16   and name HB% )
   (( segid "AREF" and resid 16   and name HA  ))
      2.600     0.900     0.900 peak  1615 spectrum    2 weight  0.10000E+01 volume  0.32143E-02 ppm1      1.431 ppm2      4.247 CV     1
 ASSI { 1616}
   (  segid "AREF" and resid 16   and name HB% )
   (( segid "AREF" and resid 16   and name HN  ))
      3.000     1.100     1.100 peak  1616 spectrum    2 weight  0.10000E+01 volume  0.39124E-02 ppm1      1.425 ppm2      7.908 CV     1
 ASSI { 1618}
   (  segid "AREF" and resid 48   and name HB% )
   (( segid "AREF" and resid 49   and name HN  ))
      3.500     1.600     1.600 peak  1618 spectrum    2 weight  0.10000E+01 volume  0.41397E-02 ppm1      1.376 ppm2      8.011 CV     1
 ASSI { 1625}
   (  segid "AREF" and resid 16   and name HB% )
   (( segid "AREF" and resid 13   and name HB2 ))
      2.900     1.000     1.000 peak  1625 spectrum    2 weight  0.10000E+01 volume  0.42370E-02 ppm1      1.430 ppm2      2.787 CV     1
 ASSI { 1626}
   (  segid "AREF" and resid 140  and name HB% )
   (  segid "AREF" and resid 142  and name HB% )
      3.900     1.900     1.900 peak  1626 spectrum    2 weight  0.10000E+01 volume  0.37338E-02 ppm1      1.414 ppm2      1.163 CV     1
 ASSI { 1628}
   (  segid "AREF" and resid 140  and name HB% )
   (( segid "AREF" and resid 139  and name HA  ))
      3.000     3.000     3.000 peak  1628 spectrum    2 weight  0.10000E+01 volume  0.86850E-02 ppm1      1.395 ppm2      3.663 CV     1
 ASSI { 1629}
   (  segid "AREF" and resid 50   and name HB% )
   (( segid "AREF" and resid 51   and name HD1 ))
      2.700     0.900     0.900 peak  1629 spectrum    2 weight  0.10000E+01 volume  0.49514E-02 ppm1      1.383 ppm2      3.196 CV     1
 OR { 1629}
   (  segid "AREF" and resid 50   and name HB% )
   (( segid "AREF" and resid 51   and name HD2 ))
 ASSI { 1631}
   (  segid "AREF" and resid 142  and name HB% )
   (( segid "AREF" and resid 142  and name HA  ))
      2.300     0.600     0.600 peak  1631 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      1.148 ppm2      2.824 CV     1
 ASSI { 1633}
   (  segid "AREF" and resid 142  and name HB% )
   (( segid "AREF" and resid 163  and name HA  ))
      2.800     1.000     1.000 peak  1633 spectrum    2 weight  0.10000E+01 volume  0.48541E-02 ppm1      1.142 ppm2      4.741 CV     1
 ASSI { 1635}
   (  segid "AREF" and resid 142  and name HB% )
   (( segid "AREF" and resid 143  and name HN  ))
      2.400     0.700     0.700 peak  1635 spectrum    2 weight  0.10000E+01 volume  0.64609E-02 ppm1      1.140 ppm2      7.846 CV     1
 ASSI { 1637}
   (  segid "AREF" and resid 140  and name HB% )
   (( segid "AREF" and resid 144  and name HN  ))
      3.000     1.100     1.100 peak  1637 spectrum    2 weight  0.10000E+01 volume  0.47565E-02 ppm1      1.404 ppm2      7.294 CV     1
 ASSI { 1638}
   (  segid "AREF" and resid 16   and name HB% )
   (( segid "AREF" and resid 18   and name HB2 ))
      3.400     3.400     2.600 peak  1638 spectrum    2 weight  0.10000E+01 volume  0.38799E-02 ppm1      1.403 ppm2      1.886 CV     1
 ASSI { 1639}
   (  segid "AREF" and resid 140  and name HB% )
   (( segid "AREF" and resid 140  and name HN  ))
      2.500     0.800     0.800 peak  1639 spectrum    2 weight  0.10000E+01 volume  0.37338E-02 ppm1      1.398 ppm2      9.131 CV     1
 ASSI { 1643}
   (  segid "AREF" and resid 140  and name HB% )
   (( segid "AREF" and resid 141  and name HN  ))
      2.500     0.800     0.800 peak  1643 spectrum    2 weight  0.10000E+01 volume  0.40584E-02 ppm1      1.397 ppm2      6.729 CV     1
 ASSI { 1646}
   (  segid "AREF" and resid 142  and name HB% )
   (( segid "AREF" and resid 139  and name HA  ))
      2.300     0.600     0.600 peak  1646 spectrum    2 weight  0.10000E+01 volume  0.60551E-02 ppm1      1.145 ppm2      3.665 CV     1
 ASSI { 1653}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 111  and name HB2 ))
      2.900     1.100     1.100 peak  1653 spectrum    2 weight  0.10000E+01 volume  0.10958E-01 ppm1      1.572 ppm2      1.804 CV     1
 ASSI { 1654}
   (  segid "AREF" and resid 140  and name HB% )
   (( segid "AREF" and resid 145  and name HN  ))
      3.500     3.500     2.500 peak  1654 spectrum    2 weight  0.10000E+01 volume  0.39124E-02 ppm1      1.411 ppm2      7.542 CV     1
 ASSI { 1656}
   (  segid "AREF" and resid 103  and name HB% )
   (( segid "AREF" and resid 103  and name HN  ))
      2.500     0.800     0.800 peak  1656 spectrum    2 weight  0.10000E+01 volume  0.34903E-02 ppm1      1.405 ppm2      8.194 CV     1
 ASSI { 1658}
   (  segid "AREF" and resid 58   and name HB% )
   (( segid "AREF" and resid 59   and name HG1 ))
      3.700     1.700     1.700 peak  1658 spectrum    2 weight  0.10000E+01 volume  0.72888E-02 ppm1      1.321 ppm2      1.947 CV     1
 OR { 1658}
   (  segid "AREF" and resid 58   and name HB% )
   (( segid "AREF" and resid 59   and name HG2 ))
 ASSI { 1668}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 109  and name HN  ))
      3.300     1.400     1.400 peak  1668 spectrum    2 weight  0.10000E+01 volume  0.47078E-02 ppm1      1.577 ppm2      7.925 CV     1
 ASSI { 1670}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 106  and name HG1 ))
      2.600     0.800     0.800 peak  1670 spectrum    2 weight  0.10000E+01 volume  0.50324E-02 ppm1      1.574 ppm2      2.426 CV     1
 OR { 1670}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 106  and name HG2 ))
 ASSI { 1671}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 107  and name HB1 ))
      1.800     1.800     4.200 peak  1671 spectrum    2 weight  0.10000E+01 volume  0.81332E-02 ppm1      1.576 ppm2      2.089 CV     1
 ASSI { 1672}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 110  and name HN  ))
      2.500     0.800     0.800 peak  1672 spectrum    2 weight  0.10000E+01 volume  0.37825E-02 ppm1      1.572 ppm2      8.517 CV     1
 ASSI { 1674}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 111  and name HN  ))
      2.400     0.700     0.700 peak  1674 spectrum    2 weight  0.10000E+01 volume  0.42695E-02 ppm1      1.572 ppm2      7.309 CV     1
 ASSI { 1678}
   (  segid "AREF" and resid 110  and name HB% )
   (  segid "AREF" and resid 115  and name HD2%)
      3.400     1.400     1.400 peak  1678 spectrum    2 weight  0.10000E+01 volume  0.38150E-02 ppm1      1.574 ppm2      0.722 CV     1
 ASSI { 1679}
   (  segid "AREF" and resid 110  and name HB% )
   (  segid "AREF" and resid 115  and name HD1%)
      3.200     3.200     2.800 peak  1679 spectrum    2 weight  0.10000E+01 volume  0.53895E-02 ppm1      1.571 ppm2     -0.069 CV     1
 ASSI { 1680}
   (  segid "AREF" and resid 58   and name HB% )
   (( segid "AREF" and resid 58   and name HN  ))
      2.500     0.800     0.800 peak  1680 spectrum    2 weight  0.10000E+01 volume  0.41558E-02 ppm1      1.320 ppm2      8.351 CV     1
 ASSI { 1682}
   (  segid "AREF" and resid 58   and name HB% )
   (( segid "AREF" and resid 59   and name HD1 ))
      3.000     1.200     1.200 peak  1682 spectrum    2 weight  0.10000E+01 volume  0.39448E-02 ppm1      1.320 ppm2      3.756 CV     1
 OR { 1682}
   (  segid "AREF" and resid 58   and name HB% )
   (( segid "AREF" and resid 59   and name HD2 ))
 ASSI { 1683}
   (  segid "AREF" and resid 58   and name HB% )
   (( segid "AREF" and resid 63   and name HD2 ))
      2.600     0.800     0.800 peak  1683 spectrum    2 weight  0.10000E+01 volume  0.38150E-02 ppm1      1.321 ppm2      3.600 CV     1
 OR { 1683}
   (  segid "AREF" and resid 58   and name HB% )
   (( segid "AREF" and resid 63   and name HD1 ))
 ASSI { 1689}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 30   and name HD22))
      2.200     0.600     0.600 peak  1689 spectrum    2 weight  0.10000E+01 volume  0.66883E-02 ppm1      0.908 ppm2      6.913 CV     1
 ASSI { 1692}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 20   and name HB1 ))
      3.500     1.600     1.600 peak  1692 spectrum    2 weight  0.10000E+01 volume  0.60878E-02 ppm1      0.905 ppm2      2.637 CV     1
 ASSI { 1693}
   (  segid "AREF" and resid 49   and name HG2%)
   (( segid "AREF" and resid 49   and name HA  ))
      3.100     1.200     1.200 peak  1693 spectrum    2 weight  0.10000E+01 volume  0.34253E-02 ppm1      0.897 ppm2      4.142 CV     1
 ASSI { 1695}
   (  segid "AREF" and resid 168  and name HG2%)
   (  segid "AREF" and resid 142  and name HB% )
      2.000     2.000     4.000 peak  1695 spectrum    2 weight  0.10000E+01 volume  0.52435E-02 ppm1      0.858 ppm2      1.102 CV     1
 ASSI { 1696}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 169  and name HN  ))
      2.000     2.000     4.000 peak  1696 spectrum    2 weight  0.10000E+01 volume  0.43994E-02 ppm1      0.853 ppm2      8.268 CV     1
 ASSI { 1697}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 168  and name HN  ))
      2.700     0.900     0.900 peak  1697 spectrum    2 weight  0.10000E+01 volume  0.44643E-02 ppm1      0.855 ppm2      8.096 CV     1
 ASSI { 1698}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 168  and name HB  ))
      2.500     0.800     0.800 peak  1698 spectrum    2 weight  0.10000E+01 volume  0.33929E-02 ppm1      0.854 ppm2      1.812 CV     1
 ASSI { 1699}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 170  and name HB2 ))
      1.800     1.800     4.200 peak  1699 spectrum    2 weight  0.10000E+01 volume  0.10926E-01 ppm1      0.853 ppm2      1.597 CV     1
 OR { 1699}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 170  and name HG  ))
 ASSI { 1700}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 168  and name HG11))
      3.100     1.200     1.200 peak  1700 spectrum    2 weight  0.10000E+01 volume  0.41072E-02 ppm1      0.854 ppm2      1.420 CV     1
 ASSI { 1701}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 168  and name HG12))
      2.400     0.700     0.700 peak  1701 spectrum    2 weight  0.10000E+01 volume  0.47890E-02 ppm1      0.853 ppm2      1.184 CV     1
 ASSI { 1707}
   (  segid "AREF" and resid 15   and name HE% )
   (( segid "AREF" and resid 18   and name HD2 ))
      3.000     1.100     1.100 peak  1707 spectrum    2 weight  0.10000E+01 volume  0.31818E-02 ppm1      2.068 ppm2      1.686 CV     1
 OR { 1707}
   (  segid "AREF" and resid 15   and name HE% )
   (( segid "AREF" and resid 18   and name HD1 ))
 ASSI { 1715}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 30   and name HD21))
      2.400     0.700     0.700 peak  1715 spectrum    2 weight  0.10000E+01 volume  0.55519E-02 ppm1      0.914 ppm2      7.609 CV     1
 ASSI { 1720}
   (  segid "AREF" and resid 27   and name HG2%)
   (( segid "AREF" and resid 24   and name HA  ))
      3.900     1.900     1.900 peak  1720 spectrum    2 weight  0.10000E+01 volume  0.40747E-02 ppm1      0.905 ppm2      4.425 CV     1
 ASSI { 1722}
   (  segid "AREF" and resid 49   and name HG2%)
   (( segid "AREF" and resid 50   and name HN  ))
      2.400     0.700     0.700 peak  1722 spectrum    2 weight  0.10000E+01 volume  0.61688E-02 ppm1      0.895 ppm2      8.316 CV     1
 ASSI { 1723}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 168  and name HA  ))
      2.600     0.800     0.800 peak  1723 spectrum    2 weight  0.10000E+01 volume  0.37176E-02 ppm1      0.854 ppm2      4.120 CV     1
 ASSI { 1724}
   (  segid "AREF" and resid 168  and name HG2%)
   (( segid "AREF" and resid 165  and name HA  ))
      2.300     0.700     0.700 peak  1724 spectrum    2 weight  0.10000E+01 volume  0.58926E-02 ppm1      0.848 ppm2      4.378 CV     1
 ASSI { 1726}
   (  segid "AREF" and resid 10   and name HE% )
   (( segid "AREF" and resid 9    and name HE22))
      1.900     1.900     4.100 peak  1726 spectrum    2 weight  0.10000E+01 volume  0.72242E-02 ppm1      2.077 ppm2      6.847 CV     1
 ASSI { 1727}
   (  segid "AREF" and resid 15   and name HE% )
   (( segid "AREF" and resid 17   and name HA  ))
      3.900     1.900     1.900 peak  1727 spectrum    2 weight  0.10000E+01 volume  0.42046E-02 ppm1      2.079 ppm2      4.517 CV     1
 ASSI { 1728}
   (  segid "AREF" and resid 15   and name HE% )
   (( segid "AREF" and resid 18   and name HA  ))
      3.000     1.100     1.100 peak  1728 spectrum    2 weight  0.10000E+01 volume  0.41883E-02 ppm1      2.076 ppm2      4.279 CV     1
 ASSI { 1730}
   (  segid "AREF" and resid 15   and name HE% )
   (( segid "AREF" and resid 17   and name HN  ))
      3.000     1.100     1.100 peak  1730 spectrum    2 weight  0.10000E+01 volume  0.37500E-02 ppm1      2.072 ppm2      8.114 CV     1
 ASSI { 1734}
   (  segid "AREF" and resid 10   and name HE% )
   (( segid "AREF" and resid 12   and name HD2 ))
      2.100     2.100     3.900 peak  1734 spectrum    2 weight  0.10000E+01 volume  0.41558E-02 ppm1      2.070 ppm2      3.147 CV     1
 OR { 1734}
   (  segid "AREF" and resid 10   and name HE% )
   (( segid "AREF" and resid 12   and name HD1 ))
 ASSI { 1769}
   (  segid "AREF" and resid 26   and name HD1%)
   (( segid "AREF" and resid 30   and name HD22))
      1.900     1.900     4.100 peak  1769 spectrum    2 weight  0.10000E+01 volume  0.72401E-02 ppm1      0.857 ppm2      6.901 CV     1
 ASSI { 1773}
   (  segid "AREF" and resid 26   and name HD1%)
   (( segid "AREF" and resid 26   and name HN  ))
      3.500     1.500     1.500 peak  1773 spectrum    2 weight  0.10000E+01 volume  0.40584E-02 ppm1      0.858 ppm2      7.950 CV     1
 ASSI { 1774}
   (  segid "AREF" and resid 26   and name HD1%)
   (( segid "AREF" and resid 23   and name HA  ))
      2.300     0.700     0.700 peak  1774 spectrum    2 weight  0.10000E+01 volume  0.36039E-02 ppm1      0.861 ppm2      4.239 CV     1
 ASSI { 1786}
   (  segid "AREF" and resid 26   and name HD1%)
   (( segid "AREF" and resid 30   and name HD21))
      1.900     1.900     4.100 peak  1786 spectrum    2 weight  0.10000E+01 volume  0.76136E-02 ppm1      0.854 ppm2      7.579 CV     1
 ASSI { 1788}
   (  segid "AREF" and resid 27   and name HD1%)
   (( segid "AREF" and resid 24   and name HA  ))
      2.200     0.600     0.600 peak  1788 spectrum    2 weight  0.10000E+01 volume  0.41397E-02 ppm1      0.848 ppm2      4.423 CV     1
 ASSI { 1789}
   (  segid "AREF" and resid 27   and name HD1%)
   (( segid "AREF" and resid 31   and name HD1 ))
      3.800     1.800     1.800 peak  1789 spectrum    2 weight  0.10000E+01 volume  0.56006E-02 ppm1      0.848 ppm2      3.192 CV     1
 OR { 1789}
   (  segid "AREF" and resid 27   and name HD1%)
   (( segid "AREF" and resid 31   and name HD2 ))
 ASSI {    1}
   (( segid "AREF" and resid 93   and name HN  ))
   (( segid "AREF" and resid 93   and name HB  ))
      3.100     1.200     1.200 peak     1 spectrum    3 weight  0.10000E+01 volume  0.30198E-02 ppm1      8.955 ppm2      1.894 CV     1
 ASSI {    4}
   (( segid "AREF" and resid 93   and name HN  ))
   (( segid "AREF" and resid 92   and name HA  ))
      2.400     0.700     0.700 peak     4 spectrum    3 weight  0.10000E+01 volume  0.23926E-02 ppm1      8.954 ppm2      4.962 CV     1
 ASSI {    6}
   (( segid "AREF" and resid 93   and name HN  ))
   (  segid "AREF" and resid 93   and name HG1%)
      2.500     0.800     0.800 peak     6 spectrum    3 weight  0.10000E+01 volume  0.54936E-02 ppm1      8.945 ppm2      1.050 CV     1
 ASSI {   16}
   (( segid "AREF" and resid 70   and name HE1 ))
   (( segid "AREF" and resid 70   and name HZ2 ))
      3.000     1.100     1.100 peak    16 spectrum    3 weight  0.10000E+01 volume  0.30314E-02 ppm1     10.140 ppm2      7.449 CV     1
 ASSI {   17}
   (( segid "AREF" and resid 70   and name HE1 ))
   (( segid "AREF" and resid 70   and name HD1 ))
      3.100     1.200     1.200 peak    17 spectrum    3 weight  0.10000E+01 volume  0.25204E-02 ppm1     10.140 ppm2      7.217 CV     1
 ASSI {   29}
   (( segid "AREF" and resid 165  and name HN  ))
   (( segid "AREF" and resid 164  and name HN  ))
      3.200     1.300     1.300 peak    29 spectrum    3 weight  0.10000E+01 volume  0.41464E-02 ppm1      8.457 ppm2      8.621 CV     1
 ASSI {   31}
   (( segid "AREF" and resid 165  and name HN  ))
   (( segid "AREF" and resid 166  and name HN  ))
      2.700     0.900     0.900 peak    31 spectrum    3 weight  0.10000E+01 volume  0.31360E-02 ppm1      8.459 ppm2      8.290 CV     1
 ASSI {   33}
   (( segid "AREF" and resid 165  and name HN  ))
   (( segid "AREF" and resid 165  and name HA  ))
      2.700     0.900     0.900 peak    33 spectrum    3 weight  0.10000E+01 volume  0.28572E-02 ppm1      8.457 ppm2      4.413 CV     1
 ASSI {   36}
   (( segid "AREF" and resid 165  and name HN  ))
   (  segid "AREF" and resid 168  and name HG2%)
      3.300     1.300     1.300 peak    36 spectrum    3 weight  0.10000E+01 volume  0.24855E-02 ppm1      8.458 ppm2      0.873 CV     1
 OR {   36}
   (( segid "AREF" and resid 165  and name HN  ))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI {   43}
   (( segid "AREF" and resid 118  and name HN  ))
   (( segid "AREF" and resid 118  and name HA  ))
      2.300     0.700     0.700 peak    43 spectrum    3 weight  0.10000E+01 volume  0.38677E-02 ppm1      8.664 ppm2      4.907 CV     1
 ASSI {   50}
   (( segid "AREF" and resid 120  and name HN  ))
   (( segid "AREF" and resid 120  and name HB  ))
      3.000     1.100     1.100 peak    50 spectrum    3 weight  0.10000E+01 volume  0.31127E-02 ppm1      9.229 ppm2      1.936 CV     1
 ASSI {   52}
   (( segid "AREF" and resid 120  and name HN  ))
   (( segid "AREF" and resid 119  and name HA  ))
      2.600     0.900     0.900 peak    52 spectrum    3 weight  0.10000E+01 volume  0.26830E-02 ppm1      9.226 ppm2      4.798 CV     1
 ASSI {   54}
   (( segid "AREF" and resid 120  and name HN  ))
   (  segid "AREF" and resid 120  and name HG1%)
      3.100     1.200     1.200 peak    54 spectrum    3 weight  0.10000E+01 volume  0.31940E-02 ppm1      9.228 ppm2      0.727 CV     1
 ASSI {   58}
   (( segid "AREF" and resid 50   and name HN  ))
   (( segid "AREF" and resid 49   and name HN  ))
      2.500     0.800     0.800 peak    58 spectrum    3 weight  0.10000E+01 volume  0.38561E-02 ppm1      8.288 ppm2      7.978 CV     1
 ASSI {   60}
   (( segid "AREF" and resid 50   and name HN  ))
   (( segid "AREF" and resid 50   and name HA  ))
      2.700     0.900     0.900 peak    60 spectrum    3 weight  0.10000E+01 volume  0.30547E-02 ppm1      8.288 ppm2      4.340 CV     1
 ASSI {   61}
   (( segid "AREF" and resid 50   and name HN  ))
   (( segid "AREF" and resid 49   and name HA  ))
      3.100     1.200     1.200 peak    61 spectrum    3 weight  0.10000E+01 volume  0.24042E-02 ppm1      8.288 ppm2      4.125 CV     1
 ASSI {   62}
   (( segid "AREF" and resid 50   and name HN  ))
   (( segid "AREF" and resid 49   and name HB  ))
      3.100     1.200     1.200 peak    62 spectrum    3 weight  0.10000E+01 volume  0.36935E-02 ppm1      8.286 ppm2      1.827 CV     1
 ASSI {   63}
   (( segid "AREF" and resid 50   and name HN  ))
   (  segid "AREF" and resid 50   and name HB% )
      3.200     1.300     1.300 peak    63 spectrum    3 weight  0.10000E+01 volume  0.25204E-02 ppm1      8.288 ppm2      1.365 CV     1
 ASSI {   65}
   (( segid "AREF" and resid 115  and name HN  ))
   (( segid "AREF" and resid 115  and name HA  ))
      2.400     0.700     0.700 peak    65 spectrum    3 weight  0.10000E+01 volume  0.52266E-02 ppm1      8.815 ppm2      4.458 CV     1
 ASSI {   68}
   (( segid "AREF" and resid 115  and name HN  ))
   (( segid "AREF" and resid 115  and name HB2 ))
      2.700     0.900     0.900 peak    68 spectrum    3 weight  0.10000E+01 volume  0.27759E-02 ppm1      8.811 ppm2      1.587 CV     1
 OR {   68}
   (( segid "AREF" and resid 115  and name HN  ))
   (( segid "AREF" and resid 115  and name HB1 ))
 ASSI {   69}
   (( segid "AREF" and resid 115  and name HN  ))
   (  segid "AREF" and resid 114  and name HG2%)
      3.600     1.700     1.700 peak    69 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      8.810 ppm2      1.192 CV     1
 ASSI {   70}
   (( segid "AREF" and resid 115  and name HN  ))
   (  segid "AREF" and resid 115  and name HD1%)
      3.400     1.400     1.400 peak    70 spectrum    3 weight  0.10000E+01 volume  0.52497E-02 ppm1      8.811 ppm2     -0.065 CV     1
 ASSI {   76}
   (( segid "AREF" and resid 135  and name HN  ))
   (( segid "AREF" and resid 135  and name HB2 ))
      2.300     0.700     0.700 peak    76 spectrum    3 weight  0.10000E+01 volume  0.52150E-02 ppm1      9.187 ppm2      2.889 CV     1
 OR {   76}
   (( segid "AREF" and resid 135  and name HN  ))
   (( segid "AREF" and resid 135  and name HB1 ))
 ASSI {   77}
   (( segid "AREF" and resid 135  and name HN  ))
   (( segid "AREF" and resid 117  and name HN  ))
      2.300     0.600     0.600 peak    77 spectrum    3 weight  0.10000E+01 volume  0.46459E-02 ppm1      9.186 ppm2      7.399 CV     1
 ASSI {   79}
   (( segid "AREF" and resid 135  and name HN  ))
   (( segid "AREF" and resid 134  and name HA  ))
      2.300     0.600     0.600 peak    79 spectrum    3 weight  0.10000E+01 volume  0.26017E-02 ppm1      9.184 ppm2      4.380 CV     1
 ASSI {   80}
   (( segid "AREF" and resid 135  and name HN  ))
   (( segid "AREF" and resid 117  and name HG2 ))
      2.700     0.900     0.900 peak    80 spectrum    3 weight  0.10000E+01 volume  0.40535E-02 ppm1      9.182 ppm2      1.255 CV     1
 OR {   80}
   (( segid "AREF" and resid 135  and name HN  ))
   (( segid "AREF" and resid 117  and name HG1 ))
 ASSI {   81}
   (( segid "AREF" and resid 135  and name HN  ))
   (  segid "AREF" and resid 134  and name HG2%)
      3.100     1.200     1.200 peak    81 spectrum    3 weight  0.10000E+01 volume  0.31824E-02 ppm1      9.183 ppm2      0.280 CV     1
 OR {   81}
   (( segid "AREF" and resid 135  and name HN  ))
   (  segid "AREF" and resid 134  and name HG1%)
 ASSI {   84}
   (( segid "AREF" and resid 164  and name HN  ))
   (( segid "AREF" and resid 91   and name HA  ))
      2.700     0.900     0.900 peak    84 spectrum    3 weight  0.10000E+01 volume  0.46459E-02 ppm1      8.623 ppm2      5.211 CV     1
 ASSI {   85}
   (( segid "AREF" and resid 164  and name HN  ))
   (( segid "AREF" and resid 163  and name HA  ))
      2.400     0.700     0.700 peak    85 spectrum    3 weight  0.10000E+01 volume  0.22881E-02 ppm1      8.624 ppm2      4.747 CV     1
 ASSI {   86}
   (( segid "AREF" and resid 164  and name HN  ))
   (( segid "AREF" and resid 164  and name HA  ))
      2.600     0.800     0.800 peak    86 spectrum    3 weight  0.10000E+01 volume  0.32637E-02 ppm1      8.623 ppm2      4.099 CV     1
 ASSI {   89}
   (( segid "AREF" and resid 164  and name HN  ))
   (  segid "AREF" and resid 164  and name HG1%)
      3.300     1.400     1.400 peak    89 spectrum    3 weight  0.10000E+01 volume  0.22533E-02 ppm1      8.624 ppm2      0.785 CV     1
 OR {   89}
   (( segid "AREF" and resid 164  and name HN  ))
   (  segid "AREF" and resid 164  and name HG2%)
 ASSI {   92}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 159  and name HA  ))
      2.700     0.900     0.900 peak    92 spectrum    3 weight  0.10000E+01 volume  0.28224E-02 ppm1      8.247 ppm2      4.295 CV     1
 ASSI {   93}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 159  and name HG1 ))
      2.500     0.800     0.800 peak    93 spectrum    3 weight  0.10000E+01 volume  0.32057E-02 ppm1      8.247 ppm2      2.421 CV     1
 OR {   93}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 159  and name HG2 ))
 ASSI {   94}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 158  and name HB2 ))
      2.900     1.100     1.100 peak    94 spectrum    3 weight  0.10000E+01 volume  0.29966E-02 ppm1      8.248 ppm2      1.844 CV     1
 ASSI {   96}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 158  and name HA  ))
      2.200     0.600     0.600 peak    96 spectrum    3 weight  0.10000E+01 volume  0.25901E-02 ppm1      8.245 ppm2      3.927 CV     1
 ASSI {   97}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 158  and name HD2 ))
      2.200     2.200     3.800 peak    97 spectrum    3 weight  0.10000E+01 volume  0.38677E-02 ppm1      8.243 ppm2      2.640 CV     1
 OR {   97}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 158  and name HD1 ))
 ASSI {   98}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 158  and name HB1 ))
      2.700     0.900     0.900 peak    98 spectrum    3 weight  0.10000E+01 volume  0.58189E-02 ppm1      8.244 ppm2      2.021 CV     1
 ASSI {  103}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 160  and name HN  ))
      3.300     1.400     1.400 peak   103 spectrum    3 weight  0.10000E+01 volume  0.65741E-02 ppm1      8.243 ppm2      8.076 CV     1
 ASSI {  104}
   (( segid "AREF" and resid 159  and name HN  ))
   (( segid "AREF" and resid 159  and name HB2 ))
      3.300     1.300     1.300 peak   104 spectrum    3 weight  0.10000E+01 volume  0.34728E-02 ppm1      8.242 ppm2      1.917 CV     1
 ASSI {  114}
   (( segid "AREF" and resid 101  and name HN  ))
   (( segid "AREF" and resid 104  and name HB2 ))
      2.200     0.600     0.600 peak   114 spectrum    3 weight  0.10000E+01 volume  0.65274E-02 ppm1      9.415 ppm2      2.532 CV     1
 OR {  114}
   (( segid "AREF" and resid 101  and name HN  ))
   (( segid "AREF" and resid 104  and name HB1 ))
 ASSI {  116}
   (( segid "AREF" and resid 101  and name HN  ))
   (  segid "AREF" and resid 100  and name HG1%)
      3.800     1.800     1.800 peak   116 spectrum    3 weight  0.10000E+01 volume  0.29966E-02 ppm1      9.410 ppm2      0.964 CV     1
 ASSI {  118}
   (( segid "AREF" and resid 163  and name HN  ))
   (( segid "AREF" and resid 162  and name HG1 ))
      3.500     1.500     1.500 peak   118 spectrum    3 weight  0.10000E+01 volume  0.58536E-02 ppm1      8.613 ppm2      2.268 CV     1
 OR {  118}
   (( segid "AREF" and resid 163  and name HN  ))
   (( segid "AREF" and resid 162  and name HG2 ))
 ASSI {  121}
   (( segid "AREF" and resid 163  and name HN  ))
   (( segid "AREF" and resid 146  and name HN  ))
      3.600     3.600     2.400 peak   121 spectrum    3 weight  0.10000E+01 volume  0.38561E-02 ppm1      8.608 ppm2      8.102 CV     1
 ASSI {  123}
   (( segid "AREF" and resid 163  and name HN  ))
   (( segid "AREF" and resid 162  and name HB2 ))
      3.200     1.300     1.300 peak   123 spectrum    3 weight  0.10000E+01 volume  0.27643E-02 ppm1      8.608 ppm2      2.062 CV     1
 OR {  123}
   (( segid "AREF" and resid 163  and name HN  ))
   (( segid "AREF" and resid 162  and name HB1 ))
 ASSI {  124}
   (( segid "AREF" and resid 163  and name HN  ))
   (( segid "AREF" and resid 150  and name HG1 ))
      2.200     2.200     3.800 peak   124 spectrum    3 weight  0.10000E+01 volume  0.36819E-02 ppm1      8.608 ppm2      1.843 CV     1
 ASSI {  125}
   (( segid "AREF" and resid 163  and name HN  ))
   (( segid "AREF" and resid 163  and name HB2 ))
      2.400     0.700     0.700 peak   125 spectrum    3 weight  0.10000E+01 volume  0.25668E-02 ppm1      8.607 ppm2      1.660 CV     1
 ASSI {  126}
   (( segid "AREF" and resid 163  and name HN  ))
   (( segid "AREF" and resid 163  and name HB1 ))
      3.300     1.300     1.300 peak   126 spectrum    3 weight  0.10000E+01 volume  0.26598E-02 ppm1      8.608 ppm2      1.392 CV     1
 ASSI {  127}
   (( segid "AREF" and resid 163  and name HN  ))
   (  segid "AREF" and resid 163  and name HD1%)
      3.000     1.100     1.100 peak   127 spectrum    3 weight  0.10000E+01 volume  0.28688E-02 ppm1      8.608 ppm2      0.762 CV     1
 ASSI {  131}
   (( segid "AREF" and resid 154  and name HN  ))
   (( segid "AREF" and resid 158  and name HA  ))
      2.400     0.700     0.700 peak   131 spectrum    3 weight  0.10000E+01 volume  0.32870E-02 ppm1      8.059 ppm2      3.924 CV     1
 ASSI {  132}
   (( segid "AREF" and resid 154  and name HN  ))
   (( segid "AREF" and resid 154  and name HB2 ))
      2.700     0.900     0.900 peak   132 spectrum    3 weight  0.10000E+01 volume  0.28224E-02 ppm1      8.060 ppm2      1.816 CV     1
 ASSI {  133}
   (( segid "AREF" and resid 154  and name HN  ))
   (( segid "AREF" and resid 157  and name HN  ))
      2.600     0.900     0.900 peak   133 spectrum    3 weight  0.10000E+01 volume  0.38909E-02 ppm1      8.053 ppm2      7.537 CV     1
 ASSI {  134}
   (( segid "AREF" and resid 160  and name HN  ))
   (( segid "AREF" and resid 159  and name HA  ))
      2.800     1.000     1.000 peak   134 spectrum    3 weight  0.10000E+01 volume  0.23346E-02 ppm1      8.061 ppm2      4.289 CV     1
 ASSI {  143}
   (( segid "AREF" and resid 121  and name HN  ))
   (( segid "AREF" and resid 133  and name HN  ))
      3.900     1.900     1.900 peak   143 spectrum    3 weight  0.10000E+01 volume  0.34728E-02 ppm1      8.445 ppm2      8.184 CV     1
 ASSI {  146}
   (( segid "AREF" and resid 121  and name HN  ))
   (( segid "AREF" and resid 120  and name HA  ))
      2.400     0.700     0.700 peak   146 spectrum    3 weight  0.10000E+01 volume  0.25552E-02 ppm1      8.443 ppm2      3.930 CV     1
 ASSI {  148}
   (( segid "AREF" and resid 121  and name HN  ))
   (  segid "AREF" and resid 120  and name HG1%)
      3.200     1.300     1.300 peak   148 spectrum    3 weight  0.10000E+01 volume  0.33218E-02 ppm1      8.442 ppm2      0.723 CV     1
 ASSI {  150}
   (( segid "AREF" and resid 121  and name HN  ))
   (  segid "AREF" and resid 132  and name HB% )
      3.600     1.600     1.600 peak   150 spectrum    3 weight  0.10000E+01 volume  0.38793E-02 ppm1      8.439 ppm2      0.903 CV     1
 ASSI {  152}
   (( segid "AREF" and resid 58   and name HN  ))
   (( segid "AREF" and resid 55   and name HN  ))
      2.100     2.100     3.900 peak   152 spectrum    3 weight  0.10000E+01 volume  0.54705E-02 ppm1      8.328 ppm2      8.446 CV     1
 ASSI {  154}
   (( segid "AREF" and resid 58   and name HN  ))
   (( segid "AREF" and resid 56   and name HN  ))
      2.300     0.700     0.700 peak   154 spectrum    3 weight  0.10000E+01 volume  0.58305E-02 ppm1      8.327 ppm2      8.128 CV     1
 ASSI {  156}
   (( segid "AREF" and resid 58   and name HN  ))
   (( segid "AREF" and resid 58   and name HA  ))
      2.600     0.900     0.900 peak   156 spectrum    3 weight  0.10000E+01 volume  0.29501E-02 ppm1      8.328 ppm2      4.534 CV     1
 ASSI {  157}
   (( segid "AREF" and resid 58   and name HN  ))
   (( segid "AREF" and resid 57   and name HA  ))
      3.200     1.300     1.300 peak   157 spectrum    3 weight  0.10000E+01 volume  0.22533E-02 ppm1      8.328 ppm2      4.396 CV     1
 ASSI {  158}
   (( segid "AREF" and resid 58   and name HN  ))
   (( segid "AREF" and resid 57   and name HB1 ))
      3.400     1.500     1.500 peak   158 spectrum    3 weight  0.10000E+01 volume  0.40651E-02 ppm1      8.328 ppm2      2.250 CV     1
 ASSI {  159}
   (( segid "AREF" and resid 58   and name HN  ))
   (( segid "AREF" and resid 57   and name HB2 ))
      2.600     0.800     0.800 peak   159 spectrum    3 weight  0.10000E+01 volume  0.34960E-02 ppm1      8.329 ppm2      1.858 CV     1
 ASSI {  162}
   (( segid "AREF" and resid 160  and name HN  ))
   (( segid "AREF" and resid 159  and name HB2 ))
      2.100     0.600     0.600 peak   162 spectrum    3 weight  0.10000E+01 volume  0.48897E-02 ppm1      8.069 ppm2      1.923 CV     1
 ASSI {  166}
   (( segid "AREF" and resid 160  and name HN  ))
   (( segid "AREF" and resid 160  and name HA  ))
      2.600     0.800     0.800 peak   166 spectrum    3 weight  0.10000E+01 volume  0.36354E-02 ppm1      8.067 ppm2      5.134 CV     1
 ASSI {  168}
   (( segid "AREF" and resid 160  and name HN  ))
   (( segid "AREF" and resid 160  and name HB2 ))
      2.500     0.800     0.800 peak   168 spectrum    3 weight  0.10000E+01 volume  0.31360E-02 ppm1      8.064 ppm2      2.712 CV     1
 ASSI {  169}
   (( segid "AREF" and resid 160  and name HN  ))
   (( segid "AREF" and resid 160  and name HB1 ))
      3.000     1.100     1.100 peak   169 spectrum    3 weight  0.10000E+01 volume  0.26249E-02 ppm1      8.067 ppm2      2.465 CV     1
 ASSI {  172}
   (( segid "AREF" and resid 136  and name HN  ))
   (  segid "AREF" and resid 136  and name HD% )
      2.400     0.700     0.700 peak   172 spectrum    3 weight  0.10000E+01 volume  0.40768E-02 ppm1      9.226 ppm2      7.213 CV     1
 ASSI {  173}
   (( segid "AREF" and resid 136  and name HN  ))
   (( segid "AREF" and resid 135  and name HA  ))
      2.400     0.700     0.700 peak   173 spectrum    3 weight  0.10000E+01 volume  0.27759E-02 ppm1      9.228 ppm2      5.412 CV     1
 ASSI {  174}
   (( segid "AREF" and resid 129  and name HN  ))
   (( segid "AREF" and resid 128  and name HA  ))
      2.800     0.900     0.900 peak   174 spectrum    3 weight  0.10000E+01 volume  0.28456E-02 ppm1      8.736 ppm2      4.095 CV     1
 ASSI {  175}
   (( segid "AREF" and resid 129  and name HN  ))
   (( segid "AREF" and resid 129  and name HG  ))
      3.000     1.200     1.200 peak   175 spectrum    3 weight  0.10000E+01 volume  0.30314E-02 ppm1      8.738 ppm2      1.504 CV     1
 OR {  175}
   (( segid "AREF" and resid 129  and name HN  ))
   (( segid "AREF" and resid 129  and name HB2 ))
 ASSI {  177}
   (( segid "AREF" and resid 129  and name HN  ))
   (( segid "AREF" and resid 129  and name HA  ))
      2.400     0.800     0.800 peak   177 spectrum    3 weight  0.10000E+01 volume  0.65625E-02 ppm1      8.731 ppm2      4.392 CV     1
 ASSI {  181}
   (( segid "AREF" and resid 136  and name HN  ))
   (( segid "AREF" and resid 136  and name HB1 ))
      2.400     0.700     0.700 peak   181 spectrum    3 weight  0.10000E+01 volume  0.65625E-02 ppm1      9.236 ppm2      2.694 CV     1
 OR {  181}
   (( segid "AREF" and resid 136  and name HN  ))
   (( segid "AREF" and resid 136  and name HB2 ))
 ASSI {  187}
   (( segid "AREF" and resid 86   and name HN  ))
   (( segid "AREF" and resid 85   and name HN  ))
      2.600     0.800     0.800 peak   187 spectrum    3 weight  0.10000E+01 volume  0.32637E-02 ppm1      8.520 ppm2      7.844 CV     1
 ASSI {  189}
   (( segid "AREF" and resid 86   and name HN  ))
   (( segid "AREF" and resid 86   and name HA  ))
      2.800     1.000     1.000 peak   189 spectrum    3 weight  0.10000E+01 volume  0.30082E-02 ppm1      8.519 ppm2      4.447 CV     1
 ASSI {  191}
   (( segid "AREF" and resid 86   and name HN  ))
   (( segid "AREF" and resid 86   and name HG2 ))
      3.700     1.700     1.700 peak   191 spectrum    3 weight  0.10000E+01 volume  0.30779E-02 ppm1      8.518 ppm2      2.328 CV     1
 OR {  191}
   (( segid "AREF" and resid 86   and name HN  ))
   (( segid "AREF" and resid 86   and name HG1 ))
 ASSI {  194}
   (( segid "AREF" and resid 86   and name HN  ))
   (( segid "AREF" and resid 87   and name HN  ))
      2.400     0.700     0.700 peak   194 spectrum    3 weight  0.10000E+01 volume  0.51567E-02 ppm1      8.519 ppm2      8.224 CV     1
 ASSI {  204}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 91   and name HA  ))
      2.200     0.600     0.600 peak   204 spectrum    3 weight  0.10000E+01 volume  0.25552E-02 ppm1      9.008 ppm2      5.215 CV     1
 ASSI {  208}
   (( segid "AREF" and resid 92   and name HN  ))
   (  segid "AREF" and resid 91   and name HD2%)
      2.600     0.800     0.800 peak   208 spectrum    3 weight  0.10000E+01 volume  0.24972E-02 ppm1      9.008 ppm2      0.791 CV     1
 OR {  208}
   (( segid "AREF" and resid 92   and name HN  ))
   (  segid "AREF" and resid 91   and name HD1%)
 ASSI {  209}
   (( segid "AREF" and resid 48   and name HN  ))
   (( segid "AREF" and resid 49   and name HN  ))
      3.000     1.100     1.100 peak   209 spectrum    3 weight  0.10000E+01 volume  0.37051E-02 ppm1      8.364 ppm2      7.971 CV     1
 ASSI {  210}
   (( segid "AREF" and resid 48   and name HN  ))
   (( segid "AREF" and resid 47   and name HA  ))
      3.000     1.100     1.100 peak   210 spectrum    3 weight  0.10000E+01 volume  0.23346E-02 ppm1      8.362 ppm2      4.396 CV     1
 ASSI {  211}
   (( segid "AREF" and resid 48   and name HN  ))
   (( segid "AREF" and resid 47   and name HB2 ))
      2.800     1.000     1.000 peak   211 spectrum    3 weight  0.10000E+01 volume  0.32637E-02 ppm1      8.363 ppm2      1.877 CV     1
 ASSI {  214}
   (( segid "AREF" and resid 48   and name HN  ))
   (  segid "AREF" and resid 48   and name HB% )
      3.400     1.400     1.400 peak   214 spectrum    3 weight  0.10000E+01 volume  0.25668E-02 ppm1      8.362 ppm2      1.364 CV     1
 ASSI {  216}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 92   and name HB1 ))
      3.200     1.200     1.200 peak   216 spectrum    3 weight  0.10000E+01 volume  0.31476E-02 ppm1      9.010 ppm2      1.413 CV     1
 ASSI {  221}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 92   and name HN  ))
      2.300     0.700     0.700 peak   221 spectrum    3 weight  0.10000E+01 volume  0.34960E-02 ppm1      8.509 ppm2      9.003 CV     1
 ASSI {  222}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 162  and name HG2 ))
      2.900     1.000     1.000 peak   222 spectrum    3 weight  0.10000E+01 volume  0.49129E-02 ppm1      8.510 ppm2      2.264 CV     1
 OR {  222}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 162  and name HG1 ))
 ASSI {  223}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 92   and name HB2 ))
      2.300     0.700     0.700 peak   223 spectrum    3 weight  0.10000E+01 volume  0.58305E-02 ppm1      8.511 ppm2      1.652 CV     1
 OR {  223}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 92   and name HG  ))
 ASSI {  225}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 161  and name HA  ))
      2.300     0.700     0.700 peak   225 spectrum    3 weight  0.10000E+01 volume  0.23810E-02 ppm1      8.505 ppm2      4.989 CV     1
 ASSI {  227}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 150  and name HG1 ))
      2.500     2.500     3.500 peak   227 spectrum    3 weight  0.10000E+01 volume  0.40303E-02 ppm1      8.506 ppm2      1.839 CV     1
 ASSI {  229}
   (( segid "AREF" and resid 48   and name HN  ))
   (( segid "AREF" and resid 48   and name HA  ))
      2.700     0.900     0.900 peak   229 spectrum    3 weight  0.10000E+01 volume  0.31476E-02 ppm1      8.361 ppm2      4.284 CV     1
 ASSI {  231}
   (( segid "AREF" and resid 152  and name HN  ))
   (( segid "AREF" and resid 150  and name HA  ))
      3.000     1.100     1.100 peak   231 spectrum    3 weight  0.10000E+01 volume  0.37283E-02 ppm1      8.124 ppm2      3.876 CV     1
 ASSI {  232}
   (( segid "AREF" and resid 152  and name HN  ))
   (( segid "AREF" and resid 152  and name HB  ))
      2.700     0.900     0.900 peak   232 spectrum    3 weight  0.10000E+01 volume  0.24855E-02 ppm1      8.124 ppm2      2.358 CV     1
 ASSI {  233}
   (( segid "AREF" and resid 152  and name HN  ))
   (  segid "AREF" and resid 152  and name HG2%)
      3.100     1.200     1.200 peak   233 spectrum    3 weight  0.10000E+01 volume  0.22997E-02 ppm1      8.124 ppm2      1.059 CV     1
 OR {  233}
   (( segid "AREF" and resid 152  and name HN  ))
   (  segid "AREF" and resid 152  and name HG1%)
 ASSI {  235}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 162  and name HB1 ))
      2.400     0.700     0.700 peak   235 spectrum    3 weight  0.10000E+01 volume  0.40768E-02 ppm1      8.505 ppm2      2.064 CV     1
 OR {  235}
   (( segid "AREF" and resid 162  and name HN  ))
   (( segid "AREF" and resid 162  and name HB2 ))
 ASSI {  237}
   (( segid "AREF" and resid 152  and name HN  ))
   (( segid "AREF" and resid 152  and name HA  ))
      2.700     0.900     0.900 peak   237 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      8.125 ppm2      4.297 CV     1
 ASSI {  238}
   (( segid "AREF" and resid 152  and name HN  ))
   (( segid "AREF" and resid 150  and name HG2 ))
      3.400     1.400     1.400 peak   238 spectrum    3 weight  0.10000E+01 volume  0.49244E-02 ppm1      8.126 ppm2      1.850 CV     1
 ASSI {  239}
   (( segid "AREF" and resid 152  and name HN  ))
   (( segid "AREF" and resid 150  and name HN  ))
      3.000     3.000     3.000 peak   239 spectrum    3 weight  0.10000E+01 volume  0.65741E-02 ppm1      8.121 ppm2      8.246 CV     1
 ASSI {  243}
   (( segid "AREF" and resid 62   and name HN  ))
   (( segid "AREF" and resid 62   and name HB2 ))
      2.500     0.800     0.800 peak   243 spectrum    3 weight  0.10000E+01 volume  0.43671E-02 ppm1      8.156 ppm2      1.833 CV     1
 ASSI {  244}
   (( segid "AREF" and resid 62   and name HN  ))
   (( segid "AREF" and resid 61   and name HB1 ))
      2.800     1.000     1.000 peak   244 spectrum    3 weight  0.10000E+01 volume  0.36354E-02 ppm1      8.151 ppm2      3.755 CV     1
 OR {  244}
   (( segid "AREF" and resid 62   and name HN  ))
   (( segid "AREF" and resid 61   and name HB2 ))
 ASSI {  247}
   (( segid "AREF" and resid 62   and name HN  ))
   (( segid "AREF" and resid 60   and name HN  ))
      3.100     1.200     1.200 peak   247 spectrum    3 weight  0.10000E+01 volume  0.37864E-02 ppm1      8.164 ppm2      8.036 CV     1
 ASSI {  248}
   (( segid "AREF" and resid 98   and name HN  ))
   (  segid "AREF" and resid 98   and name HD% )
      3.300     1.300     1.300 peak   248 spectrum    3 weight  0.10000E+01 volume  0.35773E-02 ppm1      8.163 ppm2      7.228 CV     1
 ASSI {  249}
   (( segid "AREF" and resid 98   and name HN  ))
   (( segid "AREF" and resid 97   and name HA  ))
      3.000     1.100     1.100 peak   249 spectrum    3 weight  0.10000E+01 volume  0.23810E-02 ppm1      8.163 ppm2      4.179 CV     1
 ASSI {  251}
   (( segid "AREF" and resid 98   and name HN  ))
   (( segid "AREF" and resid 98   and name HB2 ))
      3.000     1.100     1.100 peak   251 spectrum    3 weight  0.10000E+01 volume  0.29037E-02 ppm1      8.163 ppm2      3.043 CV     1
 OR {  251}
   (( segid "AREF" and resid 98   and name HN  ))
   (( segid "AREF" and resid 98   and name HB1 ))
 ASSI {  252}
   (( segid "AREF" and resid 98   and name HN  ))
   (( segid "AREF" and resid 97   and name HB2 ))
      3.100     1.200     1.200 peak   252 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      8.164 ppm2      2.576 CV     1
 OR {  252}
   (( segid "AREF" and resid 98   and name HN  ))
   (( segid "AREF" and resid 97   and name HB1 ))
 ASSI {  254}
   (( segid "AREF" and resid 62   and name HN  ))
   (( segid "AREF" and resid 62   and name HA  ))
      2.600     0.800     0.800 peak   254 spectrum    3 weight  0.10000E+01 volume  0.30198E-02 ppm1      8.156 ppm2      4.563 CV     1
 ASSI {  257}
   (( segid "AREF" and resid 62   and name HN  ))
   (( segid "AREF" and resid 62   and name HB1 ))
      3.200     1.200     1.200 peak   257 spectrum    3 weight  0.10000E+01 volume  0.28804E-02 ppm1      8.153 ppm2      1.697 CV     1
 ASSI {  260}
   (( segid "AREF" and resid 169  and name HN  ))
   (( segid "AREF" and resid 170  and name HN  ))
      2.500     0.800     0.800 peak   260 spectrum    3 weight  0.10000E+01 volume  0.29385E-02 ppm1      8.257 ppm2      8.136 CV     1
 ASSI {  261}
   (( segid "AREF" and resid 119  and name HN  ))
   (( segid "AREF" and resid 118  and name HA  ))
      2.300     0.600     0.600 peak   261 spectrum    3 weight  0.10000E+01 volume  0.23113E-02 ppm1      8.152 ppm2      4.912 CV     1
 ASSI {  262}
   (( segid "AREF" and resid 119  and name HN  ))
   (( segid "AREF" and resid 119  and name HA  ))
      2.700     0.900     0.900 peak   262 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      8.152 ppm2      4.803 CV     1
 ASSI {  265}
   (( segid "AREF" and resid 119  and name HN  ))
   (  segid "AREF" and resid 134  and name HG1%)
      2.800     1.000     1.000 peak   265 spectrum    3 weight  0.10000E+01 volume  0.39606E-02 ppm1      8.151 ppm2      0.263 CV     1
 OR {  265}
   (( segid "AREF" and resid 119  and name HN  ))
   (  segid "AREF" and resid 134  and name HG2%)
 ASSI {  269}
   (( segid "AREF" and resid 13   and name HN  ))
   (( segid "AREF" and resid 13   and name HB2 ))
      2.500     0.800     0.800 peak   269 spectrum    3 weight  0.10000E+01 volume  0.30082E-02 ppm1      8.451 ppm2      2.766 CV     1
 ASSI {  270}
   (( segid "AREF" and resid 13   and name HN  ))
   (( segid "AREF" and resid 13   and name HB1 ))
      3.600     1.600     1.600 peak   270 spectrum    3 weight  0.10000E+01 volume  0.29037E-02 ppm1      8.451 ppm2      2.568 CV     1
 ASSI {  271}
   (( segid "AREF" and resid 13   and name HN  ))
   (( segid "AREF" and resid 12   and name HB2 ))
      2.700     0.900     0.900 peak   271 spectrum    3 weight  0.10000E+01 volume  0.45181E-02 ppm1      8.452 ppm2      1.809 CV     1
 ASSI {  274}
   (( segid "AREF" and resid 169  and name HN  ))
   (( segid "AREF" and resid 168  and name HN  ))
      2.700     0.900     0.900 peak   274 spectrum    3 weight  0.10000E+01 volume  0.32173E-02 ppm1      8.257 ppm2      8.050 CV     1
 ASSI {  277}
   (( segid "AREF" and resid 169  and name HN  ))
   (( segid "AREF" and resid 169  and name HB2 ))
      2.800     1.000     1.000 peak   277 spectrum    3 weight  0.10000E+01 volume  0.27991E-02 ppm1      8.258 ppm2      2.745 CV     1
 ASSI {  278}
   (( segid "AREF" and resid 169  and name HN  ))
   (( segid "AREF" and resid 169  and name HB1 ))
      3.200     1.200     1.200 peak   278 spectrum    3 weight  0.10000E+01 volume  0.27178E-02 ppm1      8.257 ppm2      2.620 CV     1
 ASSI {  279}
   (( segid "AREF" and resid 169  and name HN  ))
   (( segid "AREF" and resid 168  and name HB  ))
      3.100     3.100     2.900 peak   279 spectrum    3 weight  0.10000E+01 volume  0.33683E-02 ppm1      8.257 ppm2      1.793 CV     1
 ASSI {  290}
   (( segid "AREF" and resid 16   and name HN  ))
   (( segid "AREF" and resid 15   and name HN  ))
      2.500     0.800     0.800 peak   290 spectrum    3 weight  0.10000E+01 volume  0.29501E-02 ppm1      7.875 ppm2      8.414 CV     1
 ASSI {  291}
   (( segid "AREF" and resid 16   and name HN  ))
   (( segid "AREF" and resid 17   and name HN  ))
      2.500     0.800     0.800 peak   291 spectrum    3 weight  0.10000E+01 volume  0.31592E-02 ppm1      7.875 ppm2      8.143 CV     1
 ASSI {  292}
   (( segid "AREF" and resid 16   and name HN  ))
   (( segid "AREF" and resid 18   and name HN  ))
      3.400     1.500     1.500 peak   292 spectrum    3 weight  0.10000E+01 volume  0.37399E-02 ppm1      7.876 ppm2      8.000 CV     1
 ASSI {  295}
   (( segid "AREF" and resid 16   and name HN  ))
   (( segid "AREF" and resid 15   and name HA  ))
      3.100     1.200     1.200 peak   295 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      7.876 ppm2      4.439 CV     1
 ASSI {  296}
   (( segid "AREF" and resid 16   and name HN  ))
   (( segid "AREF" and resid 16   and name HA  ))
      2.500     0.800     0.800 peak   296 spectrum    3 weight  0.10000E+01 volume  0.30082E-02 ppm1      7.875 ppm2      4.240 CV     1
 ASSI {  297}
   (( segid "AREF" and resid 16   and name HN  ))
   (( segid "AREF" and resid 13   and name HB2 ))
      2.900     1.000     1.000 peak   297 spectrum    3 weight  0.10000E+01 volume  0.43091E-02 ppm1      7.876 ppm2      2.762 CV     1
 ASSI {  298}
   (( segid "AREF" and resid 16   and name HN  ))
   (( segid "AREF" and resid 15   and name HB2 ))
      2.800     1.000     1.000 peak   298 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      7.876 ppm2      2.079 CV     1
 OR {  298}
   (( segid "AREF" and resid 16   and name HN  ))
   (( segid "AREF" and resid 15   and name HB1 ))
 OR {  298}
   (( segid "AREF" and resid 16   and name HN  ))
   (  segid "AREF" and resid 15   and name HE% )
 ASSI {  301}
   (( segid "AREF" and resid 13   and name HN  ))
   (( segid "AREF" and resid 13   and name HA  ))
      2.700     0.900     0.900 peak   301 spectrum    3 weight  0.10000E+01 volume  0.34844E-02 ppm1      8.453 ppm2      4.869 CV     1
 ASSI {  303}
   (( segid "AREF" and resid 13   and name HN  ))
   (( segid "AREF" and resid 12   and name HA  ))
      2.600     0.900     0.900 peak   303 spectrum    3 weight  0.10000E+01 volume  0.26133E-02 ppm1      8.452 ppm2      4.333 CV     1
 ASSI {  304}
   (( segid "AREF" and resid 23   and name HN  ))
   (( segid "AREF" and resid 24   and name HN  ))
      2.500     0.800     0.800 peak   304 spectrum    3 weight  0.10000E+01 volume  0.34031E-02 ppm1      8.378 ppm2      8.127 CV     1
 ASSI {  305}
   (( segid "AREF" and resid 23   and name HN  ))
   (( segid "AREF" and resid 22   and name HB1 ))
      3.200     1.300     1.300 peak   305 spectrum    3 weight  0.10000E+01 volume  0.49244E-02 ppm1      8.377 ppm2      3.928 CV     1
 ASSI {  320}
   (( segid "AREF" and resid 23   and name HN  ))
   (( segid "AREF" and resid 23   and name HA  ))
      2.600     0.800     0.800 peak   320 spectrum    3 weight  0.10000E+01 volume  0.30547E-02 ppm1      8.376 ppm2      4.228 CV     1
 ASSI {  321}
   (( segid "AREF" and resid 23   and name HN  ))
   (( segid "AREF" and resid 22   and name HB2 ))
      3.700     1.700     1.700 peak   321 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      8.376 ppm2      4.045 CV     1
 ASSI {  322}
   (( segid "AREF" and resid 23   and name HN  ))
   (( segid "AREF" and resid 23   and name HB1 ))
      2.800     0.900     0.900 peak   322 spectrum    3 weight  0.10000E+01 volume  0.23462E-02 ppm1      8.377 ppm2      1.655 CV     1
 OR {  322}
   (( segid "AREF" and resid 23   and name HN  ))
   (( segid "AREF" and resid 23   and name HG  ))
 OR {  322}
   (( segid "AREF" and resid 23   and name HN  ))
   (( segid "AREF" and resid 23   and name HB2 ))
 ASSI {  325}
   (( segid "AREF" and resid 66   and name HN  ))
   (( segid "AREF" and resid 66   and name HA  ))
      2.500     0.800     0.800 peak   325 spectrum    3 weight  0.10000E+01 volume  0.28340E-02 ppm1      8.222 ppm2      4.562 CV     1
 ASSI {  326}
   (( segid "AREF" and resid 66   and name HN  ))
   (( segid "AREF" and resid 65   and name HA  ))
      3.100     1.200     1.200 peak   326 spectrum    3 weight  0.10000E+01 volume  0.20790E-02 ppm1      8.223 ppm2      4.402 CV     1
 ASSI {  327}
   (( segid "AREF" and resid 66   and name HN  ))
   (( segid "AREF" and resid 67   and name HD2 ))
      2.600     0.900     0.900 peak   327 spectrum    3 weight  0.10000E+01 volume  0.65625E-02 ppm1      8.224 ppm2      3.783 CV     1
 ASSI {  328}
   (( segid "AREF" and resid 66   and name HN  ))
   (( segid "AREF" and resid 65   and name HB2 ))
      2.700     0.900     0.900 peak   328 spectrum    3 weight  0.10000E+01 volume  0.32057E-02 ppm1      8.225 ppm2      1.847 CV     1
 ASSI {  332}
   (( segid "AREF" and resid 66   and name HN  ))
   (( segid "AREF" and resid 65   and name HB1 ))
      3.300     1.400     1.400 peak   332 spectrum    3 weight  0.10000E+01 volume  0.38328E-02 ppm1      8.222 ppm2      2.235 CV     1
 ASSI {  338}
   (( segid "AREF" and resid 134  and name HN  ))
   (( segid "AREF" and resid 133  and name HA  ))
      2.400     0.700     0.700 peak   338 spectrum    3 weight  0.10000E+01 volume  0.23462E-02 ppm1      8.213 ppm2      5.094 CV     1
 ASSI {  339}
   (( segid "AREF" and resid 134  and name HN  ))
   (  segid "AREF" and resid 134  and name HG1%)
      2.500     0.800     0.800 peak   339 spectrum    3 weight  0.10000E+01 volume  0.29385E-02 ppm1      8.213 ppm2      0.260 CV     1
 ASSI {  366}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 64   and name HA  ))
      2.600     0.900     0.900 peak   366 spectrum    3 weight  0.10000E+01 volume  0.28340E-02 ppm1      8.263 ppm2      4.550 CV     1
 ASSI {  367}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 63   and name HA  ))
      2.600     0.800     0.800 peak   367 spectrum    3 weight  0.10000E+01 volume  0.21487E-02 ppm1      8.263 ppm2      4.395 CV     1
 ASSI {  368}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 63   and name HB1 ))
      3.200     1.300     1.300 peak   368 spectrum    3 weight  0.10000E+01 volume  0.37515E-02 ppm1      8.262 ppm2      2.264 CV     1
 ASSI {  369}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 64   and name HB1 ))
      3.400     1.400     1.400 peak   369 spectrum    3 weight  0.10000E+01 volume  0.24739E-02 ppm1      8.263 ppm2      1.692 CV     1
 OR {  369}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 64   and name HD1 ))
 OR {  369}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 64   and name HD2 ))
 ASSI {  370}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 64   and name HG2 ))
      2.600     0.900     0.900 peak   370 spectrum    3 weight  0.10000E+01 volume  0.29501E-02 ppm1      8.262 ppm2      1.483 CV     1
 OR {  370}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 64   and name HG1 ))
 ASSI {  371}
   (( segid "AREF" and resid 170  and name HN  ))
   (( segid "AREF" and resid 169  and name HA  ))
      3.300     1.400     1.400 peak   371 spectrum    3 weight  0.10000E+01 volume  0.21255E-02 ppm1      8.137 ppm2      4.617 CV     1
 ASSI {  372}
   (( segid "AREF" and resid 170  and name HN  ))
   (( segid "AREF" and resid 169  and name HB2 ))
      3.300     1.300     1.300 peak   372 spectrum    3 weight  0.10000E+01 volume  0.36586E-02 ppm1      8.137 ppm2      2.746 CV     1
 ASSI {  373}
   (( segid "AREF" and resid 170  and name HN  ))
   (( segid "AREF" and resid 169  and name HB1 ))
      2.800     1.000     1.000 peak   373 spectrum    3 weight  0.10000E+01 volume  0.32173E-02 ppm1      8.138 ppm2      2.622 CV     1
 ASSI {  374}
   (( segid "AREF" and resid 170  and name HN  ))
   (( segid "AREF" and resid 170  and name HB2 ))
      2.700     0.900     0.900 peak   374 spectrum    3 weight  0.10000E+01 volume  0.21139E-02 ppm1      8.137 ppm2      1.598 CV     1
 OR {  374}
   (( segid "AREF" and resid 170  and name HN  ))
   (( segid "AREF" and resid 170  and name HG  ))
 ASSI {  375}
   (( segid "AREF" and resid 170  and name HN  ))
   (  segid "AREF" and resid 170  and name HD2%)
      3.000     1.100     1.100 peak   375 spectrum    3 weight  0.10000E+01 volume  0.30198E-02 ppm1      8.135 ppm2      0.837 CV     1
 ASSI {  384}
   (( segid "AREF" and resid 150  and name HN  ))
   (( segid "AREF" and resid 149  and name HN  ))
      2.600     0.800     0.800 peak   384 spectrum    3 weight  0.10000E+01 volume  0.27991E-02 ppm1      8.278 ppm2      7.578 CV     1
 ASSI {  385}
   (( segid "AREF" and resid 150  and name HN  ))
   (( segid "AREF" and resid 149  and name HA  ))
      2.800     1.000     1.000 peak   385 spectrum    3 weight  0.10000E+01 volume  0.44833E-02 ppm1      8.280 ppm2      4.906 CV     1
 ASSI {  386}
   (( segid "AREF" and resid 150  and name HN  ))
   (( segid "AREF" and resid 150  and name HA  ))
      2.400     0.700     0.700 peak   386 spectrum    3 weight  0.10000E+01 volume  0.28921E-02 ppm1      8.278 ppm2      3.855 CV     1
 ASSI {  387}
   (( segid "AREF" and resid 150  and name HN  ))
   (( segid "AREF" and resid 150  and name HB1 ))
      2.500     0.800     0.800 peak   387 spectrum    3 weight  0.10000E+01 volume  0.23113E-02 ppm1      8.278 ppm2      1.965 CV     1
 OR {  387}
   (( segid "AREF" and resid 150  and name HN  ))
   (( segid "AREF" and resid 150  and name HB2 ))
 ASSI {  389}
   (( segid "AREF" and resid 150  and name HN  ))
   (  segid "AREF" and resid 152  and name HG1%)
      3.300     1.400     1.400 peak   389 spectrum    3 weight  0.10000E+01 volume  0.34728E-02 ppm1      8.279 ppm2      1.058 CV     1
 OR {  389}
   (( segid "AREF" and resid 150  and name HN  ))
   (  segid "AREF" and resid 152  and name HG2%)
 ASSI {  393}
   (( segid "AREF" and resid 100  and name HN  ))
   (( segid "AREF" and resid 99   and name HN  ))
      2.600     0.800     0.800 peak   393 spectrum    3 weight  0.10000E+01 volume  0.29037E-02 ppm1      7.229 ppm2      8.907 CV     1
 ASSI {  397}
   (( segid "AREF" and resid 100  and name HN  ))
   (( segid "AREF" and resid 99   and name HA2 ))
      2.800     1.000     1.000 peak   397 spectrum    3 weight  0.10000E+01 volume  0.32753E-02 ppm1      7.229 ppm2      4.220 CV     1
 ASSI {  398}
   (( segid "AREF" and resid 100  and name HN  ))
   (( segid "AREF" and resid 100  and name HA  ))
      2.600     0.800     0.800 peak   398 spectrum    3 weight  0.10000E+01 volume  0.32753E-02 ppm1      7.230 ppm2      3.977 CV     1
 ASSI {  399}
   (( segid "AREF" and resid 100  and name HN  ))
   (( segid "AREF" and resid 99   and name HA1 ))
      3.000     1.200     1.200 peak   399 spectrum    3 weight  0.10000E+01 volume  0.36586E-02 ppm1      7.232 ppm2      3.682 CV     1
 ASSI {  400}
   (( segid "AREF" and resid 100  and name HN  ))
   (( segid "AREF" and resid 100  and name HB  ))
      3.100     1.200     1.200 peak   400 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      7.230 ppm2      2.055 CV     1
 ASSI {  401}
   (( segid "AREF" and resid 100  and name HN  ))
   (  segid "AREF" and resid 100  and name HG2%)
      2.700     0.900     0.900 peak   401 spectrum    3 weight  0.10000E+01 volume  0.25552E-02 ppm1      7.230 ppm2      1.074 CV     1
 ASSI {  402}
   (( segid "AREF" and resid 100  and name HN  ))
   (  segid "AREF" and resid 100  and name HG1%)
      3.100     1.200     1.200 peak   402 spectrum    3 weight  0.10000E+01 volume  0.31011E-02 ppm1      7.228 ppm2      0.960 CV     1
 ASSI {  403}
   (( segid "AREF" and resid 110  and name HN  ))
   (( segid "AREF" and resid 111  and name HA  ))
      3.500     3.500     2.500 peak   403 spectrum    3 weight  0.10000E+01 volume  0.65857E-02 ppm1      8.498 ppm2      3.983 CV     1
 ASSI {  404}
   (( segid "AREF" and resid 110  and name HN  ))
   (( segid "AREF" and resid 111  and name HN  ))
      2.500     0.800     0.800 peak   404 spectrum    3 weight  0.10000E+01 volume  0.32753E-02 ppm1      8.493 ppm2      7.308 CV     1
 ASSI {  406}
   (( segid "AREF" and resid 110  and name HN  ))
   (  segid "AREF" and resid 115  and name HD2%)
      3.200     1.300     1.300 peak   406 spectrum    3 weight  0.10000E+01 volume  0.36354E-02 ppm1      8.492 ppm2      0.702 CV     1
 ASSI {  409}
   (( segid "AREF" and resid 167  and name HN  ))
   (( segid "AREF" and resid 168  and name HA  ))
      3.600     1.600     1.600 peak   409 spectrum    3 weight  0.10000E+01 volume  0.28688E-02 ppm1      8.462 ppm2      4.091 CV     1
 ASSI {  410}
   (( segid "AREF" and resid 37   and name HN  ))
   (( segid "AREF" and resid 37   and name HB1 ))
      3.000     1.100     1.100 peak   410 spectrum    3 weight  0.10000E+01 volume  0.45646E-02 ppm1      8.460 ppm2      2.746 CV     1
 ASSI {  412}
   (( segid "AREF" and resid 127  and name HN  ))
   (( segid "AREF" and resid 127  and name HG2 ))
      3.300     1.400     1.400 peak   412 spectrum    3 weight  0.10000E+01 volume  0.27295E-02 ppm1      8.266 ppm2      1.588 CV     1
 OR {  412}
   (( segid "AREF" and resid 127  and name HN  ))
   (( segid "AREF" and resid 127  and name HG1 ))
 ASSI {  413}
   (( segid "AREF" and resid 127  and name HN  ))
   (( segid "AREF" and resid 123  and name HN  ))
      2.500     0.800     0.800 peak   413 spectrum    3 weight  0.10000E+01 volume  0.40884E-02 ppm1      8.260 ppm2      8.993 CV     1
 ASSI {  414}
   (( segid "AREF" and resid 127  and name HN  ))
   (( segid "AREF" and resid 125  and name HN  ))
      3.400     1.400     1.400 peak   414 spectrum    3 weight  0.10000E+01 volume  0.34496E-02 ppm1      8.264 ppm2      8.390 CV     1
 ASSI {  415}
   (( segid "AREF" and resid 127  and name HN  ))
   (( segid "AREF" and resid 126  and name HA2 ))
      2.700     0.900     0.900 peak   415 spectrum    3 weight  0.10000E+01 volume  0.44136E-02 ppm1      8.261 ppm2      4.173 CV     1
 ASSI {  417}
   (( segid "AREF" and resid 116  and name HN  ))
   (( segid "AREF" and resid 116  and name HA  ))
      2.500     0.800     0.800 peak   417 spectrum    3 weight  0.10000E+01 volume  0.44136E-02 ppm1      8.866 ppm2      4.289 CV     1
 ASSI {  419}
   (( segid "AREF" and resid 116  and name HN  ))
   (( segid "AREF" and resid 117  and name HN  ))
      2.700     0.900     0.900 peak   419 spectrum    3 weight  0.10000E+01 volume  0.31476E-02 ppm1      8.860 ppm2      7.402 CV     1
 ASSI {  420}
   (( segid "AREF" and resid 116  and name HN  ))
   (( segid "AREF" and resid 115  and name HA  ))
      2.300     0.700     0.700 peak   420 spectrum    3 weight  0.10000E+01 volume  0.28688E-02 ppm1      8.859 ppm2      4.455 CV     1
 ASSI {  421}
   (( segid "AREF" and resid 116  and name HN  ))
   (( segid "AREF" and resid 116  and name HG1 ))
      3.500     1.500     1.500 peak   421 spectrum    3 weight  0.10000E+01 volume  0.31127E-02 ppm1      8.856 ppm2      1.234 CV     1
 OR {  421}
   (( segid "AREF" and resid 116  and name HN  ))
   (( segid "AREF" and resid 116  and name HG2 ))
 ASSI {  426}
   (( segid "AREF" and resid 167  and name HN  ))
   (( segid "AREF" and resid 167  and name HB1 ))
      3.200     1.300     1.300 peak   426 spectrum    3 weight  0.10000E+01 volume  0.33450E-02 ppm1      8.476 ppm2      1.985 CV     1
 ASSI {  428}
   (( segid "AREF" and resid 116  and name HN  ))
   (( segid "AREF" and resid 116  and name HB2 ))
      2.200     0.600     0.600 peak   428 spectrum    3 weight  0.10000E+01 volume  0.43439E-02 ppm1      8.864 ppm2      1.651 CV     1
 OR {  428}
   (( segid "AREF" and resid 116  and name HN  ))
   (( segid "AREF" and resid 116  and name HB1 ))
 ASSI {  438}
   (( segid "AREF" and resid 145  and name HN  ))
   (( segid "AREF" and resid 146  and name HN  ))
      2.400     0.700     0.700 peak   438 spectrum    3 weight  0.10000E+01 volume  0.32173E-02 ppm1      7.530 ppm2      8.095 CV     1
 ASSI {  440}
   (( segid "AREF" and resid 145  and name HN  ))
   (( segid "AREF" and resid 144  and name HN  ))
      2.400     0.700     0.700 peak   440 spectrum    3 weight  0.10000E+01 volume  0.27062E-02 ppm1      7.529 ppm2      7.285 CV     1
 ASSI {  442}
   (( segid "AREF" and resid 145  and name HN  ))
   (( segid "AREF" and resid 145  and name HA  ))
      2.600     0.800     0.800 peak   442 spectrum    3 weight  0.10000E+01 volume  0.28108E-02 ppm1      7.528 ppm2      2.433 CV     1
 ASSI {  444}
   (( segid "AREF" and resid 145  and name HN  ))
   (  segid "AREF" and resid 145  and name HB% )
      2.500     0.800     0.800 peak   444 spectrum    3 weight  0.10000E+01 volume  0.24275E-02 ppm1      7.530 ppm2      1.140 CV     1
 ASSI {  447}
   (( segid "AREF" and resid 97   and name HN  ))
   (( segid "AREF" and resid 97   and name HB1 ))
      3.200     1.300     1.300 peak   447 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      9.320 ppm2      2.577 CV     1
 OR {  447}
   (( segid "AREF" and resid 97   and name HN  ))
   (( segid "AREF" and resid 97   and name HB2 ))
 ASSI {  448}
   (( segid "AREF" and resid 97   and name HN  ))
   (( segid "AREF" and resid 96   and name HB1 ))
      2.400     0.700     0.700 peak   448 spectrum    3 weight  0.10000E+01 volume  0.43904E-02 ppm1      9.323 ppm2      1.074 CV     1
 ASSI {  449}
   (( segid "AREF" and resid 97   and name HN  ))
   (  segid "AREF" and resid 96   and name HD2%)
      3.200     1.300     1.300 peak   449 spectrum    3 weight  0.10000E+01 volume  0.65857E-02 ppm1      9.320 ppm2      0.742 CV     1
 ASSI {  456}
   (( segid "AREF" and resid 56   and name HN  ))
   (( segid "AREF" and resid 56   and name HB1 ))
      3.300     1.400     1.400 peak   456 spectrum    3 weight  0.10000E+01 volume  0.26946E-02 ppm1      8.125 ppm2      1.680 CV     1
 OR {  456}
   (( segid "AREF" and resid 56   and name HN  ))
   (( segid "AREF" and resid 56   and name HG2 ))
 ASSI {  465}
   (( segid "AREF" and resid 76   and name HN  ))
   (( segid "AREF" and resid 77   and name HN  ))
      3.800     1.800     1.800 peak   465 spectrum    3 weight  0.10000E+01 volume  0.40187E-02 ppm1      8.146 ppm2      8.274 CV     1
 ASSI {  467}
   (( segid "AREF" and resid 76   and name HN  ))
   (( segid "AREF" and resid 75   and name HN  ))
      2.400     0.700     0.700 peak   467 spectrum    3 weight  0.10000E+01 volume  0.41464E-02 ppm1      8.146 ppm2      8.035 CV     1
 ASSI {  470}
   (( segid "AREF" and resid 76   and name HN  ))
   (( segid "AREF" and resid 75   and name HB2 ))
      3.400     1.400     1.400 peak   470 spectrum    3 weight  0.10000E+01 volume  0.31708E-02 ppm1      8.145 ppm2      3.151 CV     1
 ASSI {  471}
   (( segid "AREF" and resid 76   and name HN  ))
   (( segid "AREF" and resid 75   and name HB1 ))
      2.800     1.000     1.000 peak   471 spectrum    3 weight  0.10000E+01 volume  0.35773E-02 ppm1      8.146 ppm2      2.980 CV     1
 ASSI {  472}
   (( segid "AREF" and resid 76   and name HN  ))
   (( segid "AREF" and resid 76   and name HB2 ))
      3.200     1.300     1.300 peak   472 spectrum    3 weight  0.10000E+01 volume  0.27991E-02 ppm1      8.145 ppm2      2.704 CV     1
 ASSI {  473}
   (( segid "AREF" and resid 76   and name HN  ))
   (( segid "AREF" and resid 76   and name HB1 ))
      3.800     1.800     1.800 peak   473 spectrum    3 weight  0.10000E+01 volume  0.27178E-02 ppm1      8.145 ppm2      2.608 CV     1
 ASSI {  490}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 24   and name HA  ))
      2.800     1.000     1.000 peak   490 spectrum    3 weight  0.10000E+01 volume  0.52497E-02 ppm1      8.052 ppm2      4.432 CV     1
 ASSI {  494}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 27   and name HG11))
      2.000     0.500     0.500 peak   494 spectrum    3 weight  0.10000E+01 volume  0.27411E-02 ppm1      8.053 ppm2      1.216 CV     1
 ASSI {  499}
   (( segid "AREF" and resid 10   and name HN  ))
   (( segid "AREF" and resid 9    and name HA  ))
      2.900     1.000     1.000 peak   499 spectrum    3 weight  0.10000E+01 volume  0.31592E-02 ppm1      8.385 ppm2      4.325 CV     1
 ASSI {  501}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 73   and name HN  ))
      2.500     0.800     0.800 peak   501 spectrum    3 weight  0.10000E+01 volume  0.45530E-02 ppm1      8.026 ppm2      8.329 CV     1
 ASSI {  502}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 76   and name HN  ))
      3.000     1.100     1.100 peak   502 spectrum    3 weight  0.10000E+01 volume  0.28224E-02 ppm1      8.025 ppm2      8.148 CV     1
 ASSI {  505}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 73   and name HA  ))
      3.100     1.200     1.200 peak   505 spectrum    3 weight  0.10000E+01 volume  0.24042E-02 ppm1      8.023 ppm2      4.529 CV     1
 ASSI {  506}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 74   and name HA  ))
      2.600     0.900     0.900 peak   506 spectrum    3 weight  0.10000E+01 volume  0.26714E-02 ppm1      8.023 ppm2      4.196 CV     1
 ASSI {  507}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 73   and name HB1 ))
      3.100     1.200     1.200 peak   507 spectrum    3 weight  0.10000E+01 volume  0.28804E-02 ppm1      8.024 ppm2      2.608 CV     1
 OR {  507}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 73   and name HB2 ))
 ASSI {  508}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 74   and name HG  ))
      3.300     1.300     1.300 peak   508 spectrum    3 weight  0.10000E+01 volume  0.22300E-02 ppm1      8.023 ppm2      1.456 CV     1
 OR {  508}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 74   and name HB2 ))
 ASSI {  509}
   (( segid "AREF" and resid 74   and name HN  ))
   (( segid "AREF" and resid 74   and name HB1 ))
      3.600     1.700     1.700 peak   509 spectrum    3 weight  0.10000E+01 volume  0.27643E-02 ppm1      8.023 ppm2      1.363 CV     1
 ASSI {  510}
   (( segid "AREF" and resid 142  and name HN  ))
   (( segid "AREF" and resid 143  and name HN  ))
      2.300     0.700     0.700 peak   510 spectrum    3 weight  0.10000E+01 volume  0.29850E-02 ppm1      6.672 ppm2      7.837 CV     1
 ASSI {  512}
   (( segid "AREF" and resid 142  and name HN  ))
   (( segid "AREF" and resid 139  and name HA  ))
      2.400     2.400     3.600 peak   512 spectrum    3 weight  0.10000E+01 volume  0.46226E-02 ppm1      6.674 ppm2      3.670 CV     1
 ASSI {  513}
   (( segid "AREF" and resid 142  and name HN  ))
   (  segid "AREF" and resid 140  and name HB% )
      3.400     1.500     1.500 peak   513 spectrum    3 weight  0.10000E+01 volume  0.42858E-02 ppm1      6.673 ppm2      1.397 CV     1
 ASSI {  514}
   (( segid "AREF" and resid 142  and name HN  ))
   (  segid "AREF" and resid 142  and name HB% )
      2.600     0.800     0.800 peak   514 spectrum    3 weight  0.10000E+01 volume  0.25088E-02 ppm1      6.673 ppm2      1.129 CV     1
 ASSI {  516}
   (( segid "AREF" and resid 142  and name HN  ))
   (( segid "AREF" and resid 141  and name HA  ))
      2.700     0.900     0.900 peak   516 spectrum    3 weight  0.10000E+01 volume  0.44368E-02 ppm1      6.671 ppm2      4.323 CV     1
 ASSI {  519}
   (( segid "AREF" and resid 90   and name HN  ))
   (( segid "AREF" and resid 90   and name HB2 ))
      2.500     0.800     0.800 peak   519 spectrum    3 weight  0.10000E+01 volume  0.34147E-02 ppm1      8.533 ppm2      1.499 CV     1
 ASSI {  520}
   (( segid "AREF" and resid 90   and name HN  ))
   (( segid "AREF" and resid 89   and name HA  ))
      2.400     0.800     0.800 peak   520 spectrum    3 weight  0.10000E+01 volume  0.24391E-02 ppm1      8.532 ppm2      4.574 CV     1
 ASSI {  523}
   (( segid "AREF" and resid 74   and name HN  ))
   (  segid "AREF" and resid 74   and name HD2%)
      2.800     1.000     1.000 peak   523 spectrum    3 weight  0.10000E+01 volume  0.43555E-02 ppm1      8.022 ppm2      0.800 CV     1
 OR {  523}
   (( segid "AREF" and resid 74   and name HN  ))
   (  segid "AREF" and resid 74   and name HD1%)
 ASSI {  526}
   (( segid "AREF" and resid 161  and name HN  ))
   (( segid "AREF" and resid 160  and name HA  ))
      2.600     0.800     0.800 peak   526 spectrum    3 weight  0.10000E+01 volume  0.25088E-02 ppm1      7.693 ppm2      5.136 CV     1
 ASSI {  531}
   (( segid "AREF" and resid 90   and name HN  ))
   (( segid "AREF" and resid 90   and name HB1 ))
      2.500     0.800     0.800 peak   531 spectrum    3 weight  0.10000E+01 volume  0.27759E-02 ppm1      8.534 ppm2      1.334 CV     1
 ASSI {  532}
   (( segid "AREF" and resid 90   and name HN  ))
   (( segid "AREF" and resid 90   and name HA  ))
      2.500     0.800     0.800 peak   532 spectrum    3 weight  0.10000E+01 volume  0.35773E-02 ppm1      8.531 ppm2      4.967 CV     1
 ASSI {  533}
   (( segid "AREF" and resid 90   and name HN  ))
   (  segid "AREF" and resid 164  and name HG2%)
      3.100     1.200     1.200 peak   533 spectrum    3 weight  0.10000E+01 volume  0.36819E-02 ppm1      8.532 ppm2      0.774 CV     1
 OR {  533}
   (( segid "AREF" and resid 90   and name HN  ))
   (  segid "AREF" and resid 164  and name HG1%)
 ASSI {  539}
   (( segid "AREF" and resid 133  and name HN  ))
   (( segid "AREF" and resid 133  and name HA  ))
      2.500     0.800     0.800 peak   539 spectrum    3 weight  0.10000E+01 volume  0.34496E-02 ppm1      8.187 ppm2      5.097 CV     1
 ASSI {  540}
   (( segid "AREF" and resid 133  and name HN  ))
   (( segid "AREF" and resid 119  and name HA  ))
      3.500     1.600     1.600 peak   540 spectrum    3 weight  0.10000E+01 volume  0.20906E-02 ppm1      8.189 ppm2      4.796 CV     1
 ASSI {  541}
   (( segid "AREF" and resid 133  and name HN  ))
   (( segid "AREF" and resid 120  and name HA  ))
      3.100     1.200     1.200 peak   541 spectrum    3 weight  0.10000E+01 volume  0.34379E-02 ppm1      8.187 ppm2      3.924 CV     1
 ASSI {  543}
   (( segid "AREF" and resid 133  and name HN  ))
   (  segid "AREF" and resid 132  and name HB% )
      3.000     1.100     1.100 peak   543 spectrum    3 weight  0.10000E+01 volume  0.27411E-02 ppm1      8.187 ppm2      0.911 CV     1
 ASSI {  544}
   (( segid "AREF" and resid 133  and name HN  ))
   (( segid "AREF" and resid 133  and name HB2 ))
      2.700     0.900     0.900 peak   544 spectrum    3 weight  0.10000E+01 volume  0.29617E-02 ppm1      8.185 ppm2      2.612 CV     1
 ASSI {  547}
   (( segid "AREF" and resid 94   and name HN  ))
   (( segid "AREF" and resid 160  and name HN  ))
      2.600     0.900     0.900 peak   547 spectrum    3 weight  0.10000E+01 volume  0.37864E-02 ppm1      9.507 ppm2      8.066 CV     1
 ASSI {  548}
   (( segid "AREF" and resid 94   and name HN  ))
   (( segid "AREF" and resid 94   and name HA  ))
      2.300     0.700     0.700 peak   548 spectrum    3 weight  0.10000E+01 volume  0.44252E-02 ppm1      9.508 ppm2      5.316 CV     1
 ASSI {  549}
   (( segid "AREF" and resid 94   and name HN  ))
   (( segid "AREF" and resid 93   and name HA  ))
      2.400     0.700     0.700 peak   549 spectrum    3 weight  0.10000E+01 volume  0.24275E-02 ppm1      9.507 ppm2      4.946 CV     1
 ASSI {  552}
   (( segid "AREF" and resid 123  and name HN  ))
   (( segid "AREF" and resid 122  and name HA  ))
      2.600     0.900     0.900 peak   552 spectrum    3 weight  0.10000E+01 volume  0.27178E-02 ppm1      8.985 ppm2      5.056 CV     1
 ASSI {  553}
   (( segid "AREF" and resid 123  and name HN  ))
   (( segid "AREF" and resid 129  and name HG  ))
      3.000     1.100     1.100 peak   553 spectrum    3 weight  0.10000E+01 volume  0.43787E-02 ppm1      8.985 ppm2      1.491 CV     1
 OR {  553}
   (( segid "AREF" and resid 123  and name HN  ))
   (( segid "AREF" and resid 129  and name HB2 ))
 ASSI {  558}
   (( segid "AREF" and resid 123  and name HN  ))
   (( segid "AREF" and resid 123  and name HB1 ))
      2.800     1.000     1.000 peak   558 spectrum    3 weight  0.10000E+01 volume  0.30547E-02 ppm1      8.983 ppm2      2.688 CV     1
 ASSI {  562}
   (( segid "AREF" and resid 43   and name HN  ))
   (( segid "AREF" and resid 42   and name HA  ))
      2.900     1.000     1.000 peak   562 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      8.414 ppm2      4.432 CV     1
 ASSI {  565}
   (( segid "AREF" and resid 43   and name HN  ))
   (( segid "AREF" and resid 43   and name HB1 ))
      3.300     1.300     1.300 peak   565 spectrum    3 weight  0.10000E+01 volume  0.29153E-02 ppm1      8.414 ppm2      1.773 CV     1
 ASSI {  566}
   (( segid "AREF" and resid 43   and name HN  ))
   (( segid "AREF" and resid 43   and name HG2 ))
      3.400     1.500     1.500 peak   566 spectrum    3 weight  0.10000E+01 volume  0.35541E-02 ppm1      8.415 ppm2      1.643 CV     1
 OR {  566}
   (( segid "AREF" and resid 43   and name HN  ))
   (( segid "AREF" and resid 43   and name HG1 ))
 ASSI {  569}
   (( segid "AREF" and resid 20   and name HN  ))
   (( segid "AREF" and resid 21   and name HN  ))
      2.600     0.900     0.900 peak   569 spectrum    3 weight  0.10000E+01 volume  0.35309E-02 ppm1      8.286 ppm2      8.155 CV     1
 ASSI {  570}
   (( segid "AREF" and resid 20   and name HN  ))
   (( segid "AREF" and resid 19   and name HA  ))
      3.100     1.200     1.200 peak   570 spectrum    3 weight  0.10000E+01 volume  0.24042E-02 ppm1      8.285 ppm2      4.433 CV     1
 ASSI {  571}
   (( segid "AREF" and resid 20   and name HN  ))
   (( segid "AREF" and resid 20   and name HB2 ))
      2.700     0.900     0.900 peak   571 spectrum    3 weight  0.10000E+01 volume  0.26714E-02 ppm1      8.285 ppm2      2.718 CV     1
 ASSI {  573}
   (( segid "AREF" and resid 20   and name HN  ))
   (( segid "AREF" and resid 19   and name HB2 ))
      2.800     1.000     1.000 peak   573 spectrum    3 weight  0.10000E+01 volume  0.35076E-02 ppm1      8.283 ppm2      2.069 CV     1
 OR {  573}
   (( segid "AREF" and resid 20   and name HN  ))
   (( segid "AREF" and resid 19   and name HB1 ))
 ASSI {  577}
   (( segid "AREF" and resid 94   and name HN  ))
   (  segid "AREF" and resid 93   and name HG2%)
      3.200     1.300     1.300 peak   577 spectrum    3 weight  0.10000E+01 volume  0.36935E-02 ppm1      9.506 ppm2      0.732 CV     1
 ASSI {  578}
   (( segid "AREF" and resid 123  and name HN  ))
   (  segid "AREF" and resid 129  and name HD1%)
      2.700     2.700     3.300 peak   578 spectrum    3 weight  0.10000E+01 volume  0.47040E-02 ppm1      8.986 ppm2      0.698 CV     1
 ASSI {  579}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 103  and name HN  ))
      3.000     3.000     3.000 peak   579 spectrum    3 weight  0.10000E+01 volume  0.46923E-02 ppm1      8.623 ppm2      8.188 CV     1
 ASSI {  580}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 107  and name HN  ))
      2.500     0.800     0.800 peak   580 spectrum    3 weight  0.10000E+01 volume  0.31127E-02 ppm1      8.622 ppm2      7.875 CV     1
 ASSI {  582}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 103  and name HA  ))
      2.800     1.000     1.000 peak   582 spectrum    3 weight  0.10000E+01 volume  0.52266E-02 ppm1      8.619 ppm2      4.071 CV     1
 ASSI {  583}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 106  and name HA  ))
      2.600     0.900     0.900 peak   583 spectrum    3 weight  0.10000E+01 volume  0.30082E-02 ppm1      8.622 ppm2      3.665 CV     1
 ASSI {  584}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 106  and name HG1 ))
      3.800     1.800     1.800 peak   584 spectrum    3 weight  0.10000E+01 volume  0.31011E-02 ppm1      8.620 ppm2      2.414 CV     1
 OR {  584}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 106  and name HG2 ))
 ASSI {  585}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 106  and name HB1 ))
      2.500     0.800     0.800 peak   585 spectrum    3 weight  0.10000E+01 volume  0.25088E-02 ppm1      8.622 ppm2      2.119 CV     1
 OR {  585}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 106  and name HB2 ))
 ASSI {  588}
   (( segid "AREF" and resid 34   and name HN  ))
   (( segid "AREF" and resid 34   and name HA  ))
      2.900     1.000     1.000 peak   588 spectrum    3 weight  0.10000E+01 volume  0.25668E-02 ppm1      8.150 ppm2      4.281 CV     1
 ASSI {  589}
   (( segid "AREF" and resid 34   and name HN  ))
   (( segid "AREF" and resid 34   and name HB1 ))
      3.000     1.100     1.100 peak   589 spectrum    3 weight  0.10000E+01 volume  0.26133E-02 ppm1      8.150 ppm2      1.812 CV     1
 OR {  589}
   (( segid "AREF" and resid 34   and name HN  ))
   (( segid "AREF" and resid 34   and name HB2 ))
 ASSI {  593}
   (( segid "AREF" and resid 168  and name HN  ))
   (( segid "AREF" and resid 167  and name HG1 ))
      3.200     1.300     1.300 peak   593 spectrum    3 weight  0.10000E+01 volume  0.44484E-02 ppm1      8.049 ppm2      2.335 CV     1
 OR {  593}
   (( segid "AREF" and resid 168  and name HN  ))
   (( segid "AREF" and resid 167  and name HG2 ))
 ASSI {  594}
   (( segid "AREF" and resid 168  and name HN  ))
   (( segid "AREF" and resid 167  and name HB2 ))
      3.000     1.100     1.100 peak   594 spectrum    3 weight  0.10000E+01 volume  0.35193E-02 ppm1      8.050 ppm2      2.092 CV     1
 ASSI {  598}
   (( segid "AREF" and resid 29   and name HN  ))
   (( segid "AREF" and resid 28   and name HA  ))
      2.900     1.000     1.000 peak   598 spectrum    3 weight  0.10000E+01 volume  0.23578E-02 ppm1      7.967 ppm2      4.127 CV     1
 ASSI {  599}
   (( segid "AREF" and resid 29   and name HN  ))
   (( segid "AREF" and resid 26   and name HA  ))
      2.600     2.600     3.400 peak   599 spectrum    3 weight  0.10000E+01 volume  0.38328E-02 ppm1      7.971 ppm2      3.900 CV     1
 ASSI {  601}
   (( segid "AREF" and resid 29   and name HN  ))
   (( segid "AREF" and resid 28   and name HD1 ))
      4.200     2.200     1.800 peak   601 spectrum    3 weight  0.10000E+01 volume  0.20210E-02 ppm1      7.969 ppm2      1.698 CV     1
 ASSI {  602}
   (( segid "AREF" and resid 29   and name HN  ))
   (  segid "AREF" and resid 29   and name HD2%)
      3.700     1.700     1.700 peak   602 spectrum    3 weight  0.10000E+01 volume  0.29734E-02 ppm1      7.970 ppm2      0.882 CV     1
 OR {  602}
   (( segid "AREF" and resid 29   and name HN  ))
   (  segid "AREF" and resid 29   and name HD1%)
 ASSI {  604}
   (( segid "AREF" and resid 71   and name HN  ))
   (( segid "AREF" and resid 71   and name HB2 ))
      2.900     1.000     1.000 peak   604 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      7.959 ppm2      1.938 CV     1
 ASSI {  606}
   (( segid "AREF" and resid 91   and name HN  ))
   (( segid "AREF" and resid 135  and name HA  ))
      2.500     0.800     0.800 peak   606 spectrum    3 weight  0.10000E+01 volume  0.58420E-02 ppm1      9.352 ppm2      5.411 CV     1
 ASSI {  607}
   (( segid "AREF" and resid 91   and name HN  ))
   (( segid "AREF" and resid 90   and name HA  ))
      2.300     0.700     0.700 peak   607 spectrum    3 weight  0.10000E+01 volume  0.24972E-02 ppm1      9.355 ppm2      4.969 CV     1
 ASSI {  608}
   (( segid "AREF" and resid 91   and name HN  ))
   (( segid "AREF" and resid 91   and name HB1 ))
      2.200     0.600     0.600 peak   608 spectrum    3 weight  0.10000E+01 volume  0.31244E-02 ppm1      9.353 ppm2      1.686 CV     1
 OR {  608}
   (( segid "AREF" and resid 91   and name HN  ))
   (( segid "AREF" and resid 91   and name HB2 ))
 ASSI {  609}
   (( segid "AREF" and resid 91   and name HN  ))
   (  segid "AREF" and resid 91   and name HD1%)
      3.300     1.300     1.300 peak   609 spectrum    3 weight  0.10000E+01 volume  0.34031E-02 ppm1      9.353 ppm2      0.786 CV     1
 OR {  609}
   (( segid "AREF" and resid 91   and name HN  ))
   (  segid "AREF" and resid 91   and name HD2%)
 ASSI {  616}
   (( segid "AREF" and resid 168  and name HN  ))
   (( segid "AREF" and resid 167  and name HA  ))
      2.900     1.100     1.100 peak   616 spectrum    3 weight  0.10000E+01 volume  0.21603E-02 ppm1      8.051 ppm2      4.334 CV     1
 ASSI {  619}
   (( segid "AREF" and resid 168  and name HN  ))
   (( segid "AREF" and resid 168  and name HG12))
      2.900     1.000     1.000 peak   619 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      8.051 ppm2      1.124 CV     1
 ASSI {  623}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 26   and name HN  ))
      2.400     0.700     0.700 peak   623 spectrum    3 weight  0.10000E+01 volume  0.29153E-02 ppm1      8.051 ppm2      7.930 CV     1
 ASSI {  626}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 28   and name HG1 ))
      4.100     2.100     1.900 peak   626 spectrum    3 weight  0.10000E+01 volume  0.30198E-02 ppm1      8.051 ppm2      1.399 CV     1
 ASSI {  627}
   (( segid "AREF" and resid 71   and name HN  ))
   (( segid "AREF" and resid 71   and name HG2 ))
      3.200     1.300     1.300 peak   627 spectrum    3 weight  0.10000E+01 volume  0.34379E-02 ppm1      7.959 ppm2      2.075 CV     1
 OR {  627}
   (( segid "AREF" and resid 71   and name HN  ))
   (( segid "AREF" and resid 71   and name HG1 ))
 ASSI {  632}
   (( segid "AREF" and resid 73   and name HN  ))
   (( segid "AREF" and resid 74   and name HB1 ))
      4.100     2.100     1.900 peak   632 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      8.291 ppm2      1.367 CV     1
 ASSI {  635}
   (( segid "AREF" and resid 21   and name HN  ))
   (( segid "AREF" and resid 21   and name HA  ))
      2.600     0.900     0.900 peak   635 spectrum    3 weight  0.10000E+01 volume  0.27991E-02 ppm1      8.145 ppm2      4.520 CV     1
 ASSI {  643}
   (( segid "AREF" and resid 26   and name HN  ))
   (( segid "AREF" and resid 25   and name HA  ))
      2.900     1.100     1.100 peak   643 spectrum    3 weight  0.10000E+01 volume  0.28456E-02 ppm1      7.912 ppm2      4.490 CV     1
 ASSI {  644}
   (( segid "AREF" and resid 26   and name HN  ))
   (( segid "AREF" and resid 23   and name HA  ))
      2.800     1.000     1.000 peak   644 spectrum    3 weight  0.10000E+01 volume  0.34031E-02 ppm1      7.911 ppm2      4.232 CV     1
 ASSI {  645}
   (( segid "AREF" and resid 26   and name HN  ))
   (( segid "AREF" and resid 26   and name HA  ))
      2.700     0.900     0.900 peak   645 spectrum    3 weight  0.10000E+01 volume  0.27178E-02 ppm1      7.912 ppm2      3.894 CV     1
 ASSI {  646}
   (( segid "AREF" and resid 26   and name HN  ))
   (( segid "AREF" and resid 25   and name HB1 ))
      2.700     0.900     0.900 peak   646 spectrum    3 weight  0.10000E+01 volume  0.29966E-02 ppm1      7.912 ppm2      2.741 CV     1
 OR {  646}
   (( segid "AREF" and resid 26   and name HN  ))
   (( segid "AREF" and resid 25   and name HB2 ))
 ASSI {  650}
   (( segid "AREF" and resid 26   and name HN  ))
   (  segid "AREF" and resid 26   and name HD1%)
      4.000     2.000     2.000 peak   650 spectrum    3 weight  0.10000E+01 volume  0.26714E-02 ppm1      7.911 ppm2      0.878 CV     1
 OR {  650}
   (( segid "AREF" and resid 26   and name HN  ))
   (  segid "AREF" and resid 26   and name HG2%)
 ASSI {  656}
   (( segid "AREF" and resid 51   and name HN  ))
   (( segid "AREF" and resid 49   and name HN  ))
      2.100     2.100     3.900 peak   656 spectrum    3 weight  0.10000E+01 volume  0.49013E-02 ppm1      8.325 ppm2      8.019 CV     1
 ASSI {  657}
   (( segid "AREF" and resid 29   and name HN  ))
   (( segid "AREF" and resid 25   and name HA  ))
      2.800     2.800     3.200 peak   657 spectrum    3 weight  0.10000E+01 volume  0.44484E-02 ppm1      7.968 ppm2      4.491 CV     1
 ASSI {  659}
   (( segid "AREF" and resid 70   and name HN  ))
   (( segid "AREF" and resid 68   and name HB1 ))
      2.100     2.100     3.900 peak   659 spectrum    3 weight  0.10000E+01 volume  0.49712E-02 ppm1      7.968 ppm2      2.581 CV     1
 OR {  659}
   (( segid "AREF" and resid 70   and name HN  ))
   (( segid "AREF" and resid 68   and name HB2 ))
 ASSI {  666}
   (( segid "AREF" and resid 157  and name HN  ))
   (( segid "AREF" and resid 157  and name HA  ))
      2.700     0.900     0.900 peak   666 spectrum    3 weight  0.10000E+01 volume  0.35309E-02 ppm1      7.534 ppm2      4.970 CV     1
 ASSI {  668}
   (( segid "AREF" and resid 157  and name HN  ))
   (( segid "AREF" and resid 156  and name HA2 ))
      3.400     1.400     1.400 peak   668 spectrum    3 weight  0.10000E+01 volume  0.30314E-02 ppm1      7.535 ppm2      4.224 CV     1
 ASSI {  669}
   (( segid "AREF" and resid 157  and name HN  ))
   (( segid "AREF" and resid 156  and name HA1 ))
      2.800     1.000     1.000 peak   669 spectrum    3 weight  0.10000E+01 volume  0.35193E-02 ppm1      7.536 ppm2      3.598 CV     1
 ASSI {  671}
   (( segid "AREF" and resid 157  and name HN  ))
   (( segid "AREF" and resid 157  and name HB1 ))
      3.000     1.100     1.100 peak   671 spectrum    3 weight  0.10000E+01 volume  0.25901E-02 ppm1      7.536 ppm2      1.836 CV     1
 OR {  671}
   (( segid "AREF" and resid 157  and name HN  ))
   (( segid "AREF" and resid 157  and name HB2 ))
 ASSI {  674}
   (( segid "AREF" and resid 83   and name HN  ))
   (( segid "AREF" and resid 83   and name HA  ))
      2.800     1.000     1.000 peak   674 spectrum    3 weight  0.10000E+01 volume  0.29501E-02 ppm1      8.421 ppm2      4.297 CV     1
 ASSI {  675}
   (( segid "AREF" and resid 83   and name HN  ))
   (( segid "AREF" and resid 82   and name HA2 ))
      3.000     1.100     1.100 peak   675 spectrum    3 weight  0.10000E+01 volume  0.24507E-02 ppm1      8.421 ppm2      3.966 CV     1
 OR {  675}
   (( segid "AREF" and resid 83   and name HN  ))
   (( segid "AREF" and resid 82   and name HA1 ))
 ASSI {  676}
   (( segid "AREF" and resid 83   and name HN  ))
   (( segid "AREF" and resid 83   and name HG1 ))
      3.700     1.700     1.700 peak   676 spectrum    3 weight  0.10000E+01 volume  0.31244E-02 ppm1      8.421 ppm2      2.261 CV     1
 OR {  676}
   (( segid "AREF" and resid 83   and name HN  ))
   (( segid "AREF" and resid 83   and name HG2 ))
 ASSI {  677}
   (( segid "AREF" and resid 83   and name HN  ))
   (( segid "AREF" and resid 83   and name HB2 ))
      2.600     0.800     0.800 peak   677 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      8.421 ppm2      2.070 CV     1
 ASSI {  678}
   (( segid "AREF" and resid 83   and name HN  ))
   (( segid "AREF" and resid 83   and name HB1 ))
      3.400     1.400     1.400 peak   678 spectrum    3 weight  0.10000E+01 volume  0.27411E-02 ppm1      8.421 ppm2      1.945 CV     1
 ASSI {  681}
   (( segid "AREF" and resid 19   and name HN  ))
   (( segid "AREF" and resid 18   and name HN  ))
      2.400     0.700     0.700 peak   681 spectrum    3 weight  0.10000E+01 volume  0.41464E-02 ppm1      8.249 ppm2      7.990 CV     1
 ASSI {  684}
   (( segid "AREF" and resid 19   and name HN  ))
   (( segid "AREF" and resid 19   and name HA  ))
      2.800     1.000     1.000 peak   684 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      8.248 ppm2      4.440 CV     1
 ASSI {  695}
   (( segid "AREF" and resid 36   and name HN  ))
   (( segid "AREF" and resid 36   and name HB  ))
      3.200     1.300     1.300 peak   695 spectrum    3 weight  0.10000E+01 volume  0.26714E-02 ppm1      8.065 ppm2      2.056 CV     1
 ASSI {  696}
   (( segid "AREF" and resid 36   and name HN  ))
   (  segid "AREF" and resid 36   and name HG1%)
      3.300     1.400     1.400 peak   696 spectrum    3 weight  0.10000E+01 volume  0.25436E-02 ppm1      8.066 ppm2      0.914 CV     1
 OR {  696}
   (( segid "AREF" and resid 36   and name HN  ))
   (  segid "AREF" and resid 36   and name HG2%)
 ASSI {  697}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 17   and name HN  ))
      2.300     0.700     0.700 peak   697 spectrum    3 weight  0.10000E+01 volume  0.36238E-02 ppm1      7.991 ppm2      8.129 CV     1
 ASSI {  700}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 17   and name HA  ))
      3.300     1.300     1.300 peak   700 spectrum    3 weight  0.10000E+01 volume  0.25901E-02 ppm1      7.991 ppm2      4.557 CV     1
 ASSI {  701}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 18   and name HA  ))
      2.500     0.800     0.800 peak   701 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      7.992 ppm2      4.293 CV     1
 ASSI {  702}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 17   and name HB1 ))
      2.600     0.800     0.800 peak   702 spectrum    3 weight  0.10000E+01 volume  0.43091E-02 ppm1      7.992 ppm2      2.617 CV     1
 ASSI {  703}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 18   and name HB2 ))
      2.500     0.800     0.800 peak   703 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      7.991 ppm2      1.875 CV     1
 ASSI {  704}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 18   and name HB1 ))
      3.400     1.400     1.400 peak   704 spectrum    3 weight  0.10000E+01 volume  0.26598E-02 ppm1      7.992 ppm2      1.772 CV     1
 ASSI {  705}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 18   and name HG2 ))
      3.500     1.500     1.500 peak   705 spectrum    3 weight  0.10000E+01 volume  0.31244E-02 ppm1      7.991 ppm2      1.426 CV     1
 OR {  705}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 18   and name HG1 ))
 ASSI {  709}
   (( segid "AREF" and resid 70   and name HN  ))
   (( segid "AREF" and resid 70   and name HD1 ))
      2.900     1.000     1.000 peak   709 spectrum    3 weight  0.10000E+01 volume  0.39374E-02 ppm1      7.969 ppm2      7.217 CV     1
 ASSI {  711}
   (( segid "AREF" and resid 70   and name HN  ))
   (( segid "AREF" and resid 69   and name HG2 ))
      3.700     1.700     1.700 peak   711 spectrum    3 weight  0.10000E+01 volume  0.38212E-02 ppm1      7.969 ppm2      1.169 CV     1
 OR {  711}
   (( segid "AREF" and resid 70   and name HN  ))
   (( segid "AREF" and resid 69   and name HG1 ))
 ASSI {  715}
   (( segid "AREF" and resid 102  and name HN  ))
   (( segid "AREF" and resid 101  and name HB2 ))
      2.900     1.000     1.000 peak   715 spectrum    3 weight  0.10000E+01 volume  0.29617E-02 ppm1      8.684 ppm2      4.401 CV     1
 ASSI {  716}
   (( segid "AREF" and resid 102  and name HN  ))
   (( segid "AREF" and resid 101  and name HB1 ))
      2.300     0.700     0.700 peak   716 spectrum    3 weight  0.10000E+01 volume  0.29617E-02 ppm1      8.682 ppm2      4.004 CV     1
 ASSI {  717}
   (( segid "AREF" and resid 102  and name HN  ))
   (( segid "AREF" and resid 102  and name HB2 ))
      2.700     0.900     0.900 peak   717 spectrum    3 weight  0.10000E+01 volume  0.32637E-02 ppm1      8.682 ppm2      2.919 CV     1
 ASSI {  718}
   (( segid "AREF" and resid 102  and name HN  ))
   (( segid "AREF" and resid 102  and name HB1 ))
      2.800     1.000     1.000 peak   718 spectrum    3 weight  0.10000E+01 volume  0.30082E-02 ppm1      8.682 ppm2      2.763 CV     1
 ASSI {  719}
   (( segid "AREF" and resid 102  and name HN  ))
   (  segid "AREF" and resid 120  and name HG1%)
      3.200     1.300     1.300 peak   719 spectrum    3 weight  0.10000E+01 volume  0.34496E-02 ppm1      8.683 ppm2      0.733 CV     1
 ASSI {  720}
   (( segid "AREF" and resid 122  and name HN  ))
   (( segid "AREF" and resid 122  and name HA  ))
      2.700     0.900     0.900 peak   720 spectrum    3 weight  0.10000E+01 volume  0.38909E-02 ppm1      8.351 ppm2      5.056 CV     1
 ASSI {  722}
   (( segid "AREF" and resid 122  and name HN  ))
   (  segid "AREF" and resid 122  and name HD% )
      3.100     1.200     1.200 peak   722 spectrum    3 weight  0.10000E+01 volume  0.34496E-02 ppm1      8.350 ppm2      6.907 CV     1
 OR {  722}
   (( segid "AREF" and resid 122  and name HN  ))
   (  segid "AREF" and resid 122  and name HE% )
 ASSI {  723}
   (( segid "AREF" and resid 122  and name HN  ))
   (( segid "AREF" and resid 122  and name HB1 ))
      2.900     1.000     1.000 peak   723 spectrum    3 weight  0.10000E+01 volume  0.28688E-02 ppm1      8.349 ppm2      2.743 CV     1
 OR {  723}
   (( segid "AREF" and resid 122  and name HN  ))
   (( segid "AREF" and resid 122  and name HB2 ))
 ASSI {  724}
   (( segid "AREF" and resid 19   and name HN  ))
   (( segid "AREF" and resid 18   and name HB2 ))
      2.800     2.800     3.200 peak   724 spectrum    3 weight  0.10000E+01 volume  0.57375E-02 ppm1      8.249 ppm2      1.875 CV     1
 ASSI {  726}
   (( segid "AREF" and resid 31   and name HN  ))
   (( segid "AREF" and resid 31   and name HB2 ))
      2.900     1.000     1.000 peak   726 spectrum    3 weight  0.10000E+01 volume  0.26946E-02 ppm1      8.199 ppm2      1.842 CV     1
 OR {  726}
   (( segid "AREF" and resid 31   and name HN  ))
   (( segid "AREF" and resid 31   and name HB1 ))
 ASSI {  731}
   (( segid "AREF" and resid 36   and name HN  ))
   (( segid "AREF" and resid 35   and name HN  ))
      2.700     0.900     0.900 peak   731 spectrum    3 weight  0.10000E+01 volume  0.37051E-02 ppm1      8.066 ppm2      8.194 CV     1
 ASSI {  734}
   (( segid "AREF" and resid 18   and name HN  ))
   (( segid "AREF" and resid 17   and name HB2 ))
      2.700     0.900     0.900 peak   734 spectrum    3 weight  0.10000E+01 volume  0.40419E-02 ppm1      7.992 ppm2      2.695 CV     1
 ASSI {  737}
   (( segid "AREF" and resid 102  and name HN  ))
   (( segid "AREF" and resid 103  and name HN  ))
      2.400     0.700     0.700 peak   737 spectrum    3 weight  0.10000E+01 volume  0.36586E-02 ppm1      8.685 ppm2      8.184 CV     1
 ASSI {  738}
   (( segid "AREF" and resid 102  and name HN  ))
   (( segid "AREF" and resid 101  and name HA  ))
      2.800     1.000     1.000 peak   738 spectrum    3 weight  0.10000E+01 volume  0.26249E-02 ppm1      8.682 ppm2      4.970 CV     1
 ASSI {  739}
   (( segid "AREF" and resid 102  and name HN  ))
   (( segid "AREF" and resid 102  and name HA  ))
      2.600     0.800     0.800 peak   739 spectrum    3 weight  0.10000E+01 volume  0.30198E-02 ppm1      8.683 ppm2      4.149 CV     1
 ASSI {  740}
   (( segid "AREF" and resid 54   and name HN  ))
   (( segid "AREF" and resid 54   and name HB1 ))
      2.900     1.000     1.000 peak   740 spectrum    3 weight  0.10000E+01 volume  0.36819E-02 ppm1      8.229 ppm2      1.759 CV     1
 OR {  740}
   (( segid "AREF" and resid 54   and name HN  ))
   (( segid "AREF" and resid 54   and name HB2 ))
 ASSI {  751}
   (( segid "AREF" and resid 68   and name HN  ))
   (( segid "AREF" and resid 67   and name HB2 ))
      2.700     0.900     0.900 peak   751 spectrum    3 weight  0.10000E+01 volume  0.32870E-02 ppm1      8.271 ppm2      1.845 CV     1
 ASSI {  753}
   (( segid "AREF" and resid 54   and name HN  ))
   (( segid "AREF" and resid 53   and name HA2 ))
      2.900     1.100     1.100 peak   753 spectrum    3 weight  0.10000E+01 volume  0.30198E-02 ppm1      8.223 ppm2      3.962 CV     1
 OR {  753}
   (( segid "AREF" and resid 54   and name HN  ))
   (( segid "AREF" and resid 53   and name HA1 ))
 ASSI {  754}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 70   and name HN  ))
      3.400     1.400     1.400 peak   754 spectrum    3 weight  0.10000E+01 volume  0.34263E-02 ppm1      8.090 ppm2      7.966 CV     1
 ASSI {  755}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 68   and name HN  ))
      2.700     0.900     0.900 peak   755 spectrum    3 weight  0.10000E+01 volume  0.34844E-02 ppm1      8.087 ppm2      8.272 CV     1
 ASSI {  757}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 69   and name HA  ))
      2.800     1.000     1.000 peak   757 spectrum    3 weight  0.10000E+01 volume  0.26946E-02 ppm1      8.086 ppm2      4.154 CV     1
 ASSI {  758}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 68   and name HB1 ))
      3.600     1.700     1.700 peak   758 spectrum    3 weight  0.10000E+01 volume  0.28224E-02 ppm1      8.086 ppm2      2.580 CV     1
 OR {  758}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 68   and name HB2 ))
 ASSI {  760}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 69   and name HG1 ))
      3.600     1.600     1.600 peak   760 spectrum    3 weight  0.10000E+01 volume  0.29153E-02 ppm1      8.087 ppm2      1.169 CV     1
 OR {  760}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 69   and name HG2 ))
 ASSI {  767}
   (( segid "AREF" and resid 8    and name HN  ))
   (( segid "AREF" and resid 10   and name HN  ))
      2.500     0.800     0.800 peak   767 spectrum    3 weight  0.10000E+01 volume  0.58536E-02 ppm1      8.275 ppm2      8.394 CV     1
 ASSI {  772}
   (( segid "AREF" and resid 68   and name HN  ))
   (( segid "AREF" and resid 68   and name HB2 ))
      3.200     1.300     1.300 peak   772 spectrum    3 weight  0.10000E+01 volume  0.24972E-02 ppm1      8.272 ppm2      2.583 CV     1
 OR {  772}
   (( segid "AREF" and resid 68   and name HN  ))
   (( segid "AREF" and resid 68   and name HB1 ))
 ASSI {  773}
   (( segid "AREF" and resid 68   and name HN  ))
   (( segid "AREF" and resid 67   and name HB1 ))
      3.700     1.700     1.700 peak   773 spectrum    3 weight  0.10000E+01 volume  0.33915E-02 ppm1      8.273 ppm2      2.244 CV     1
 ASSI {  774}
   (( segid "AREF" and resid 103  and name HN  ))
   (( segid "AREF" and resid 104  and name HN  ))
      2.400     0.700     0.700 peak   774 spectrum    3 weight  0.10000E+01 volume  0.29269E-02 ppm1      8.189 ppm2      7.527 CV     1
 ASSI {  775}
   (( segid "AREF" and resid 103  and name HN  ))
   (( segid "AREF" and resid 102  and name HB1 ))
      3.000     1.100     1.100 peak   775 spectrum    3 weight  0.10000E+01 volume  0.29501E-02 ppm1      8.189 ppm2      2.763 CV     1
 ASSI {  782}
   (( segid "AREF" and resid 103  and name HN  ))
   (( segid "AREF" and resid 101  and name HB2 ))
      2.200     0.600     0.600 peak   782 spectrum    3 weight  0.10000E+01 volume  0.58536E-02 ppm1      8.188 ppm2      4.407 CV     1
 ASSI {  783}
   (( segid "AREF" and resid 103  and name HN  ))
   (( segid "AREF" and resid 102  and name HB2 ))
      3.000     1.100     1.100 peak   783 spectrum    3 weight  0.10000E+01 volume  0.31244E-02 ppm1      8.188 ppm2      2.920 CV     1
 ASSI {  791}
   (( segid "AREF" and resid 144  and name HN  ))
   (( segid "AREF" and resid 143  and name HN  ))
      2.500     0.800     0.800 peak   791 spectrum    3 weight  0.10000E+01 volume  0.27411E-02 ppm1      7.287 ppm2      7.848 CV     1
 ASSI {  792}
   (( segid "AREF" and resid 144  and name HN  ))
   (( segid "AREF" and resid 144  and name HA  ))
      2.600     0.900     0.900 peak   792 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      7.288 ppm2      3.846 CV     1
 ASSI {  793}
   (( segid "AREF" and resid 144  and name HN  ))
   (( segid "AREF" and resid 143  and name HB1 ))
      2.200     0.600     0.600 peak   793 spectrum    3 weight  0.10000E+01 volume  0.31940E-02 ppm1      7.287 ppm2      1.445 CV     1
 ASSI {  797}
   (( segid "AREF" and resid 8    and name HN  ))
   (( segid "AREF" and resid 7    and name HA1 ))
      2.800     1.000     1.000 peak   797 spectrum    3 weight  0.10000E+01 volume  0.34844E-02 ppm1      8.274 ppm2      3.971 CV     1
 OR {  797}
   (( segid "AREF" and resid 8    and name HN  ))
   (( segid "AREF" and resid 7    and name HA2 ))
 ASSI {  799}
   (( segid "AREF" and resid 144  and name HN  ))
   (( segid "AREF" and resid 141  and name HA  ))
      2.600     2.600     3.400 peak   799 spectrum    3 weight  0.10000E+01 volume  0.51688E-02 ppm1      7.287 ppm2      4.311 CV     1
 ASSI {  807}
   (( segid "AREF" and resid 171  and name HN  ))
   (( segid "AREF" and resid 171  and name HG2 ))
      3.700     1.700     1.700 peak   807 spectrum    3 weight  0.10000E+01 volume  0.31127E-02 ppm1      8.192 ppm2      2.188 CV     1
 ASSI {  808}
   (( segid "AREF" and resid 33   and name HN  ))
   (( segid "AREF" and resid 32   and name HB1 ))
      3.000     1.200     1.200 peak   808 spectrum    3 weight  0.10000E+01 volume  0.34960E-02 ppm1      8.139 ppm2      2.848 CV     1
 OR {  808}
   (( segid "AREF" and resid 33   and name HN  ))
   (( segid "AREF" and resid 32   and name HB2 ))
 ASSI {  809}
   (( segid "AREF" and resid 33   and name HN  ))
   (( segid "AREF" and resid 33   and name HG2 ))
      3.300     1.400     1.400 peak   809 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      8.137 ppm2      2.381 CV     1
 OR {  809}
   (( segid "AREF" and resid 33   and name HN  ))
   (( segid "AREF" and resid 33   and name HG1 ))
 ASSI {  810}
   (( segid "AREF" and resid 33   and name HN  ))
   (( segid "AREF" and resid 33   and name HB2 ))
      2.500     0.800     0.800 peak   810 spectrum    3 weight  0.10000E+01 volume  0.28108E-02 ppm1      8.137 ppm2      2.026 CV     1
 ASSI {  813}
   (( segid "AREF" and resid 33   and name HN  ))
   (( segid "AREF" and resid 33   and name HA  ))
      2.800     1.000     1.000 peak   813 spectrum    3 weight  0.10000E+01 volume  0.30198E-02 ppm1      8.136 ppm2      4.268 CV     1
 ASSI {  814}
   (( segid "AREF" and resid 33   and name HN  ))
   (( segid "AREF" and resid 33   and name HB1 ))
      3.300     1.400     1.400 peak   814 spectrum    3 weight  0.10000E+01 volume  0.33334E-02 ppm1      8.135 ppm2      2.123 CV     1
 ASSI {  827}
   (( segid "AREF" and resid 132  and name HN  ))
   (  segid "AREF" and resid 120  and name HG2%)
      3.800     1.800     1.800 peak   827 spectrum    3 weight  0.10000E+01 volume  0.44717E-02 ppm1      9.151 ppm2      0.463 CV     1
 ASSI {  829}
   (( segid "AREF" and resid 132  and name HN  ))
   (( segid "AREF" and resid 93   and name HN  ))
      2.400     0.700     0.700 peak   829 spectrum    3 weight  0.10000E+01 volume  0.44020E-02 ppm1      9.149 ppm2      8.947 CV     1
 ASSI {  830}
   (( segid "AREF" and resid 132  and name HN  ))
   (( segid "AREF" and resid 131  and name HA  ))
      2.400     0.700     0.700 peak   830 spectrum    3 weight  0.10000E+01 volume  0.25785E-02 ppm1      9.148 ppm2      5.324 CV     1
 ASSI {  832}
   (( segid "AREF" and resid 132  and name HN  ))
   (  segid "AREF" and resid 131  and name HG2%)
      2.900     1.000     1.000 peak   832 spectrum    3 weight  0.10000E+01 volume  0.31011E-02 ppm1      9.148 ppm2      1.049 CV     1
 ASSI {  833}
   (( segid "AREF" and resid 132  and name HN  ))
   (  segid "AREF" and resid 132  and name HB% )
      2.700     0.900     0.900 peak   833 spectrum    3 weight  0.10000E+01 volume  0.29850E-02 ppm1      9.147 ppm2      0.902 CV     1
 ASSI {  834}
   (( segid "AREF" and resid 132  and name HN  ))
   (  segid "AREF" and resid 93   and name HG2%)
      2.400     2.400     3.600 peak   834 spectrum    3 weight  0.10000E+01 volume  0.58420E-02 ppm1      9.147 ppm2      0.726 CV     1
 ASSI {  835}
   (( segid "AREF" and resid 132  and name HN  ))
   (  segid "AREF" and resid 92   and name HD2%)
      3.200     3.200     2.800 peak   835 spectrum    3 weight  0.10000E+01 volume  0.58657E-02 ppm1      9.124 ppm2      0.857 CV     1
 ASSI {  842}
   (( segid "AREF" and resid 171  and name HN  ))
   (( segid "AREF" and resid 170  and name HB2 ))
      2.500     0.800     0.800 peak   842 spectrum    3 weight  0.10000E+01 volume  0.29501E-02 ppm1      8.194 ppm2      1.599 CV     1
 OR {  842}
   (( segid "AREF" and resid 171  and name HN  ))
   (( segid "AREF" and resid 170  and name HG  ))
 ASSI {  844}
   (( segid "AREF" and resid 75   and name HN  ))
   (  segid "AREF" and resid 75   and name HD% )
      3.600     1.600     1.600 peak   844 spectrum    3 weight  0.10000E+01 volume  0.41000E-02 ppm1      8.070 ppm2      7.215 CV     1
 ASSI {  845}
   (( segid "AREF" and resid 75   and name HN  ))
   (( segid "AREF" and resid 74   and name HB2 ))
      2.400     0.700     0.700 peak   845 spectrum    3 weight  0.10000E+01 volume  0.29501E-02 ppm1      8.070 ppm2      1.456 CV     1
 OR {  845}
   (( segid "AREF" and resid 75   and name HN  ))
   (( segid "AREF" and resid 74   and name HG  ))
 ASSI {  846}
   (( segid "AREF" and resid 25   and name HN  ))
   (( segid "AREF" and resid 24   and name HN  ))
      2.700     0.900     0.900 peak   846 spectrum    3 weight  0.10000E+01 volume  0.27759E-02 ppm1      7.944 ppm2      8.130 CV     1
 ASSI {  849}
   (( segid "AREF" and resid 25   and name HN  ))
   (( segid "AREF" and resid 25   and name HB2 ))
      2.700     0.900     0.900 peak   849 spectrum    3 weight  0.10000E+01 volume  0.23113E-02 ppm1      7.945 ppm2      2.743 CV     1
 OR {  849}
   (( segid "AREF" and resid 25   and name HN  ))
   (( segid "AREF" and resid 25   and name HB1 ))
 ASSI {  850}
   (( segid "AREF" and resid 25   and name HN  ))
   (( segid "AREF" and resid 24   and name HB1 ))
      2.800     1.000     1.000 peak   850 spectrum    3 weight  0.10000E+01 volume  0.28804E-02 ppm1      7.944 ppm2      2.561 CV     1
 OR {  850}
   (( segid "AREF" and resid 25   and name HN  ))
   (( segid "AREF" and resid 24   and name HB2 ))
 ASSI {  853}
   (( segid "AREF" and resid 132  and name HN  ))
   (( segid "AREF" and resid 93   and name HB  ))
      3.000     3.000     3.000 peak   853 spectrum    3 weight  0.10000E+01 volume  0.65972E-02 ppm1      9.152 ppm2      1.888 CV     1
 ASSI {  860}
   (( segid "AREF" and resid 75   and name HN  ))
   (( segid "AREF" and resid 75   and name HA  ))
      2.700     0.900     0.900 peak   860 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      8.068 ppm2      4.572 CV     1
 ASSI {  861}
   (( segid "AREF" and resid 75   and name HN  ))
   (( segid "AREF" and resid 74   and name HA  ))
      3.200     1.300     1.300 peak   861 spectrum    3 weight  0.10000E+01 volume  0.23926E-02 ppm1      8.068 ppm2      4.194 CV     1
 ASSI {  867}
   (( segid "AREF" and resid 60   and name HN  ))
   (( segid "AREF" and resid 60   and name HA  ))
      2.800     1.000     1.000 peak   867 spectrum    3 weight  0.10000E+01 volume  0.29385E-02 ppm1      8.010 ppm2      4.535 CV     1
 ASSI {  870}
   (( segid "AREF" and resid 25   and name HN  ))
   (( segid "AREF" and resid 25   and name HA  ))
      2.900     1.000     1.000 peak   870 spectrum    3 weight  0.10000E+01 volume  0.25088E-02 ppm1      7.944 ppm2      4.482 CV     1
 ASSI {  882}
   (( segid "AREF" and resid 89   and name HN  ))
   (( segid "AREF" and resid 90   and name HN  ))
      3.300     1.400     1.400 peak   882 spectrum    3 weight  0.10000E+01 volume  0.36006E-02 ppm1      8.059 ppm2      8.532 CV     1
 ASSI {  884}
   (( segid "AREF" and resid 89   and name HN  ))
   (( segid "AREF" and resid 135  and name HD2 ))
      2.400     0.700     0.700 peak   884 spectrum    3 weight  0.10000E+01 volume  0.65274E-02 ppm1      8.058 ppm2      6.871 CV     1
 ASSI {  885}
   (( segid "AREF" and resid 89   and name HN  ))
   (( segid "AREF" and resid 89   and name HA  ))
      2.600     0.900     0.900 peak   885 spectrum    3 weight  0.10000E+01 volume  0.30779E-02 ppm1      8.058 ppm2      4.571 CV     1
 ASSI {  886}
   (( segid "AREF" and resid 89   and name HN  ))
   (( segid "AREF" and resid 88   and name HA2 ))
      3.000     1.100     1.100 peak   886 spectrum    3 weight  0.10000E+01 volume  0.24623E-02 ppm1      8.058 ppm2      4.191 CV     1
 ASSI {  887}
   (( segid "AREF" and resid 89   and name HN  ))
   (( segid "AREF" and resid 88   and name HA1 ))
      2.800     1.000     1.000 peak   887 spectrum    3 weight  0.10000E+01 volume  0.26249E-02 ppm1      8.057 ppm2      3.822 CV     1
 ASSI {  889}
   (( segid "AREF" and resid 89   and name HN  ))
   (( segid "AREF" and resid 136  and name HN  ))
      2.700     0.900     0.900 peak   889 spectrum    3 weight  0.10000E+01 volume  0.35889E-02 ppm1      8.056 ppm2      9.220 CV     1
 ASSI {  892}
   (( segid "AREF" and resid 128  and name HN  ))
   (( segid "AREF" and resid 128  and name HA  ))
      2.800     1.000     1.000 peak   892 spectrum    3 weight  0.10000E+01 volume  0.28804E-02 ppm1      8.795 ppm2      4.072 CV     1
 ASSI {  893}
   (( segid "AREF" and resid 128  and name HN  ))
   (  segid "AREF" and resid 122  and name HD% )
      2.800     1.000     1.000 peak   893 spectrum    3 weight  0.10000E+01 volume  0.37283E-02 ppm1      8.793 ppm2      6.909 CV     1
 ASSI {  894}
   (( segid "AREF" and resid 128  and name HN  ))
   (( segid "AREF" and resid 127  and name HA  ))
      3.000     1.100     1.100 peak   894 spectrum    3 weight  0.10000E+01 volume  0.25785E-02 ppm1      8.795 ppm2      4.485 CV     1
 ASSI {  895}
   (( segid "AREF" and resid 128  and name HN  ))
   (( segid "AREF" and resid 128  and name HB2 ))
      3.100     1.200     1.200 peak   895 spectrum    3 weight  0.10000E+01 volume  0.32753E-02 ppm1      8.794 ppm2      3.841 CV     1
 OR {  895}
   (( segid "AREF" and resid 128  and name HN  ))
   (( segid "AREF" and resid 128  and name HB1 ))
 ASSI {  896}
   (( segid "AREF" and resid 128  and name HN  ))
   (( segid "AREF" and resid 127  and name HB1 ))
      2.700     0.900     0.900 peak   896 spectrum    3 weight  0.10000E+01 volume  0.40419E-02 ppm1      8.794 ppm2      1.805 CV     1
 OR {  896}
   (( segid "AREF" and resid 128  and name HN  ))
   (( segid "AREF" and resid 127  and name HB2 ))
 ASSI {  908}
   (( segid "AREF" and resid 128  and name HN  ))
   (( segid "AREF" and resid 127  and name HG1 ))
      2.900     1.000     1.000 peak   908 spectrum    3 weight  0.10000E+01 volume  0.41697E-02 ppm1      8.793 ppm2      1.582 CV     1
 ASSI {  913}
   (( segid "AREF" and resid 85   and name HN  ))
   (( segid "AREF" and resid 84   and name HA2 ))
      3.200     1.300     1.300 peak   913 spectrum    3 weight  0.10000E+01 volume  0.22533E-02 ppm1      7.842 ppm2      3.959 CV     1
 OR {  913}
   (( segid "AREF" and resid 85   and name HN  ))
   (( segid "AREF" and resid 84   and name HA1 ))
 ASSI {  918}
   (( segid "AREF" and resid 30   and name HN  ))
   (( segid "AREF" and resid 29   and name HN  ))
      2.400     0.700     0.700 peak   918 spectrum    3 weight  0.10000E+01 volume  0.31244E-02 ppm1      8.248 ppm2      7.972 CV     1
 ASSI {  921}
   (( segid "AREF" and resid 30   and name HN  ))
   (( segid "AREF" and resid 30   and name HB1 ))
      2.800     1.000     1.000 peak   921 spectrum    3 weight  0.10000E+01 volume  0.26133E-02 ppm1      8.251 ppm2      2.840 CV     1
 OR {  921}
   (( segid "AREF" and resid 30   and name HN  ))
   (( segid "AREF" and resid 30   and name HB2 ))
 ASSI {  922}
   (( segid "AREF" and resid 30   and name HN  ))
   (( segid "AREF" and resid 29   and name HB1 ))
      2.700     0.900     0.900 peak   922 spectrum    3 weight  0.10000E+01 volume  0.31940E-02 ppm1      8.250 ppm2      1.613 CV     1
 OR {  922}
   (( segid "AREF" and resid 30   and name HN  ))
   (( segid "AREF" and resid 29   and name HB2 ))
 ASSI {  927}
   (( segid "AREF" and resid 17   and name HN  ))
   (  segid "AREF" and resid 16   and name HB% )
      3.600     1.600     1.600 peak   927 spectrum    3 weight  0.10000E+01 volume  0.29153E-02 ppm1      8.141 ppm2      1.414 CV     1
 ASSI {  931}
   (( segid "AREF" and resid 24   and name HN  ))
   (( segid "AREF" and resid 22   and name HB2 ))
      3.500     1.600     1.600 peak   931 spectrum    3 weight  0.10000E+01 volume  0.32521E-02 ppm1      8.131 ppm2      4.043 CV     1
 ASSI {  932}
   (( segid "AREF" and resid 24   and name HN  ))
   (( segid "AREF" and resid 24   and name HB2 ))
      3.000     1.100     1.100 peak   932 spectrum    3 weight  0.10000E+01 volume  0.21371E-02 ppm1      8.133 ppm2      2.576 CV     1
 OR {  932}
   (( segid "AREF" and resid 24   and name HN  ))
   (( segid "AREF" and resid 24   and name HB1 ))
 ASSI {  933}
   (( segid "AREF" and resid 24   and name HN  ))
   (( segid "AREF" and resid 23   and name HB1 ))
      2.900     1.100     1.100 peak   933 spectrum    3 weight  0.10000E+01 volume  0.25204E-02 ppm1      8.131 ppm2      1.649 CV     1
 OR {  933}
   (( segid "AREF" and resid 24   and name HN  ))
   (( segid "AREF" and resid 23   and name HB2 ))
 ASSI {  937}
   (( segid "AREF" and resid 32   and name HN  ))
   (( segid "AREF" and resid 31   and name HB1 ))
      2.700     0.900     0.900 peak   937 spectrum    3 weight  0.10000E+01 volume  0.46226E-02 ppm1      8.291 ppm2      1.855 CV     1
 OR {  937}
   (( segid "AREF" and resid 32   and name HN  ))
   (( segid "AREF" and resid 31   and name HB2 ))
 ASSI {  939}
   (( segid "AREF" and resid 79   and name HN  ))
   (( segid "AREF" and resid 78   and name HA2 ))
      3.000     1.200     1.200 peak   939 spectrum    3 weight  0.10000E+01 volume  0.31360E-02 ppm1      8.165 ppm2      3.994 CV     1
 OR {  939}
   (( segid "AREF" and resid 79   and name HN  ))
   (( segid "AREF" and resid 78   and name HA1 ))
 ASSI {  940}
   (( segid "AREF" and resid 79   and name HN  ))
   (( segid "AREF" and resid 79   and name HB1 ))
      2.900     1.000     1.000 peak   940 spectrum    3 weight  0.10000E+01 volume  0.35076E-02 ppm1      8.165 ppm2      2.929 CV     1
 OR {  940}
   (( segid "AREF" and resid 79   and name HN  ))
   (( segid "AREF" and resid 79   and name HB2 ))
 ASSI {  946}
   (( segid "AREF" and resid 32   and name HN  ))
   (( segid "AREF" and resid 32   and name HB2 ))
      2.700     0.900     0.900 peak   946 spectrum    3 weight  0.10000E+01 volume  0.28340E-02 ppm1      8.291 ppm2      2.827 CV     1
 OR {  946}
   (( segid "AREF" and resid 32   and name HN  ))
   (( segid "AREF" and resid 32   and name HB1 ))
 ASSI {  955}
   (( segid "AREF" and resid 15   and name HN  ))
   (( segid "AREF" and resid 14   and name HA  ))
      3.100     1.200     1.200 peak   955 spectrum    3 weight  0.10000E+01 volume  0.25436E-02 ppm1      8.415 ppm2      4.412 CV     1
 ASSI {  958}
   (( segid "AREF" and resid 15   and name HN  ))
   (  segid "AREF" and resid 15   and name HE% )
      3.900     1.900     1.900 peak   958 spectrum    3 weight  0.10000E+01 volume  0.24391E-02 ppm1      8.415 ppm2      2.059 CV     1
 ASSI {  961}
   (( segid "AREF" and resid 61   and name HN  ))
   (( segid "AREF" and resid 60   and name HA  ))
      3.100     1.200     1.200 peak   961 spectrum    3 weight  0.10000E+01 volume  0.27062E-02 ppm1      7.966 ppm2      4.539 CV     1
 ASSI {  962}
   (( segid "AREF" and resid 61   and name HN  ))
   (( segid "AREF" and resid 60   and name HB1 ))
      2.700     0.900     0.900 peak   962 spectrum    3 weight  0.10000E+01 volume  0.43671E-02 ppm1      7.967 ppm2      3.016 CV     1
 OR {  962}
   (( segid "AREF" and resid 61   and name HN  ))
   (( segid "AREF" and resid 60   and name HB2 ))
 ASSI {  963}
   (( segid "AREF" and resid 61   and name HN  ))
   (( segid "AREF" and resid 61   and name HB1 ))
      2.900     1.100     1.100 peak   963 spectrum    3 weight  0.10000E+01 volume  0.33334E-02 ppm1      7.965 ppm2      3.751 CV     1
 OR {  963}
   (( segid "AREF" and resid 61   and name HN  ))
   (( segid "AREF" and resid 61   and name HB2 ))
 ASSI {  970}
   (( segid "AREF" and resid 22   and name HN  ))
   (( segid "AREF" and resid 22   and name HB1 ))
      3.200     1.300     1.300 peak   970 spectrum    3 weight  0.10000E+01 volume  0.31940E-02 ppm1      8.674 ppm2      3.930 CV     1
 ASSI {  971}
   (( segid "AREF" and resid 22   and name HN  ))
   (( segid "AREF" and resid 25   and name HB2 ))
      3.700     1.700     1.700 peak   971 spectrum    3 weight  0.10000E+01 volume  0.30779E-02 ppm1      8.676 ppm2      2.736 CV     1
 OR {  971}
   (( segid "AREF" and resid 22   and name HN  ))
   (( segid "AREF" and resid 25   and name HB1 ))
 ASSI {  972}
   (( segid "AREF" and resid 22   and name HN  ))
   (( segid "AREF" and resid 21   and name HB2 ))
      2.900     1.100     1.100 peak   972 spectrum    3 weight  0.10000E+01 volume  0.36702E-02 ppm1      8.675 ppm2      2.119 CV     1
 ASSI {  973}
   (( segid "AREF" and resid 22   and name HN  ))
   (( segid "AREF" and resid 21   and name HB1 ))
      2.200     2.200     3.800 peak   973 spectrum    3 weight  0.10000E+01 volume  0.58536E-02 ppm1      8.671 ppm2      1.991 CV     1
 ASSI {  975}
   (( segid "AREF" and resid 15   and name HN  ))
   (( segid "AREF" and resid 17   and name HB2 ))
      3.500     3.500     2.500 peak   975 spectrum    3 weight  0.10000E+01 volume  0.65741E-02 ppm1      8.416 ppm2      2.662 CV     1
 OR {  975}
   (( segid "AREF" and resid 15   and name HN  ))
   (( segid "AREF" and resid 17   and name HB1 ))
 ASSI {  978}
   (( segid "AREF" and resid 22   and name HN  ))
   (( segid "AREF" and resid 22   and name HB2 ))
      2.400     0.700     0.700 peak   978 spectrum    3 weight  0.10000E+01 volume  0.45646E-02 ppm1      8.676 ppm2      4.043 CV     1
 ASSI {  980}
   (( segid "AREF" and resid 124  and name HN  ))
   (( segid "AREF" and resid 124  and name HA  ))
      2.700     0.900     0.900 peak   980 spectrum    3 weight  0.10000E+01 volume  0.35076E-02 ppm1      8.438 ppm2      4.150 CV     1
 ASSI {  981}
   (( segid "AREF" and resid 124  and name HN  ))
   (( segid "AREF" and resid 123  and name HB1 ))
      2.800     1.000     1.000 peak   981 spectrum    3 weight  0.10000E+01 volume  0.34147E-02 ppm1      8.438 ppm2      2.672 CV     1
 ASSI {  982}
   (( segid "AREF" and resid 124  and name HN  ))
   (( segid "AREF" and resid 124  and name HB1 ))
      2.700     0.900     0.900 peak   982 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      8.438 ppm2      1.928 CV     1
 OR {  982}
   (( segid "AREF" and resid 124  and name HN  ))
   (( segid "AREF" and resid 124  and name HB2 ))
 ASSI {  983}
   (( segid "AREF" and resid 124  and name HN  ))
   (( segid "AREF" and resid 124  and name HG2 ))
      3.200     1.300     1.300 peak   983 spectrum    3 weight  0.10000E+01 volume  0.34379E-02 ppm1      8.437 ppm2      1.749 CV     1
 OR {  983}
   (( segid "AREF" and resid 124  and name HN  ))
   (( segid "AREF" and resid 124  and name HG1 ))
 ASSI {  984}
   (( segid "AREF" and resid 105  and name HN  ))
   (( segid "AREF" and resid 105  and name HA  ))
      2.500     0.800     0.800 peak   984 spectrum    3 weight  0.10000E+01 volume  0.33915E-02 ppm1      7.545 ppm2      3.878 CV     1
 ASSI {  987}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 101  and name HN  ))
      2.700     0.900     0.900 peak   987 spectrum    3 weight  0.10000E+01 volume  0.58657E-02 ppm1      7.522 ppm2      9.430 CV     1
 ASSI {  991}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 104  and name HA  ))
      2.800     1.000     1.000 peak   991 spectrum    3 weight  0.10000E+01 volume  0.27643E-02 ppm1      7.524 ppm2      4.313 CV     1
 ASSI {  994}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 104  and name HB2 ))
      2.400     0.700     0.700 peak   994 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      7.523 ppm2      2.532 CV     1
 OR {  994}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 104  and name HB1 ))
 ASSI {  995}
   (( segid "AREF" and resid 104  and name HN  ))
   (  segid "AREF" and resid 103  and name HB% )
      3.100     1.200     1.200 peak   995 spectrum    3 weight  0.10000E+01 volume  0.27643E-02 ppm1      7.523 ppm2      1.394 CV     1
 ASSI {  996}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 107  and name HN  ))
      3.000     3.000     3.000 peak   996 spectrum    3 weight  0.10000E+01 volume  0.31476E-02 ppm1      7.499 ppm2      7.884 CV     1
 ASSI {  997}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 101  and name HB1 ))
      3.300     1.400     1.400 peak   997 spectrum    3 weight  0.10000E+01 volume  0.65972E-02 ppm1      7.499 ppm2      4.026 CV     1
 ASSI {  999}
   (( segid "AREF" and resid 141  and name HN  ))
   (( segid "AREF" and resid 140  and name HN  ))
      2.600     0.900     0.900 peak   999 spectrum    3 weight  0.10000E+01 volume  0.31244E-02 ppm1      6.723 ppm2      9.083 CV     1
 ASSI { 1001}
   (( segid "AREF" and resid 141  and name HN  ))
   (( segid "AREF" and resid 141  and name HA  ))
      2.700     0.900     0.900 peak  1001 spectrum    3 weight  0.10000E+01 volume  0.30082E-02 ppm1      6.721 ppm2      4.317 CV     1
 ASSI { 1002}
   (( segid "AREF" and resid 141  and name HN  ))
   (( segid "AREF" and resid 141  and name HB1 ))
      3.500     1.500     1.500 peak  1002 spectrum    3 weight  0.10000E+01 volume  0.31011E-02 ppm1      6.721 ppm2      2.835 CV     1
 ASSI { 1003}
   (( segid "AREF" and resid 141  and name HN  ))
   (( segid "AREF" and resid 141  and name HB2 ))
      2.300     0.700     0.700 peak  1003 spectrum    3 weight  0.10000E+01 volume  0.36354E-02 ppm1      6.722 ppm2      2.610 CV     1
 ASSI { 1004}
   (( segid "AREF" and resid 141  and name HN  ))
   (( segid "AREF" and resid 138  and name HB1 ))
      2.600     0.900     0.900 peak  1004 spectrum    3 weight  0.10000E+01 volume  0.30430E-02 ppm1      6.724 ppm2      1.926 CV     1
 OR { 1004}
   (( segid "AREF" and resid 141  and name HN  ))
   (( segid "AREF" and resid 138  and name HB2 ))
 ASSI { 1008}
   (( segid "AREF" and resid 105  and name HN  ))
   (  segid "AREF" and resid 105  and name HD1%)
      3.700     1.700     1.700 peak  1008 spectrum    3 weight  0.10000E+01 volume  0.32521E-02 ppm1      7.548 ppm2      0.736 CV     1
 ASSI { 1009}
   (( segid "AREF" and resid 105  and name HN  ))
   (( segid "AREF" and resid 106  and name HN  ))
      2.500     0.800     0.800 peak  1009 spectrum    3 weight  0.10000E+01 volume  0.29850E-02 ppm1      7.542 ppm2      8.620 CV     1
 ASSI { 1010}
   (( segid "AREF" and resid 105  and name HN  ))
   (( segid "AREF" and resid 105  and name HB  ))
      2.500     0.800     0.800 peak  1010 spectrum    3 weight  0.10000E+01 volume  0.25668E-02 ppm1      7.541 ppm2      2.049 CV     1
 ASSI { 1014}
   (( segid "AREF" and resid 105  and name HN  ))
   (  segid "AREF" and resid 132  and name HB% )
      3.900     1.900     1.900 peak  1014 spectrum    3 weight  0.10000E+01 volume  0.31360E-02 ppm1      7.533 ppm2      0.874 CV     1
 ASSI { 1017}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 146  and name HN  ))
      2.200     0.600     0.600 peak  1017 spectrum    3 weight  0.10000E+01 volume  0.28804E-02 ppm1      7.770 ppm2      8.087 CV     1
 ASSI { 1020}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 146  and name HG1 ))
      2.300     0.700     0.700 peak  1020 spectrum    3 weight  0.10000E+01 volume  0.41116E-02 ppm1      7.773 ppm2      2.420 CV     1
 OR { 1020}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 146  and name HG2 ))
 ASSI { 1021}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 146  and name HB2 ))
      3.200     1.300     1.300 peak  1021 spectrum    3 weight  0.10000E+01 volume  0.30547E-02 ppm1      7.772 ppm2      2.202 CV     1
 ASSI { 1022}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 147  and name HB1 ))
      2.400     0.700     0.700 peak  1022 spectrum    3 weight  0.10000E+01 volume  0.21836E-02 ppm1      7.771 ppm2      1.848 CV     1
 OR { 1022}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 147  and name HB2 ))
 ASSI { 1027}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 147  and name HA  ))
      2.700     0.900     0.900 peak  1027 spectrum    3 weight  0.10000E+01 volume  0.25785E-02 ppm1      7.771 ppm2      3.946 CV     1
 ASSI { 1028}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 144  and name HG2 ))
      3.400     1.400     1.400 peak  1028 spectrum    3 weight  0.10000E+01 volume  0.31127E-02 ppm1      7.770 ppm2      1.494 CV     1
 ASSI { 1031}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 115  and name HA  ))
      3.300     1.300     1.300 peak  1031 spectrum    3 weight  0.10000E+01 volume  0.41813E-02 ppm1      7.401 ppm2      4.458 CV     1
 ASSI { 1037}
   (( segid "AREF" and resid 96   and name HN  ))
   (( segid "AREF" and resid 94   and name HA  ))
      3.500     1.500     1.500 peak  1037 spectrum    3 weight  0.10000E+01 volume  0.38445E-02 ppm1      8.155 ppm2      5.323 CV     1
 ASSI { 1038}
   (( segid "AREF" and resid 96   and name HN  ))
   (( segid "AREF" and resid 95   and name HA  ))
      3.000     1.100     1.100 peak  1038 spectrum    3 weight  0.10000E+01 volume  0.32870E-02 ppm1      8.156 ppm2      4.462 CV     1
 ASSI { 1039}
   (( segid "AREF" and resid 96   and name HN  ))
   (( segid "AREF" and resid 96   and name HB2 ))
      3.200     1.200     1.200 peak  1039 spectrum    3 weight  0.10000E+01 volume  0.24275E-02 ppm1      8.155 ppm2      1.223 CV     1
 OR { 1039}
   (( segid "AREF" and resid 96   and name HN  ))
   (( segid "AREF" and resid 96   and name HG  ))
 ASSI { 1040}
   (( segid "AREF" and resid 96   and name HN  ))
   (( segid "AREF" and resid 96   and name HB1 ))
      3.000     1.100     1.100 peak  1040 spectrum    3 weight  0.10000E+01 volume  0.35309E-02 ppm1      8.158 ppm2      1.062 CV     1
 ASSI { 1041}
   (( segid "AREF" and resid 96   and name HN  ))
   (  segid "AREF" and resid 96   and name HD2%)
      3.600     1.600     1.600 peak  1041 spectrum    3 weight  0.10000E+01 volume  0.34612E-02 ppm1      8.156 ppm2      0.731 CV     1
 ASSI { 1042}
   (( segid "AREF" and resid 96   and name HN  ))
   (  segid "AREF" and resid 96   and name HD1%)
      3.500     1.500     1.500 peak  1042 spectrum    3 weight  0.10000E+01 volume  0.35309E-02 ppm1      8.156 ppm2      0.459 CV     1
 ASSI { 1044}
   (( segid "AREF" and resid 77   and name HN  ))
   (( segid "AREF" and resid 78   and name HA1 ))
      3.700     1.700     1.700 peak  1044 spectrum    3 weight  0.10000E+01 volume  0.34728E-02 ppm1      8.274 ppm2      3.972 CV     1
 OR { 1044}
   (( segid "AREF" and resid 77   and name HN  ))
   (( segid "AREF" and resid 78   and name HA2 ))
 ASSI { 1045}
   (( segid "AREF" and resid 77   and name HN  ))
   (( segid "AREF" and resid 77   and name HB1 ))
      3.000     1.100     1.100 peak  1045 spectrum    3 weight  0.10000E+01 volume  0.36470E-02 ppm1      8.275 ppm2      3.883 CV     1
 ASSI { 1046}
   (( segid "AREF" and resid 77   and name HN  ))
   (( segid "AREF" and resid 76   and name HB1 ))
      2.500     0.800     0.800 peak  1046 spectrum    3 weight  0.10000E+01 volume  0.49244E-02 ppm1      8.274 ppm2      2.604 CV     1
 ASSI { 1047}
   (( segid "AREF" and resid 96   and name HN  ))
   (( segid "AREF" and resid 96   and name HA  ))
      2.700     0.900     0.900 peak  1047 spectrum    3 weight  0.10000E+01 volume  0.36935E-02 ppm1      8.156 ppm2      4.146 CV     1
 ASSI { 1055}
   (( segid "AREF" and resid 77   and name HN  ))
   (( segid "AREF" and resid 77   and name HA  ))
      2.800     1.000     1.000 peak  1055 spectrum    3 weight  0.10000E+01 volume  0.35076E-02 ppm1      8.276 ppm2      4.371 CV     1
 ASSI { 1064}
   (( segid "AREF" and resid 151  and name HN  ))
   (( segid "AREF" and resid 150  and name HA  ))
      2.200     0.600     0.600 peak  1064 spectrum    3 weight  0.10000E+01 volume  0.26365E-02 ppm1      9.171 ppm2      3.870 CV     1
 ASSI { 1065}
   (( segid "AREF" and resid 151  and name HN  ))
   (( segid "AREF" and resid 152  and name HN  ))
      2.300     0.600     0.600 peak  1065 spectrum    3 weight  0.10000E+01 volume  0.38445E-02 ppm1      9.167 ppm2      8.121 CV     1
 ASSI { 1066}
   (( segid "AREF" and resid 151  and name HN  ))
   (( segid "AREF" and resid 151  and name HA1 ))
      3.000     1.100     1.100 peak  1066 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      9.166 ppm2      3.656 CV     1
 ASSI { 1068}
   (( segid "AREF" and resid 151  and name HN  ))
   (( segid "AREF" and resid 151  and name HA2 ))
      2.500     0.800     0.800 peak  1068 spectrum    3 weight  0.10000E+01 volume  0.30547E-02 ppm1      9.172 ppm2      4.242 CV     1
 ASSI { 1078}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 146  and name HN  ))
      3.000     1.100     1.100 peak  1078 spectrum    3 weight  0.10000E+01 volume  0.36354E-02 ppm1      7.545 ppm2      8.105 CV     1
 ASSI { 1080}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 147  and name HN  ))
      2.200     0.600     0.600 peak  1080 spectrum    3 weight  0.10000E+01 volume  0.27759E-02 ppm1      7.546 ppm2      7.775 CV     1
 ASSI { 1083}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 148  and name HB2 ))
      2.400     0.700     0.700 peak  1083 spectrum    3 weight  0.10000E+01 volume  0.27759E-02 ppm1      7.547 ppm2      1.937 CV     1
 OR { 1083}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 148  and name HB1 ))
 ASSI { 1084}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 147  and name HB1 ))
      2.700     0.900     0.900 peak  1084 spectrum    3 weight  0.10000E+01 volume  0.21719E-02 ppm1      7.546 ppm2      1.848 CV     1
 OR { 1084}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 147  and name HB2 ))
 ASSI { 1085}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 144  and name HG2 ))
      3.100     1.200     1.200 peak  1085 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      7.546 ppm2      1.510 CV     1
 ASSI { 1090}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 146  and name HB2 ))
      3.300     1.400     1.400 peak  1090 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      8.095 ppm2      2.200 CV     1
 ASSI { 1091}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 148  and name HB2 ))
      3.800     1.800     1.800 peak  1091 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      8.096 ppm2      1.909 CV     1
 OR { 1091}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 148  and name HB1 ))
 ASSI { 1094}
   (( segid "AREF" and resid 146  and name HN  ))
   (  segid "AREF" and resid 91   and name HD2%)
      3.700     1.700     1.700 peak  1094 spectrum    3 weight  0.10000E+01 volume  0.29734E-02 ppm1      8.093 ppm2      0.792 CV     1
 ASSI { 1096}
   (( segid "AREF" and resid 95   and name HN  ))
   (  segid "AREF" and resid 131  and name HG2%)
      3.500     1.500     1.500 peak  1096 spectrum    3 weight  0.10000E+01 volume  0.58189E-02 ppm1      8.724 ppm2      1.062 CV     1
 ASSI { 1097}
   (( segid "AREF" and resid 95   and name HN  ))
   (( segid "AREF" and resid 94   and name HB2 ))
      3.000     1.100     1.100 peak  1097 spectrum    3 weight  0.10000E+01 volume  0.30314E-02 ppm1      8.717 ppm2      3.990 CV     1
 ASSI { 1099}
   (( segid "AREF" and resid 95   and name HN  ))
   (( segid "AREF" and resid 96   and name HN  ))
      2.600     0.800     0.800 peak  1099 spectrum    3 weight  0.10000E+01 volume  0.40535E-02 ppm1      8.715 ppm2      8.156 CV     1
 ASSI { 1100}
   (( segid "AREF" and resid 95   and name HN  ))
   (( segid "AREF" and resid 94   and name HA  ))
      2.400     0.700     0.700 peak  1100 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      8.715 ppm2      5.323 CV     1
 ASSI { 1102}
   (( segid "AREF" and resid 95   and name HN  ))
   (( segid "AREF" and resid 95   and name HA  ))
      2.800     1.000     1.000 peak  1102 spectrum    3 weight  0.10000E+01 volume  0.25552E-02 ppm1      8.716 ppm2      4.461 CV     1
 ASSI { 1104}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 146  and name HG2 ))
      2.400     0.700     0.700 peak  1104 spectrum    3 weight  0.10000E+01 volume  0.35773E-02 ppm1      8.092 ppm2      2.429 CV     1
 OR { 1104}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 146  and name HG1 ))
 ASSI { 1108}
   (( segid "AREF" and resid 143  and name HN  ))
   (( segid "AREF" and resid 143  and name HA  ))
      2.500     0.800     0.800 peak  1108 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      7.839 ppm2      3.795 CV     1
 ASSI { 1109}
   (( segid "AREF" and resid 143  and name HN  ))
   (( segid "AREF" and resid 143  and name HB2 ))
      2.700     0.900     0.900 peak  1109 spectrum    3 weight  0.10000E+01 volume  0.23346E-02 ppm1      7.839 ppm2      1.657 CV     1
 OR { 1109}
   (( segid "AREF" and resid 143  and name HN  ))
   (( segid "AREF" and resid 143  and name HG  ))
 ASSI { 1110}
   (( segid "AREF" and resid 143  and name HN  ))
   (( segid "AREF" and resid 143  and name HB1 ))
      2.300     0.700     0.700 peak  1110 spectrum    3 weight  0.10000E+01 volume  0.28340E-02 ppm1      7.839 ppm2      1.436 CV     1
 ASSI { 1115}
   (( segid "AREF" and resid 143  and name HN  ))
   (( segid "AREF" and resid 140  and name HA  ))
      2.500     0.800     0.800 peak  1115 spectrum    3 weight  0.10000E+01 volume  0.52035E-02 ppm1      7.839 ppm2      3.920 CV     1
 ASSI { 1120}
   (( segid "AREF" and resid 166  and name HN  ))
   (( segid "AREF" and resid 166  and name HB2 ))
      3.000     1.200     1.200 peak  1120 spectrum    3 weight  0.10000E+01 volume  0.30430E-02 ppm1      8.322 ppm2      3.834 CV     1
 OR { 1120}
   (( segid "AREF" and resid 166  and name HN  ))
   (( segid "AREF" and resid 166  and name HB1 ))
 ASSI { 1121}
   (( segid "AREF" and resid 166  and name HN  ))
   (  segid "AREF" and resid 165  and name HB% )
      3.400     1.500     1.500 peak  1121 spectrum    3 weight  0.10000E+01 volume  0.28572E-02 ppm1      8.323 ppm2      1.386 CV     1
 ASSI { 1128}
   (( segid "AREF" and resid 125  and name HN  ))
   (( segid "AREF" and resid 126  and name HN  ))
      2.500     0.800     0.800 peak  1128 spectrum    3 weight  0.10000E+01 volume  0.25204E-02 ppm1      8.394 ppm2      8.219 CV     1
 ASSI { 1131}
   (( segid "AREF" and resid 125  and name HN  ))
   (( segid "AREF" and resid 124  and name HB2 ))
      2.700     0.900     0.900 peak  1131 spectrum    3 weight  0.10000E+01 volume  0.33915E-02 ppm1      8.394 ppm2      1.928 CV     1
 OR { 1131}
   (( segid "AREF" and resid 125  and name HN  ))
   (( segid "AREF" and resid 124  and name HB1 ))
 ASSI { 1132}
   (( segid "AREF" and resid 125  and name HN  ))
   (( segid "AREF" and resid 125  and name HA  ))
      2.900     1.000     1.000 peak  1132 spectrum    3 weight  0.10000E+01 volume  0.28921E-02 ppm1      8.392 ppm2      4.581 CV     1
 ASSI { 1138}
   (( segid "AREF" and resid 112  and name HN  ))
   (( segid "AREF" and resid 112  and name HA  ))
      2.700     0.900     0.900 peak  1138 spectrum    3 weight  0.10000E+01 volume  0.29734E-02 ppm1      7.724 ppm2      4.317 CV     1
 ASSI { 1139}
   (( segid "AREF" and resid 112  and name HN  ))
   (( segid "AREF" and resid 112  and name HB1 ))
      3.200     1.300     1.300 peak  1139 spectrum    3 weight  0.10000E+01 volume  0.30663E-02 ppm1      7.724 ppm2      3.150 CV     1
 ASSI { 1140}
   (( segid "AREF" and resid 112  and name HN  ))
   (( segid "AREF" and resid 111  and name HB2 ))
      2.900     1.000     1.000 peak  1140 spectrum    3 weight  0.10000E+01 volume  0.39025E-02 ppm1      7.725 ppm2      1.789 CV     1
 ASSI { 1141}
   (( segid "AREF" and resid 112  and name HN  ))
   (( segid "AREF" and resid 111  and name HA  ))
      2.800     1.000     1.000 peak  1141 spectrum    3 weight  0.10000E+01 volume  0.43787E-02 ppm1      7.720 ppm2      3.977 CV     1
 ASSI { 1142}
   (( segid "AREF" and resid 87   and name HN  ))
   (( segid "AREF" and resid 86   and name HA  ))
      3.300     1.400     1.400 peak  1142 spectrum    3 weight  0.10000E+01 volume  0.22881E-02 ppm1      8.223 ppm2      4.451 CV     1
 ASSI { 1143}
   (( segid "AREF" and resid 87   and name HN  ))
   (( segid "AREF" and resid 86   and name HB1 ))
      2.700     0.900     0.900 peak  1143 spectrum    3 weight  0.10000E+01 volume  0.46343E-02 ppm1      8.224 ppm2      2.054 CV     1
 ASSI { 1144}
   (( segid "AREF" and resid 87   and name HN  ))
   (  segid "AREF" and resid 87   and name HG2%)
      3.000     1.100     1.100 peak  1144 spectrum    3 weight  0.10000E+01 volume  0.30663E-02 ppm1      8.225 ppm2      1.238 CV     1
 ASSI { 1147}
   (( segid "AREF" and resid 112  and name HN  ))
   (( segid "AREF" and resid 111  and name HN  ))
      2.500     0.800     0.800 peak  1147 spectrum    3 weight  0.10000E+01 volume  0.27411E-02 ppm1      7.722 ppm2      7.298 CV     1
 ASSI { 1148}
   (( segid "AREF" and resid 112  and name HN  ))
   (( segid "AREF" and resid 111  and name HB1 ))
      2.400     0.700     0.700 peak  1148 spectrum    3 weight  0.10000E+01 volume  0.31708E-02 ppm1      7.726 ppm2      1.605 CV     1
 ASSI { 1149}
   (( segid "AREF" and resid 112  and name HN  ))
   (( segid "AREF" and resid 112  and name HB2 ))
      2.300     0.700     0.700 peak  1149 spectrum    3 weight  0.10000E+01 volume  0.31940E-02 ppm1      7.720 ppm2      3.383 CV     1
 ASSI { 1172}
   (( segid "AREF" and resid 111  and name HN  ))
   (( segid "AREF" and resid 111  and name HA  ))
      2.700     0.900     0.900 peak  1172 spectrum    3 weight  0.10000E+01 volume  0.29037E-02 ppm1      7.299 ppm2      3.984 CV     1
 ASSI { 1178}
   (( segid "AREF" and resid 109  and name HN  ))
   (  segid "AREF" and resid 112  and name HD% )
      3.400     3.400     2.600 peak  1178 spectrum    3 weight  0.10000E+01 volume  0.35076E-02 ppm1      7.918 ppm2      7.526 CV     1
 ASSI { 1180}
   (( segid "AREF" and resid 109  and name HN  ))
   (( segid "AREF" and resid 108  and name HB1 ))
      2.000     0.500     0.500 peak  1180 spectrum    3 weight  0.10000E+01 volume  0.43555E-02 ppm1      7.920 ppm2      1.527 CV     1
 ASSI { 1181}
   (( segid "AREF" and resid 109  and name HN  ))
   (  segid "AREF" and resid 108  and name HD2%)
      3.500     1.500     1.500 peak  1181 spectrum    3 weight  0.10000E+01 volume  0.41348E-02 ppm1      7.919 ppm2      0.867 CV     1
 ASSI { 1183}
   (( segid "AREF" and resid 109  and name HN  ))
   (( segid "AREF" and resid 108  and name HA  ))
      2.700     0.900     0.900 peak  1183 spectrum    3 weight  0.10000E+01 volume  0.65505E-02 ppm1      7.915 ppm2      4.027 CV     1
 ASSI { 1186}
   (( segid "AREF" and resid 109  and name HN  ))
   (  segid "AREF" and resid 109  and name HD% )
      2.900     1.100     1.100 peak  1186 spectrum    3 weight  0.10000E+01 volume  0.43787E-02 ppm1      7.917 ppm2      7.638 CV     1
 ASSI { 1187}
   (( segid "AREF" and resid 109  and name HN  ))
   (( segid "AREF" and resid 109  and name HB2 ))
      2.100     0.600     0.600 peak  1187 spectrum    3 weight  0.10000E+01 volume  0.46807E-02 ppm1      7.922 ppm2      3.408 CV     1
 OR { 1187}
   (( segid "AREF" and resid 109  and name HN  ))
   (( segid "AREF" and resid 109  and name HB1 ))
 ASSI { 1188}
   (( segid "AREF" and resid 109  and name HN  ))
   (( segid "AREF" and resid 110  and name HN  ))
      2.400     0.700     0.700 peak  1188 spectrum    3 weight  0.10000E+01 volume  0.34379E-02 ppm1      7.916 ppm2      8.494 CV     1
 ASSI { 1206}
   (( segid "AREF" and resid 114  and name HN  ))
   (( segid "AREF" and resid 113  and name HA1 ))
      3.000     1.100     1.100 peak  1206 spectrum    3 weight  0.10000E+01 volume  0.25901E-02 ppm1      8.175 ppm2      4.790 CV     1
 ASSI { 1208}
   (( segid "AREF" and resid 114  and name HN  ))
   (( segid "AREF" and resid 114  and name HA  ))
      2.900     1.000     1.000 peak  1208 spectrum    3 weight  0.10000E+01 volume  0.24623E-02 ppm1      8.176 ppm2      4.080 CV     1
 OR { 1208}
   (( segid "AREF" and resid 114  and name HN  ))
   (( segid "AREF" and resid 114  and name HB  ))
 ASSI { 1209}
   (( segid "AREF" and resid 114  and name HN  ))
   (( segid "AREF" and resid 113  and name HA2 ))
      2.800     1.000     1.000 peak  1209 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      8.175 ppm2      3.882 CV     1
 ASSI { 1210}
   (( segid "AREF" and resid 114  and name HN  ))
   (  segid "AREF" and resid 114  and name HG2%)
      3.000     1.200     1.200 peak  1210 spectrum    3 weight  0.10000E+01 volume  0.30547E-02 ppm1      8.174 ppm2      1.195 CV     1
 ASSI { 1211}
   (( segid "AREF" and resid 114  and name HN  ))
   (( segid "AREF" and resid 115  and name HN  ))
      3.600     1.600     1.600 peak  1211 spectrum    3 weight  0.10000E+01 volume  0.51688E-02 ppm1      8.172 ppm2      8.804 CV     1
 ASSI { 1213}
   (( segid "AREF" and resid 37   and name HD21))
   (( segid "AREF" and resid 37   and name HB1 ))
      2.800     1.000     1.000 peak  1213 spectrum    3 weight  0.10000E+01 volume  0.29385E-02 ppm1      7.585 ppm2      2.760 CV     1
 ASSI { 1219}
   (( segid "AREF" and resid 37   and name HD22))
   (( segid "AREF" and resid 37   and name HB2 ))
      3.500     1.500     1.500 peak  1219 spectrum    3 weight  0.10000E+01 volume  0.49129E-02 ppm1      6.896 ppm2      2.842 CV     1
 ASSI { 1222}
   (( segid "AREF" and resid 37   and name HD21))
   (( segid "AREF" and resid 37   and name HB2 ))
      3.000     1.100     1.100 peak  1222 spectrum    3 weight  0.10000E+01 volume  0.25204E-02 ppm1      7.589 ppm2      2.831 CV     1
 ASSI { 1225}
   (( segid "AREF" and resid 37   and name HD21))
   (( segid "AREF" and resid 37   and name HD22))
      2.500     0.800     0.800 peak  1225 spectrum    3 weight  0.10000E+01 volume  0.14170E-02 ppm1      7.586 ppm2      6.901 CV     1
 ASSI { 1228}
   (( segid "AREF" and resid 95   and name HD21))
   (( segid "AREF" and resid 95   and name HD22))
      2.300     0.700     0.700 peak  1228 spectrum    3 weight  0.10000E+01 volume  0.25785E-02 ppm1      8.282 ppm2      7.248 CV     1
 ASSI { 1229}
   (( segid "AREF" and resid 95   and name HD21))
   (( segid "AREF" and resid 95   and name HB2 ))
      2.600     0.900     0.900 peak  1229 spectrum    3 weight  0.10000E+01 volume  0.43323E-02 ppm1      8.282 ppm2      3.790 CV     1
 ASSI { 1234}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 149  and name HB1 ))
      2.300     0.700     0.700 peak  1234 spectrum    3 weight  0.10000E+01 volume  0.36122E-02 ppm1      7.579 ppm2      3.474 CV     1
 OR { 1234}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 149  and name HB2 ))
 ASSI { 1238}
   (( segid "AREF" and resid 95   and name HD22))
   (( segid "AREF" and resid 95   and name HB2 ))
      3.400     1.400     1.400 peak  1238 spectrum    3 weight  0.10000E+01 volume  0.52266E-02 ppm1      7.254 ppm2      3.784 CV     1
 ASSI { 1244}
   (( segid "AREF" and resid 162  and name HE21))
   (( segid "AREF" and resid 162  and name HE22))
      2.400     0.700     0.700 peak  1244 spectrum    3 weight  0.10000E+01 volume  0.17538E-02 ppm1      7.664 ppm2      6.734 CV     1
 ASSI { 1246}
   (( segid "AREF" and resid 162  and name HE21))
   (( segid "AREF" and resid 162  and name HG2 ))
      2.800     1.000     1.000 peak  1246 spectrum    3 weight  0.10000E+01 volume  0.28804E-02 ppm1      7.664 ppm2      2.277 CV     1
 OR { 1246}
   (( segid "AREF" and resid 162  and name HE21))
   (( segid "AREF" and resid 162  and name HG1 ))
 ASSI { 1247}
   (( segid "AREF" and resid 162  and name HE21))
   (  segid "AREF" and resid 92   and name HD1%)
      2.900     1.000     1.000 peak  1247 spectrum    3 weight  0.10000E+01 volume  0.37748E-02 ppm1      7.664 ppm2      0.808 CV     1
 ASSI { 1249}
   (( segid "AREF" and resid 30   and name HD21))
   (( segid "AREF" and resid 27   and name HA  ))
      2.800     2.800     3.200 peak  1249 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      7.583 ppm2      3.947 CV     1
 ASSI { 1250}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 149  and name HA  ))
      2.600     0.800     0.800 peak  1250 spectrum    3 weight  0.10000E+01 volume  0.30547E-02 ppm1      7.579 ppm2      4.897 CV     1
 ASSI { 1263}
   (( segid "AREF" and resid 162  and name HE22))
   (( segid "AREF" and resid 162  and name HG2 ))
      3.500     1.600     1.600 peak  1263 spectrum    3 weight  0.10000E+01 volume  0.31592E-02 ppm1      6.733 ppm2      2.275 CV     1
 OR { 1263}
   (( segid "AREF" and resid 162  and name HE22))
   (( segid "AREF" and resid 162  and name HG1 ))
 ASSI { 1264}
   (( segid "AREF" and resid 162  and name HE22))
   (  segid "AREF" and resid 92   and name HD1%)
      3.100     1.200     1.200 peak  1264 spectrum    3 weight  0.10000E+01 volume  0.37632E-02 ppm1      6.734 ppm2      0.808 CV     1
 ASSI { 1266}
   (( segid "AREF" and resid 167  and name HE21))
   (( segid "AREF" and resid 167  and name HE22))
      2.500     0.800     0.800 peak  1266 spectrum    3 weight  0.10000E+01 volume  0.16144E-02 ppm1      7.559 ppm2      6.815 CV     1
 ASSI { 1267}
   (( segid "AREF" and resid 167  and name HE21))
   (( segid "AREF" and resid 167  and name HG1 ))
      2.700     0.900     0.900 peak  1267 spectrum    3 weight  0.10000E+01 volume  0.29850E-02 ppm1      7.559 ppm2      2.333 CV     1
 OR { 1267}
   (( segid "AREF" and resid 167  and name HE21))
   (( segid "AREF" and resid 167  and name HG2 ))
 ASSI { 1292}
   (( segid "AREF" and resid 33   and name HE21))
   (( segid "AREF" and resid 33   and name HG1 ))
      2.700     0.900     0.900 peak  1292 spectrum    3 weight  0.10000E+01 volume  0.31940E-02 ppm1      7.470 ppm2      2.379 CV     1
 OR { 1292}
   (( segid "AREF" and resid 33   and name HE21))
   (( segid "AREF" and resid 33   and name HG2 ))
 ASSI { 1294}
   (( segid "AREF" and resid 71   and name HE21))
   (( segid "AREF" and resid 71   and name HE22))
      2.500     0.800     0.800 peak  1294 spectrum    3 weight  0.10000E+01 volume  0.16841E-02 ppm1      7.424 ppm2      6.761 CV     1
 ASSI { 1296}
   (( segid "AREF" and resid 71   and name HE21))
   (( segid "AREF" and resid 71   and name HG1 ))
      2.800     0.900     0.900 peak  1296 spectrum    3 weight  0.10000E+01 volume  0.30314E-02 ppm1      7.424 ppm2      2.089 CV     1
 OR { 1296}
   (( segid "AREF" and resid 71   and name HE21))
   (( segid "AREF" and resid 71   and name HG2 ))
 ASSI { 1303}
   (( segid "AREF" and resid 71   and name HE22))
   (( segid "AREF" and resid 71   and name HG1 ))
      3.600     1.600     1.600 peak  1303 spectrum    3 weight  0.10000E+01 volume  0.32753E-02 ppm1      6.760 ppm2      2.089 CV     1
 OR { 1303}
   (( segid "AREF" and resid 71   and name HE22))
   (( segid "AREF" and resid 71   and name HG2 ))
 ASSI { 1314}
   (( segid "AREF" and resid 33   and name HE21))
   (  segid "AREF" and resid 29   and name HD1%)
      2.000     2.000     4.000 peak  1314 spectrum    3 weight  0.10000E+01 volume  0.65972E-02 ppm1      7.469 ppm2      0.876 CV     1
 OR { 1314}
   (( segid "AREF" and resid 33   and name HE21))
   (  segid "AREF" and resid 29   and name HD2%)
 ASSI { 1319}
   (( segid "AREF" and resid 148  and name HE21))
   (( segid "AREF" and resid 148  and name HE22))
      2.100     0.600     0.600 peak  1319 spectrum    3 weight  0.10000E+01 volume  0.18003E-02 ppm1      7.028 ppm2      6.867 CV     1
 ASSI { 1321}
   (( segid "AREF" and resid 148  and name HE21))
   (( segid "AREF" and resid 148  and name HB2 ))
      2.200     0.600     0.600 peak  1321 spectrum    3 weight  0.10000E+01 volume  0.58657E-02 ppm1      7.028 ppm2      1.953 CV     1
 OR { 1321}
   (( segid "AREF" and resid 148  and name HE21))
   (( segid "AREF" and resid 148  and name HB1 ))
 ASSI { 1322}
   (( segid "AREF" and resid 148  and name HE21))
   (( segid "AREF" and resid 147  and name HB2 ))
      2.500     0.800     0.800 peak  1322 spectrum    3 weight  0.10000E+01 volume  0.31592E-02 ppm1      7.028 ppm2      1.845 CV     1
 OR { 1322}
   (( segid "AREF" and resid 148  and name HE21))
   (( segid "AREF" and resid 147  and name HB1 ))
 ASSI { 1323}
   (( segid "AREF" and resid 148  and name HE22))
   (( segid "AREF" and resid 148  and name HB2 ))
      3.500     1.500     1.500 peak  1323 spectrum    3 weight  0.10000E+01 volume  0.38445E-02 ppm1      6.868 ppm2      1.955 CV     1
 OR { 1323}
   (( segid "AREF" and resid 148  and name HE22))
   (( segid "AREF" and resid 148  and name HB1 ))
 ASSI { 1328}
   (( segid "AREF" and resid 148  and name HE22))
   (( segid "AREF" and resid 147  and name HB1 ))
      2.500     0.800     0.800 peak  1328 spectrum    3 weight  0.10000E+01 volume  0.31360E-02 ppm1      6.866 ppm2      1.847 CV     1
 ASSI { 1344}
   (( segid "AREF" and resid 80   and name HN  ))
   (( segid "AREF" and resid 79   and name HA  ))
      2.600     0.800     0.800 peak  1344 spectrum    3 weight  0.10000E+01 volume  0.42742E-02 ppm1      8.519 ppm2      4.569 CV     1
 ASSI { 1349}
   (( segid "AREF" and resid 80   and name HN  ))
   (( segid "AREF" and resid 80   and name HA2 ))
      2.900     1.100     1.100 peak  1349 spectrum    3 weight  0.10000E+01 volume  0.29850E-02 ppm1      8.520 ppm2      3.971 CV     1
 OR { 1349}
   (( segid "AREF" and resid 80   and name HN  ))
   (( segid "AREF" and resid 80   and name HA1 ))
 ASSI { 1358}
   (( segid "AREF" and resid 78   and name HN  ))
   (( segid "AREF" and resid 77   and name HA  ))
      2.700     0.900     0.900 peak  1358 spectrum    3 weight  0.10000E+01 volume  0.33799E-02 ppm1      8.497 ppm2      4.362 CV     1
 ASSI { 1361}
   (( segid "AREF" and resid 78   and name HN  ))
   (( segid "AREF" and resid 78   and name HA2 ))
      3.000     1.100     1.100 peak  1361 spectrum    3 weight  0.10000E+01 volume  0.24739E-02 ppm1      8.495 ppm2      3.994 CV     1
 OR { 1361}
   (( segid "AREF" and resid 78   and name HN  ))
   (( segid "AREF" and resid 78   and name HA1 ))
 ASSI { 1367}
   (( segid "AREF" and resid 11   and name HN  ))
   (( segid "AREF" and resid 10   and name HA  ))
      2.900     1.000     1.000 peak  1367 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      8.412 ppm2      4.483 CV     1
 ASSI { 1372}
   (( segid "AREF" and resid 84   and name HN  ))
   (( segid "AREF" and resid 85   and name HN  ))
      2.700     0.900     0.900 peak  1372 spectrum    3 weight  0.10000E+01 volume  0.33218E-02 ppm1      8.458 ppm2      7.848 CV     1
 ASSI { 1375}
   (( segid "AREF" and resid 84   and name HN  ))
   (( segid "AREF" and resid 84   and name HA1 ))
      3.000     1.100     1.100 peak  1375 spectrum    3 weight  0.10000E+01 volume  0.23810E-02 ppm1      8.459 ppm2      3.959 CV     1
 OR { 1375}
   (( segid "AREF" and resid 84   and name HN  ))
   (( segid "AREF" and resid 84   and name HA2 ))
 ASSI { 1376}
   (( segid "AREF" and resid 84   and name HN  ))
   (( segid "AREF" and resid 83   and name HB2 ))
      3.100     1.200     1.200 peak  1376 spectrum    3 weight  0.10000E+01 volume  0.40884E-02 ppm1      8.457 ppm2      2.075 CV     1
 ASSI { 1391}
   (( segid "AREF" and resid 126  and name HN  ))
   (( segid "AREF" and resid 126  and name HA2 ))
      2.800     1.000     1.000 peak  1391 spectrum    3 weight  0.10000E+01 volume  0.26365E-02 ppm1      8.211 ppm2      4.171 CV     1
 ASSI { 1392}
   (( segid "AREF" and resid 126  and name HN  ))
   (( segid "AREF" and resid 126  and name HA1 ))
      2.800     0.900     0.900 peak  1392 spectrum    3 weight  0.10000E+01 volume  0.26946E-02 ppm1      8.212 ppm2      3.553 CV     1
 ASSI { 1393}
   (( segid "AREF" and resid 126  and name HN  ))
   (( segid "AREF" and resid 125  and name HA  ))
      2.800     1.000     1.000 peak  1393 spectrum    3 weight  0.10000E+01 volume  0.43439E-02 ppm1      8.209 ppm2      4.587 CV     1
 ASSI { 1397}
   (( segid "AREF" and resid 130  and name HN  ))
   (( segid "AREF" and resid 131  and name HN  ))
      2.500     0.800     0.800 peak  1397 spectrum    3 weight  0.10000E+01 volume  0.42510E-02 ppm1      9.582 ppm2      7.036 CV     1
 ASSI { 1400}
   (( segid "AREF" and resid 130  and name HN  ))
   (( segid "AREF" and resid 130  and name HA2 ))
      2.600     0.800     0.800 peak  1400 spectrum    3 weight  0.10000E+01 volume  0.30082E-02 ppm1      9.574 ppm2      4.099 CV     1
 ASSI { 1401}
   (( segid "AREF" and resid 130  and name HN  ))
   (( segid "AREF" and resid 130  and name HA1 ))
      3.100     1.200     1.200 peak  1401 spectrum    3 weight  0.10000E+01 volume  0.33566E-02 ppm1      9.571 ppm2      3.454 CV     1
 ASSI { 1407}
   (( segid "AREF" and resid 41   and name HN  ))
   (( segid "AREF" and resid 41   and name HA2 ))
      2.900     1.100     1.100 peak  1407 spectrum    3 weight  0.10000E+01 volume  0.25552E-02 ppm1      8.181 ppm2      4.107 CV     1
 OR { 1407}
   (( segid "AREF" and resid 41   and name HN  ))
   (( segid "AREF" and resid 41   and name HA1 ))
 ASSI { 1411}
   (( segid "AREF" and resid 41   and name HN  ))
   (( segid "AREF" and resid 40   and name HA2 ))
      2.900     1.000     1.000 peak  1411 spectrum    3 weight  0.10000E+01 volume  0.29966E-02 ppm1      8.180 ppm2      3.994 CV     1
 OR { 1411}
   (( segid "AREF" and resid 41   and name HN  ))
   (( segid "AREF" and resid 40   and name HA1 ))
 ASSI { 1412}
   (( segid "AREF" and resid 41   and name HN  ))
   (( segid "AREF" and resid 42   and name HD1 ))
      2.300     0.700     0.700 peak  1412 spectrum    3 weight  0.10000E+01 volume  0.58189E-02 ppm1      8.177 ppm2      3.608 CV     1
 ASSI { 1426}
   (( segid "AREF" and resid 99   and name HN  ))
   (( segid "AREF" and resid 98   and name HN  ))
      2.500     0.800     0.800 peak  1426 spectrum    3 weight  0.10000E+01 volume  0.44600E-02 ppm1      8.913 ppm2      8.164 CV     1
 ASSI { 1429}
   (( segid "AREF" and resid 99   and name HN  ))
   (( segid "AREF" and resid 99   and name HA2 ))
      2.900     1.000     1.000 peak  1429 spectrum    3 weight  0.10000E+01 volume  0.26249E-02 ppm1      8.909 ppm2      4.218 CV     1
 ASSI { 1430}
   (( segid "AREF" and resid 99   and name HN  ))
   (( segid "AREF" and resid 99   and name HA1 ))
      3.000     1.200     1.200 peak  1430 spectrum    3 weight  0.10000E+01 volume  0.26598E-02 ppm1      8.909 ppm2      3.676 CV     1
 ASSI { 1434}
   (( segid "AREF" and resid 131  and name HN  ))
   (( segid "AREF" and resid 95   and name HN  ))
      3.000     3.000     3.000 peak  1434 spectrum    3 weight  0.10000E+01 volume  0.65741E-02 ppm1      7.038 ppm2      8.724 CV     1
 ASSI { 1436}
   (( segid "AREF" and resid 131  and name HN  ))
   (( segid "AREF" and resid 131  and name HA  ))
      2.500     0.800     0.800 peak  1436 spectrum    3 weight  0.10000E+01 volume  0.33683E-02 ppm1      7.034 ppm2      5.330 CV     1
 ASSI { 1438}
   (( segid "AREF" and resid 131  and name HN  ))
   (( segid "AREF" and resid 130  and name HA2 ))
      2.700     0.900     0.900 peak  1438 spectrum    3 weight  0.10000E+01 volume  0.38909E-02 ppm1      7.035 ppm2      4.104 CV     1
 ASSI { 1439}
   (( segid "AREF" and resid 131  and name HN  ))
   (  segid "AREF" and resid 131  and name HG2%)
      3.300     1.400     1.400 peak  1439 spectrum    3 weight  0.10000E+01 volume  0.30895E-02 ppm1      7.036 ppm2      1.052 CV     1
 ASSI { 1440}
   (( segid "AREF" and resid 131  and name HN  ))
   (  segid "AREF" and resid 120  and name HG2%)
      3.200     3.200     2.800 peak  1440 spectrum    3 weight  0.10000E+01 volume  0.36935E-02 ppm1      7.029 ppm2      0.456 CV     1
 ASSI { 1442}
   (( segid "AREF" and resid 113  and name HN  ))
   (( segid "AREF" and resid 112  and name HA  ))
      2.800     1.000     1.000 peak  1442 spectrum    3 weight  0.10000E+01 volume  0.34844E-02 ppm1      7.500 ppm2      4.316 CV     1
 ASSI { 1443}
   (( segid "AREF" and resid 113  and name HN  ))
   (( segid "AREF" and resid 115  and name HB2 ))
      3.300     3.300     2.700 peak  1443 spectrum    3 weight  0.10000E+01 volume  0.36122E-02 ppm1      7.499 ppm2      1.578 CV     1
 OR { 1443}
   (( segid "AREF" and resid 113  and name HN  ))
   (( segid "AREF" and resid 115  and name HB1 ))
 ASSI { 1445}
   (( segid "AREF" and resid 113  and name HN  ))
   (( segid "AREF" and resid 112  and name HN  ))
      2.600     0.900     0.900 peak  1445 spectrum    3 weight  0.10000E+01 volume  0.27062E-02 ppm1      7.499 ppm2      7.727 CV     1
 ASSI { 1447}
   (( segid "AREF" and resid 113  and name HN  ))
   (( segid "AREF" and resid 113  and name HA1 ))
      3.200     1.300     1.300 peak  1447 spectrum    3 weight  0.10000E+01 volume  0.28572E-02 ppm1      7.498 ppm2      4.790 CV     1
 ASSI { 1449}
   (( segid "AREF" and resid 113  and name HN  ))
   (( segid "AREF" and resid 110  and name HA  ))
      2.700     0.900     0.900 peak  1449 spectrum    3 weight  0.10000E+01 volume  0.39025E-02 ppm1      7.498 ppm2      4.449 CV     1
 ASSI { 1450}
   (( segid "AREF" and resid 113  and name HN  ))
   (( segid "AREF" and resid 113  and name HA2 ))
      2.800     1.000     1.000 peak  1450 spectrum    3 weight  0.10000E+01 volume  0.26946E-02 ppm1      7.500 ppm2      3.882 CV     1
 ASSI { 1458}
   (( segid "AREF" and resid 156  and name HN  ))
   (( segid "AREF" and resid 157  and name HN  ))
      2.900     1.000     1.000 peak  1458 spectrum    3 weight  0.10000E+01 volume  0.41348E-02 ppm1      8.358 ppm2      7.532 CV     1




! Ambiguous NOE restraints:

 ASSI {    7}
   (  segid "AREF" and resid 109  and name HD% )
   (( segid "AREF" and resid 141  and name HB1 ))
      2.900     2.900     3.100 peak     7 spectrum    1 weight  0.10000E+01 volume  0.49514E-02 ppm1      7.671 ppm2      2.827 CV     1
 OR {    7}
   (  segid "AREF" and resid 109  and name HD% )
   (( segid "AREF" and resid 142  and name HA  ))
 ASSI {   57}
   (  segid "AREF" and resid 136  and name HD% )
   (( segid "AREF" and resid 141  and name HB1 ))
      2.600     0.800     0.800 peak    57 spectrum    1 weight  0.10000E+01 volume  0.40009E-02 ppm1      7.230 ppm2      2.825 CV     1
 OR {   57}
   (  segid "AREF" and resid 136  and name HD% )
   (( segid "AREF" and resid 142  and name HA  ))
 ASSI {  134}
   (  segid "AREF" and resid 149  and name HD% )
   (( segid "AREF" and resid 150  and name HG1 ))
      3.700     3.700     2.300 peak   134 spectrum    1 weight  0.10000E+01 volume  0.41082E-02 ppm1      6.811 ppm2      1.836 CV     1
 OR {  134}
   (  segid "AREF" and resid 149  and name HD% )
   (( segid "AREF" and resid 150  and name HG2 ))
 OR {  134}
   (  segid "AREF" and resid 149  and name HD% )
   (( segid "AREF" and resid 146  and name HB1 ))
 ASSI {   14}
   (( segid "AREF" and resid 91   and name HA  ))
   (  segid "AREF" and resid 91   and name HD2%)
      2.200     0.600     0.600 peak    14 spectrum    2 weight  0.10000E+01 volume  0.59418E-02 ppm1      5.221 ppm2      0.829 CV     1
 OR {   14}
   (( segid "AREF" and resid 91   and name HA  ))
   (  segid "AREF" and resid 92   and name HD2%)
 ASSI {   15}
   (( segid "AREF" and resid 133  and name HA  ))
   (( segid "AREF" and resid 134  and name HN  ))
      2.000     0.500     0.500 peak    15 spectrum    2 weight  0.10000E+01 volume  0.58767E-02 ppm1      5.103 ppm2      8.208 CV     1
 OR {   15}
   (( segid "AREF" and resid 133  and name HA  ))
   (( segid "AREF" and resid 133  and name HN  ))
 ASSI {   55}
   (( segid "AREF" and resid 26   and name HA  ))
   (( segid "AREF" and resid 26   and name HN  ))
      2.400     0.700     0.700 peak    55 spectrum    2 weight  0.10000E+01 volume  0.45617E-02 ppm1      3.906 ppm2      7.947 CV     1
 OR {   55}
   (( segid "AREF" and resid 26   and name HA  ))
   (( segid "AREF" and resid 29   and name HN  ))
 ASSI {   57}
   (( segid "AREF" and resid 26   and name HA  ))
   (( segid "AREF" and resid 29   and name HB2 ))
      2.600     0.800     0.800 peak    57 spectrum    2 weight  0.10000E+01 volume  0.38799E-02 ppm1      3.896 ppm2      1.617 CV     1
 OR {   57}
   (( segid "AREF" and resid 26   and name HA  ))
   (( segid "AREF" and resid 26   and name HG11))
 OR {   57}
   (( segid "AREF" and resid 26   and name HA  ))
   (( segid "AREF" and resid 29   and name HB1 ))
 ASSI {   66}
   (( segid "AREF" and resid 57   and name HA  ))
   (( segid "AREF" and resid 56   and name HG1 ))
      2.900     1.000     1.000 peak    66 spectrum    2 weight  0.10000E+01 volume  0.33766E-02 ppm1      4.415 ppm2      1.659 CV     1
 OR {   66}
   (( segid "AREF" and resid 57   and name HA  ))
   (( segid "AREF" and resid 56   and name HG2 ))
 OR {   66}
   (( segid "AREF" and resid 65   and name HA  ))
   (( segid "AREF" and resid 64   and name HB1 ))
 ASSI {   71}
   (( segid "AREF" and resid 67   and name HA  ))
   (( segid "AREF" and resid 67   and name HD2 ))
      2.900     1.000     1.000 peak    71 spectrum    2 weight  0.10000E+01 volume  0.61365E-02 ppm1      4.359 ppm2      3.756 CV     1
 OR {   71}
   (( segid "AREF" and resid 59   and name HA  ))
   (( segid "AREF" and resid 59   and name HD2 ))
 OR {   71}
   (( segid "AREF" and resid 59   and name HA  ))
   (( segid "AREF" and resid 59   and name HD1 ))
 ASSI {   74}
   (( segid "AREF" and resid 120  and name HA  ))
   (  segid "AREF" and resid 132  and name HB% )
      2.400     0.700     0.700 peak    74 spectrum    2 weight  0.10000E+01 volume  0.32468E-02 ppm1      3.952 ppm2      0.887 CV     1
 OR {   74}
   (( segid "AREF" and resid 27   and name HA  ))
   (  segid "AREF" and resid 27   and name HG2%)
 ASSI {   76}
   (( segid "AREF" and resid 158  and name HA  ))
   (( segid "AREF" and resid 158  and name HB1 ))
      2.100     0.600     0.600 peak    76 spectrum    2 weight  0.10000E+01 volume  0.41397E-02 ppm1      3.904 ppm2      1.974 CV     1
 OR {   76}
   (( segid "AREF" and resid 26   and name HA  ))
   (( segid "AREF" and resid 26   and name HB  ))
 ASSI {   82}
   (( segid "AREF" and resid 65   and name HA  ))
   (( segid "AREF" and resid 64   and name HN  ))
      3.200     3.200     2.800 peak    82 spectrum    2 weight  0.10000E+01 volume  0.27598E-02 ppm1      4.411 ppm2      8.279 CV     1
 OR {   82}
   (( segid "AREF" and resid 47   and name HA  ))
   (( segid "AREF" and resid 50   and name HN  ))
 OR {   82}
   (( segid "AREF" and resid 65   and name HA  ))
   (( segid "AREF" and resid 68   and name HN  ))
 ASSI {   84}
   (( segid "AREF" and resid 57   and name HA  ))
   (( segid "AREF" and resid 57   and name HB1 ))
      2.500     0.800     0.800 peak    84 spectrum    2 weight  0.10000E+01 volume  0.25974E-02 ppm1      4.410 ppm2      2.274 CV     1
 OR {   84}
   (( segid "AREF" and resid 47   and name HA  ))
   (( segid "AREF" and resid 47   and name HB1 ))
 ASSI {   88}
   (( segid "AREF" and resid 63   and name HA  ))
   (( segid "AREF" and resid 63   and name HD2 ))
      2.700     0.900     0.900 peak    88 spectrum    2 weight  0.10000E+01 volume  0.53408E-02 ppm1      4.374 ppm2      3.589 CV     1
 OR {   88}
   (( segid "AREF" and resid 63   and name HA  ))
   (( segid "AREF" and resid 63   and name HD1 ))
 OR {   88}
   (( segid "AREF" and resid 67   and name HA  ))
   (( segid "AREF" and resid 67   and name HD1 ))
 ASSI {   89}
   (( segid "AREF" and resid 120  and name HA  ))
   (( segid "AREF" and resid 120  and name HB  ))
      2.400     0.700     0.700 peak    89 spectrum    2 weight  0.10000E+01 volume  0.37500E-02 ppm1      3.949 ppm2      1.925 CV     1
 OR {   89}
   (( segid "AREF" and resid 27   and name HA  ))
   (( segid "AREF" and resid 27   and name HB  ))
 ASSI {   97}
   (( segid "AREF" and resid 164  and name HA  ))
   (( segid "AREF" and resid 162  and name HB1 ))
      2.700     2.700     3.300 peak    97 spectrum    2 weight  0.10000E+01 volume  0.37987E-02 ppm1      4.107 ppm2      2.071 CV     1
 OR {   97}
   (( segid "AREF" and resid 164  and name HA  ))
   (( segid "AREF" and resid 167  and name HB2 ))
 ASSI {  184}
   (( segid "AREF" and resid 166  and name HA  ))
   (( segid "AREF" and resid 88   and name HA1 ))
      2.200     2.200     3.800 peak   184 spectrum    2 weight  0.10000E+01 volume  0.31818E-02 ppm1      4.414 ppm2      3.793 CV     1
 OR {  184}
   (( segid "AREF" and resid 166  and name HA  ))
   (( segid "AREF" and resid 143  and name HA  ))
 ASSI {  187}
   (( segid "AREF" and resid 28   and name HA  ))
   (( segid "AREF" and resid 28   and name HD2 ))
      2.300     0.600     0.600 peak   187 spectrum    2 weight  0.10000E+01 volume  0.40098E-02 ppm1      4.119 ppm2      1.668 CV     1
 OR {  187}
   (( segid "AREF" and resid 28   and name HA  ))
   (( segid "AREF" and resid 28   and name HD1 ))
 OR {  187}
   (( segid "AREF" and resid 28   and name HA  ))
   (( segid "AREF" and resid 31   and name HG2 ))
 ASSI {  209}
   (( segid "AREF" and resid 70   and name HA  ))
   (( segid "AREF" and resid 71   and name HN  ))
      2.600     0.800     0.800 peak   209 spectrum    2 weight  0.10000E+01 volume  0.43831E-02 ppm1      4.638 ppm2      7.982 CV     1
 OR {  209}
   (( segid "AREF" and resid 70   and name HA  ))
   (( segid "AREF" and resid 70   and name HN  ))
 ASSI {  210}
   (( segid "AREF" and resid 70   and name HA  ))
   (( segid "AREF" and resid 69   and name HA  ))
      3.000     1.100     1.100 peak   210 spectrum    2 weight  0.10000E+01 volume  0.68344E-02 ppm1      4.638 ppm2      4.176 CV     1
 OR {  210}
   (( segid "AREF" and resid 70   and name HA  ))
   (( segid "AREF" and resid 71   and name HA  ))
 ASSI {  229}
   (( segid "AREF" and resid 104  and name HA  ))
   (( segid "AREF" and resid 104  and name HN  ))
      2.500     0.800     0.800 peak   229 spectrum    2 weight  0.10000E+01 volume  0.52435E-02 ppm1      4.322 ppm2      7.547 CV     1
 OR {  229}
   (( segid "AREF" and resid 104  and name HA  ))
   (( segid "AREF" and resid 105  and name HN  ))
 ASSI {  240}
   (( segid "AREF" and resid 141  and name HA  ))
   (  segid "AREF" and resid 140  and name HB% )
      3.100     1.200     1.200 peak   240 spectrum    2 weight  0.10000E+01 volume  0.32955E-02 ppm1      4.318 ppm2      1.426 CV     1
 OR {  240}
   (( segid "AREF" and resid 167  and name HA  ))
   (( segid "AREF" and resid 168  and name HG11))
 ASSI {  243}
   (( segid "AREF" and resid 132  and name HA  ))
   (( segid "AREF" and resid 133  and name HN  ))
      2.400     0.700     0.700 peak   243 spectrum    2 weight  0.10000E+01 volume  0.34903E-02 ppm1      4.287 ppm2      8.173 CV     1
 OR {  243}
   (( segid "AREF" and resid 34   and name HA  ))
   (( segid "AREF" and resid 35   and name HN  ))
 OR {  243}
   (( segid "AREF" and resid 35   and name HA  ))
   (( segid "AREF" and resid 35   and name HN  ))
 OR {  243}
   (( segid "AREF" and resid 34   and name HA  ))
   (( segid "AREF" and resid 34   and name HN  ))
 ASSI {  244}
   (( segid "AREF" and resid 141  and name HA  ))
   (  segid "AREF" and resid 89   and name HB% )
      3.700     1.700     1.700 peak   244 spectrum    2 weight  0.10000E+01 volume  0.31818E-02 ppm1      4.292 ppm2      1.243 CV     1
 OR {  244}
   (( segid "AREF" and resid 132  and name HA  ))
   (  segid "AREF" and resid 118  and name HB% )
 ASSI {  246}
   (( segid "AREF" and resid 117  and name HA  ))
   (( segid "AREF" and resid 117  and name HG2 ))
      3.100     1.200     1.200 peak   246 spectrum    2 weight  0.10000E+01 volume  0.30682E-02 ppm1      4.246 ppm2      1.265 CV     1
 OR {  246}
   (( segid "AREF" and resid 117  and name HA  ))
   (( segid "AREF" and resid 117  and name HG1 ))
 OR {  246}
   (( segid "AREF" and resid 117  and name HA  ))
   (  segid "AREF" and resid 118  and name HB% )
 ASSI {  248}
   (( segid "AREF" and resid 117  and name HA  ))
   (( segid "AREF" and resid 117  and name HB2 ))
      2.500     0.800     0.800 peak   248 spectrum    2 weight  0.10000E+01 volume  0.26786E-02 ppm1      4.237 ppm2      1.665 CV     1
 OR {  248}
   (( segid "AREF" and resid 23   and name HA  ))
   (( segid "AREF" and resid 23   and name HG  ))
 OR {  248}
   (( segid "AREF" and resid 23   and name HA  ))
   (( segid "AREF" and resid 23   and name HB2 ))
 OR {  248}
   (( segid "AREF" and resid 117  and name HA  ))
   (( segid "AREF" and resid 117  and name HB1 ))
 OR {  248}
   (( segid "AREF" and resid 23   and name HA  ))
   (( segid "AREF" and resid 23   and name HB1 ))
 ASSI {  255}
   (( segid "AREF" and resid 25   and name HA  ))
   (  segid "AREF" and resid 29   and name HD1%)
      3.200     1.300     1.300 peak   255 spectrum    2 weight  0.10000E+01 volume  0.51625E-02 ppm1      4.495 ppm2      0.894 CV     1
 OR {  255}
   (( segid "AREF" and resid 25   and name HA  ))
   (  segid "AREF" and resid 26   and name HG2%)
 OR {  255}
   (( segid "AREF" and resid 25   and name HA  ))
   (  segid "AREF" and resid 27   and name HG2%)
 ASSI {  259}
   (( segid "AREF" and resid 8    and name HA  ))
   (( segid "AREF" and resid 8    and name HB2 ))
      2.900     1.000     1.000 peak   259 spectrum    2 weight  0.10000E+01 volume  0.26948E-02 ppm1      4.345 ppm2      2.073 CV     1
 OR {  259}
   (( segid "AREF" and resid 167  and name HA  ))
   (( segid "AREF" and resid 167  and name HB2 ))
 ASSI {  260}
   (( segid "AREF" and resid 51   and name HA  ))
   (( segid "AREF" and resid 51   and name HD2 ))
      3.400     1.400     1.400 peak   260 spectrum    2 weight  0.10000E+01 volume  0.33604E-02 ppm1      4.340 ppm2      3.195 CV     1
 OR {  260}
   (( segid "AREF" and resid 51   and name HA  ))
   (( segid "AREF" and resid 51   and name HD1 ))
 OR {  260}
   (( segid "AREF" and resid 38   and name HA  ))
   (( segid "AREF" and resid 38   and name HD1 ))
 OR {  260}
   (( segid "AREF" and resid 44   and name HA  ))
   (( segid "AREF" and resid 44   and name HD2 ))
 ASSI {  262}
   (( segid "AREF" and resid 44   and name HA  ))
   (( segid "AREF" and resid 45   and name HN  ))
      2.500     0.800     0.800 peak   262 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      4.329 ppm2      8.465 CV     1
 OR {  262}
   (( segid "AREF" and resid 167  and name HA  ))
   (( segid "AREF" and resid 167  and name HN  ))
 OR {  262}
   (( segid "AREF" and resid 43   and name HA  ))
   (( segid "AREF" and resid 43   and name HN  ))
 OR {  262}
   (( segid "AREF" and resid 54   and name HA  ))
   (( segid "AREF" and resid 55   and name HN  ))
 ASSI {  263}
   (( segid "AREF" and resid 8    and name HA  ))
   (( segid "AREF" and resid 7    and name HA2 ))
      3.300     1.300     1.300 peak   263 spectrum    2 weight  0.10000E+01 volume  0.42533E-02 ppm1      4.325 ppm2      3.964 CV     1
 OR {  263}
   (( segid "AREF" and resid 38   and name HA  ))
   (( segid "AREF" and resid 39   and name HA1 ))
 OR {  263}
   (( segid "AREF" and resid 83   and name HA  ))
   (( segid "AREF" and resid 82   and name HA2 ))
 OR {  263}
   (( segid "AREF" and resid 8    and name HA  ))
   (( segid "AREF" and resid 7    and name HA1 ))
 OR {  263}
   (( segid "AREF" and resid 51   and name HA  ))
   (( segid "AREF" and resid 52   and name HA2 ))
 OR {  263}
   (( segid "AREF" and resid 83   and name HA  ))
   (( segid "AREF" and resid 82   and name HA1 ))
 OR {  263}
   (( segid "AREF" and resid 38   and name HA  ))
   (( segid "AREF" and resid 39   and name HA2 ))
 OR {  263}
   (( segid "AREF" and resid 54   and name HA  ))
   (( segid "AREF" and resid 53   and name HA2 ))
 OR {  263}
   (( segid "AREF" and resid 51   and name HA  ))
   (( segid "AREF" and resid 52   and name HA1 ))
 ASSI {  264}
   (( segid "AREF" and resid 54   and name HA  ))
   (( segid "AREF" and resid 54   and name HN  ))
      2.600     0.900     0.900 peak   264 spectrum    2 weight  0.10000E+01 volume  0.34578E-02 ppm1      4.313 ppm2      8.250 CV     1
 OR {  264}
   (( segid "AREF" and resid 18   and name HA  ))
   (( segid "AREF" and resid 19   and name HN  ))
 ASSI {  268}
   (( segid "AREF" and resid 33   and name HA  ))
   (( segid "AREF" and resid 33   and name HN  ))
      2.600     0.800     0.800 peak   268 spectrum    2 weight  0.10000E+01 volume  0.40584E-02 ppm1      4.253 ppm2      8.166 CV     1
 OR {  268}
   (( segid "AREF" and resid 33   and name HA  ))
   (( segid "AREF" and resid 34   and name HN  ))
 ASSI {  277}
   (( segid "AREF" and resid 25   and name HA  ))
   (( segid "AREF" and resid 25   and name HN  ))
      2.600     0.900     0.900 peak   277 spectrum    2 weight  0.10000E+01 volume  0.37176E-02 ppm1      4.500 ppm2      7.946 CV     1
 OR {  277}
   (( segid "AREF" and resid 25   and name HA  ))
   (( segid "AREF" and resid 26   and name HN  ))
 ASSI {  280}
   (( segid "AREF" and resid 24   and name HA  ))
   (( segid "AREF" and resid 24   and name HB1 ))
      2.700     0.900     0.900 peak   280 spectrum    2 weight  0.10000E+01 volume  0.32305E-02 ppm1      4.435 ppm2      2.611 CV     1
 OR {  280}
   (( segid "AREF" and resid 24   and name HA  ))
   (( segid "AREF" and resid 24   and name HB2 ))
 OR {  280}
   (( segid "AREF" and resid 19   and name HA  ))
   (( segid "AREF" and resid 19   and name HG2 ))
 ASSI {  284}
   (( segid "AREF" and resid 8    and name HA  ))
   (( segid "AREF" and resid 8    and name HG2 ))
      2.800     1.000     1.000 peak   284 spectrum    2 weight  0.10000E+01 volume  0.35390E-02 ppm1      4.347 ppm2      2.355 CV     1
 OR {  284}
   (( segid "AREF" and resid 167  and name HA  ))
   (( segid "AREF" and resid 167  and name HG2 ))
 OR {  284}
   (( segid "AREF" and resid 8    and name HA  ))
   (( segid "AREF" and resid 8    and name HG1 ))
 OR {  284}
   (( segid "AREF" and resid 167  and name HA  ))
   (( segid "AREF" and resid 167  and name HG1 ))
 ASSI {  286}
   (( segid "AREF" and resid 51   and name HA  ))
   (( segid "AREF" and resid 51   and name HB1 ))
      2.800     1.000     1.000 peak   286 spectrum    2 weight  0.10000E+01 volume  0.22727E-02 ppm1      4.340 ppm2      1.827 CV     1
 OR {  286}
   (( segid "AREF" and resid 38   and name HA  ))
   (( segid "AREF" and resid 38   and name HB1 ))
 OR {  286}
   (( segid "AREF" and resid 44   and name HA  ))
   (( segid "AREF" and resid 44   and name HB2 ))
 OR {  286}
   (( segid "AREF" and resid 38   and name HA  ))
   (( segid "AREF" and resid 38   and name HB2 ))
 ASSI {  287}
   (( segid "AREF" and resid 44   and name HA  ))
   (( segid "AREF" and resid 44   and name HG1 ))
      3.000     1.100     1.100 peak   287 spectrum    2 weight  0.10000E+01 volume  0.23864E-02 ppm1      4.342 ppm2      1.636 CV     1
 OR {  287}
   (( segid "AREF" and resid 38   and name HA  ))
   (( segid "AREF" and resid 38   and name HG1 ))
 OR {  287}
   (( segid "AREF" and resid 44   and name HA  ))
   (( segid "AREF" and resid 44   and name HG2 ))
 OR {  287}
   (( segid "AREF" and resid 38   and name HA  ))
   (( segid "AREF" and resid 38   and name HG2 ))
 ASSI {  297}
   (( segid "AREF" and resid 15   and name HA  ))
   (( segid "AREF" and resid 15   and name HB2 ))
      2.800     1.000     1.000 peak   297 spectrum    2 weight  0.10000E+01 volume  0.30032E-02 ppm1      4.456 ppm2      2.088 CV     1
 OR {  297}
   (( segid "AREF" and resid 15   and name HA  ))
   (( segid "AREF" and resid 15   and name HB1 ))
 OR {  297}
   (( segid "AREF" and resid 10   and name HA  ))
   (( segid "AREF" and resid 10   and name HB2 ))
 ASSI {  298}
   (( segid "AREF" and resid 24   and name HA  ))
   (( segid "AREF" and resid 25   and name HN  ))
      2.600     0.800     0.800 peak   298 spectrum    2 weight  0.10000E+01 volume  0.41558E-02 ppm1      4.444 ppm2      7.933 CV     1
 OR {  298}
   (( segid "AREF" and resid 24   and name HA  ))
   (( segid "AREF" and resid 26   and name HN  ))
 ASSI {  299}
   (( segid "AREF" and resid 167  and name HA  ))
   (( segid "AREF" and resid 167  and name HN  ))
      2.600     0.900     0.900 peak   299 spectrum    2 weight  0.10000E+01 volume  0.40909E-02 ppm1      4.347 ppm2      8.469 CV     1
 OR {  299}
   (( segid "AREF" and resid 8    and name HA  ))
   (( segid "AREF" and resid 9    and name HN  ))
 ASSI {  301}
   (( segid "AREF" and resid 170  and name HA  ))
   (  segid "AREF" and resid 170  and name HD2%)
      3.500     1.500     1.500 peak   301 spectrum    2 weight  0.10000E+01 volume  0.27273E-02 ppm1      4.220 ppm2      0.826 CV     1
 OR {  301}
   (( segid "AREF" and resid 74   and name HA  ))
   (  segid "AREF" and resid 74   and name HD2%)
 ASSI {  323}
   (( segid "AREF" and resid 73   and name HA  ))
   (( segid "AREF" and resid 73   and name HB2 ))
      2.900     1.000     1.000 peak   323 spectrum    2 weight  0.10000E+01 volume  0.26948E-02 ppm1      4.546 ppm2      2.622 CV     1
 OR {  323}
   (( segid "AREF" and resid 17   and name HA  ))
   (( segid "AREF" and resid 17   and name HB1 ))
 OR {  323}
   (( segid "AREF" and resid 73   and name HA  ))
   (( segid "AREF" and resid 73   and name HB1 ))
 ASSI {  332}
   (( segid "AREF" and resid 154  and name HA  ))
   (( segid "AREF" and resid 154  and name HN  ))
      2.700     0.900     0.900 peak   332 spectrum    2 weight  0.10000E+01 volume  0.31818E-02 ppm1      4.547 ppm2      8.046 CV     1
 OR {  332}
   (( segid "AREF" and resid 73   and name HA  ))
   (( segid "AREF" and resid 74   and name HN  ))
 ASSI {  339}
   (( segid "AREF" and resid 154  and name HA  ))
   (( segid "AREF" and resid 152  and name HA  ))
      2.800     2.800     3.200 peak   339 spectrum    2 weight  0.10000E+01 volume  0.48377E-02 ppm1      4.573 ppm2      4.332 CV     1
 OR {  339}
   (( segid "AREF" and resid 64   and name HA  ))
   (( segid "AREF" and resid 67   and name HA  ))
 ASSI {  340}
   (( segid "AREF" and resid 17   and name HA  ))
   (( segid "AREF" and resid 16   and name HA  ))
      3.100     1.200     1.200 peak   340 spectrum    2 weight  0.10000E+01 volume  0.47890E-02 ppm1      4.559 ppm2      4.218 CV     1
 OR {  340}
   (( segid "AREF" and resid 73   and name HA  ))
   (( segid "AREF" and resid 74   and name HA  ))
 ASSI {  351}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 29   and name HB1 ))
      3.000     1.100     1.100 peak   351 spectrum    2 weight  0.10000E+01 volume  0.27598E-02 ppm1      4.619 ppm2      1.671 CV     1
 OR {  351}
   (( segid "AREF" and resid 30   and name HA  ))
   (( segid "AREF" and resid 31   and name HG2 ))
 ASSI {  354}
   (( segid "AREF" and resid 64   and name HA  ))
   (( segid "AREF" and resid 64   and name HN  ))
      2.500     0.800     0.800 peak   354 spectrum    2 weight  0.10000E+01 volume  0.36039E-02 ppm1      4.574 ppm2      8.252 CV     1
 OR {  354}
   (( segid "AREF" and resid 64   and name HA  ))
   (( segid "AREF" and resid 66   and name HN  ))
 ASSI {  357}
   (( segid "AREF" and resid 64   and name HA  ))
   (( segid "AREF" and resid 64   and name HB1 ))
      2.500     0.800     0.800 peak   357 spectrum    2 weight  0.10000E+01 volume  0.28409E-02 ppm1      4.571 ppm2      1.717 CV     1
 OR {  357}
   (( segid "AREF" and resid 154  and name HA  ))
   (( segid "AREF" and resid 154  and name HB1 ))
 OR {  357}
   (( segid "AREF" and resid 62   and name HA  ))
   (( segid "AREF" and resid 62   and name HB1 ))
 ASSI {  370}
   (( segid "AREF" and resid 55   and name HA  ))
   (( segid "AREF" and resid 56   and name HN  ))
      2.400     0.700     0.700 peak   370 spectrum    2 weight  0.10000E+01 volume  0.51625E-02 ppm1      4.672 ppm2      8.180 CV     1
 OR {  370}
   (( segid "AREF" and resid 45   and name HA  ))
   (( segid "AREF" and resid 46   and name HN  ))
 OR {  370}
   (( segid "AREF" and resid 46   and name HA  ))
   (( segid "AREF" and resid 46   and name HN  ))
 ASSI {  372}
   (( segid "AREF" and resid 55   and name HA  ))
   (( segid "AREF" and resid 55   and name HD22))
      2.900     1.100     1.100 peak   372 spectrum    2 weight  0.10000E+01 volume  0.81168E-02 ppm1      4.677 ppm2      6.899 CV     1
 OR {  372}
   (( segid "AREF" and resid 45   and name HA  ))
   (( segid "AREF" and resid 45   and name HD22))
 ASSI {  404}
   (( segid "AREF" and resid 67   and name HD2 ))
   (( segid "AREF" and resid 67   and name HA  ))
      3.200     1.300     1.300 peak   404 spectrum    2 weight  0.10000E+01 volume  0.41072E-02 ppm1      3.799 ppm2      4.388 CV     1
 OR {  404}
   (( segid "AREF" and resid 14   and name HD2 ))
   (( segid "AREF" and resid 14   and name HA  ))
 OR {  404}
   (( segid "AREF" and resid 65   and name HD2 ))
   (( segid "AREF" and resid 65   and name HA  ))
 ASSI {  407}
   (( segid "AREF" and resid 65   and name HD2 ))
   (( segid "AREF" and resid 64   and name HA  ))
      2.400     0.700     0.700 peak   407 spectrum    2 weight  0.10000E+01 volume  0.25487E-02 ppm1      3.787 ppm2      4.591 CV     1
 OR {  407}
   (( segid "AREF" and resid 67   and name HD2 ))
   (( segid "AREF" and resid 66   and name HA  ))
 ASSI {  408}
   (( segid "AREF" and resid 65   and name HD2 ))
   (( segid "AREF" and resid 65   and name HG1 ))
      2.600     0.900     0.900 peak   408 spectrum    2 weight  0.10000E+01 volume  0.24351E-02 ppm1      3.786 ppm2      1.982 CV     1
 OR {  408}
   (( segid "AREF" and resid 14   and name HD2 ))
   (( segid "AREF" and resid 14   and name HG1 ))
 OR {  408}
   (( segid "AREF" and resid 42   and name HD2 ))
   (( segid "AREF" and resid 42   and name HG2 ))
 OR {  408}
   (( segid "AREF" and resid 42   and name HD2 ))
   (( segid "AREF" and resid 42   and name HG1 ))
 OR {  408}
   (( segid "AREF" and resid 65   and name HD2 ))
   (( segid "AREF" and resid 65   and name HG2 ))
 OR {  408}
   (( segid "AREF" and resid 67   and name HD2 ))
   (( segid "AREF" and resid 67   and name HG1 ))
 ASSI {  409}
   (( segid "AREF" and resid 14   and name HD2 ))
   (( segid "AREF" and resid 14   and name HD1 ))
      2.000     0.500     0.500 peak   409 spectrum    2 weight  0.10000E+01 volume  0.22565E-02 ppm1      3.780 ppm2      3.612 CV     1
 OR {  409}
   (( segid "AREF" and resid 42   and name HD2 ))
   (( segid "AREF" and resid 42   and name HD1 ))
 OR {  409}
   (( segid "AREF" and resid 67   and name HD2 ))
   (( segid "AREF" and resid 67   and name HD1 ))
 ASSI {  410}
   (( segid "AREF" and resid 67   and name HD2 ))
   (( segid "AREF" and resid 67   and name HB1 ))
      3.400     1.500     1.500 peak   410 spectrum    2 weight  0.10000E+01 volume  0.35714E-02 ppm1      3.783 ppm2      2.261 CV     1
 OR {  410}
   (( segid "AREF" and resid 65   and name HD2 ))
   (( segid "AREF" and resid 65   and name HB1 ))
 OR {  410}
   (( segid "AREF" and resid 42   and name HD2 ))
   (( segid "AREF" and resid 42   and name HB1 ))
 ASSI {  411}
   (( segid "AREF" and resid 14   and name HD2 ))
   (( segid "AREF" and resid 14   and name HA  ))
      3.200     1.200     1.200 peak   411 spectrum    2 weight  0.10000E+01 volume  0.46104E-02 ppm1      3.777 ppm2      4.411 CV     1
 OR {  411}
   (( segid "AREF" and resid 65   and name HD2 ))
   (( segid "AREF" and resid 65   and name HA  ))
 OR {  411}
   (( segid "AREF" and resid 42   and name HD2 ))
   (( segid "AREF" and resid 42   and name HA  ))
 ASSI {  412}
   (( segid "AREF" and resid 65   and name HD2 ))
   (( segid "AREF" and resid 64   and name HB1 ))
      2.800     1.000     1.000 peak   412 spectrum    2 weight  0.10000E+01 volume  0.42370E-02 ppm1      3.778 ppm2      1.663 CV     1
 OR {  412}
   (( segid "AREF" and resid 67   and name HD2 ))
   (( segid "AREF" and resid 66   and name HG  ))
 ASSI {  413}
   (( segid "AREF" and resid 59   and name HD2 ))
   (( segid "AREF" and resid 59   and name HB1 ))
      3.200     1.200     1.200 peak   413 spectrum    2 weight  0.10000E+01 volume  0.49673E-02 ppm1      3.744 ppm2      2.218 CV     1
 OR {  413}
   (( segid "AREF" and resid 57   and name HD2 ))
   (( segid "AREF" and resid 57   and name HB1 ))
 OR {  413}
   (( segid "AREF" and resid 59   and name HD1 ))
   (( segid "AREF" and resid 59   and name HB1 ))
 ASSI {  415}
   (( segid "AREF" and resid 67   and name HD1 ))
   (( segid "AREF" and resid 66   and name HA  ))
      2.400     0.700     0.700 peak   415 spectrum    2 weight  0.10000E+01 volume  0.26136E-02 ppm1      3.625 ppm2      4.583 CV     1
 OR {  415}
   (( segid "AREF" and resid 63   and name HD2 ))
   (( segid "AREF" and resid 62   and name HA  ))
 OR {  415}
   (( segid "AREF" and resid 63   and name HD1 ))
   (( segid "AREF" and resid 62   and name HA  ))
 ASSI {  417}
   (( segid "AREF" and resid 57   and name HD1 ))
   (( segid "AREF" and resid 57   and name HA  ))
      2.800     1.000     1.000 peak   417 spectrum    2 weight  0.10000E+01 volume  0.49187E-02 ppm1      3.605 ppm2      4.377 CV     1
 OR {  417}
   (( segid "AREF" and resid 14   and name HD1 ))
   (( segid "AREF" and resid 14   and name HA  ))
 OR {  417}
   (( segid "AREF" and resid 63   and name HD1 ))
   (( segid "AREF" and resid 63   and name HA  ))
 OR {  417}
   (( segid "AREF" and resid 67   and name HD1 ))
   (( segid "AREF" and resid 67   and name HA  ))
 ASSI {  424}
   (( segid "AREF" and resid 63   and name HD1 ))
   (( segid "AREF" and resid 63   and name HB1 ))
      2.800     1.000     1.000 peak   424 spectrum    2 weight  0.10000E+01 volume  0.35877E-02 ppm1      3.629 ppm2      2.267 CV     1
 OR {  424}
   (( segid "AREF" and resid 67   and name HD1 ))
   (( segid "AREF" and resid 67   and name HB1 ))
 OR {  424}
   (( segid "AREF" and resid 63   and name HD2 ))
   (( segid "AREF" and resid 63   and name HB1 ))
 ASSI {  425}
   (( segid "AREF" and resid 63   and name HD2 ))
   (( segid "AREF" and resid 63   and name HG2 ))
      2.500     0.800     0.800 peak   425 spectrum    2 weight  0.10000E+01 volume  0.24026E-02 ppm1      3.626 ppm2      1.995 CV     1
 OR {  425}
   (( segid "AREF" and resid 67   and name HD1 ))
   (( segid "AREF" and resid 67   and name HG1 ))
 OR {  425}
   (( segid "AREF" and resid 67   and name HD1 ))
   (( segid "AREF" and resid 67   and name HG2 ))
 OR {  425}
   (( segid "AREF" and resid 63   and name HD1 ))
   (( segid "AREF" and resid 63   and name HG2 ))
 OR {  425}
   (( segid "AREF" and resid 14   and name HD1 ))
   (( segid "AREF" and resid 14   and name HG1 ))
 OR {  425}
   (( segid "AREF" and resid 63   and name HD2 ))
   (( segid "AREF" and resid 63   and name HG1 ))
 ASSI {  426}
   (( segid "AREF" and resid 42   and name HD1 ))
   (( segid "AREF" and resid 42   and name HA  ))
      2.800     1.000     1.000 peak   426 spectrum    2 weight  0.10000E+01 volume  0.46591E-02 ppm1      3.620 ppm2      4.414 CV     1
 OR {  426}
   (( segid "AREF" and resid 14   and name HD1 ))
   (( segid "AREF" and resid 14   and name HA  ))
 OR {  426}
   (( segid "AREF" and resid 63   and name HD1 ))
   (( segid "AREF" and resid 63   and name HA  ))
 ASSI {  461}
   (( segid "AREF" and resid 99   and name HA2 ))
   (( segid "AREF" and resid 99   and name HA1 ))
      2.000     0.500     0.500 peak   461 spectrum    2 weight  0.10000E+01 volume  0.38636E-02 ppm1      4.223 ppm2      3.656 CV     1
 OR {  461}
   (( segid "AREF" and resid 151  and name HA2 ))
   (( segid "AREF" and resid 151  and name HA1 ))
 ASSI {  464}
   (( segid "AREF" and resid 40   and name HA1 ))
   (( segid "AREF" and resid 42   and name HB2 ))
      3.300     1.400     1.400 peak   464 spectrum    2 weight  0.10000E+01 volume  0.50652E-02 ppm1      3.985 ppm2      1.867 CV     1
 OR {  464}
   (( segid "AREF" and resid 53   and name HA2 ))
   (( segid "AREF" and resid 56   and name HB2 ))
 OR {  464}
   (( segid "AREF" and resid 40   and name HA2 ))
   (( segid "AREF" and resid 42   and name HB2 ))
 ASSI {  465}
   (( segid "AREF" and resid 81   and name HA2 ))
   (( segid "AREF" and resid 81   and name HN  ))
      2.700     0.900     0.900 peak   465 spectrum    2 weight  0.10000E+01 volume  0.37987E-02 ppm1      3.984 ppm2      8.314 CV     1
 OR {  465}
   (( segid "AREF" and resid 7    and name HA2 ))
   (( segid "AREF" and resid 7    and name HN  ))
 OR {  465}
   (( segid "AREF" and resid 80   and name HA1 ))
   (( segid "AREF" and resid 81   and name HN  ))
 OR {  465}
   (( segid "AREF" and resid 40   and name HA1 ))
   (( segid "AREF" and resid 40   and name HN  ))
 OR {  465}
   (( segid "AREF" and resid 7    and name HA1 ))
   (( segid "AREF" and resid 7    and name HN  ))
 OR {  465}
   (( segid "AREF" and resid 40   and name HA2 ))
   (( segid "AREF" and resid 40   and name HN  ))
 OR {  465}
   (( segid "AREF" and resid 81   and name HA1 ))
   (( segid "AREF" and resid 81   and name HN  ))
 OR {  465}
   (( segid "AREF" and resid 80   and name HA2 ))
   (( segid "AREF" and resid 81   and name HN  ))
 ASSI {  468}
   (( segid "AREF" and resid 82   and name HA2 ))
   (( segid "AREF" and resid 83   and name HN  ))
      2.700     0.900     0.900 peak   468 spectrum    2 weight  0.10000E+01 volume  0.35714E-02 ppm1      3.978 ppm2      8.457 CV     1
 OR {  468}
   (( segid "AREF" and resid 39   and name HA2 ))
   (( segid "AREF" and resid 39   and name HN  ))
 OR {  468}
   (( segid "AREF" and resid 39   and name HA1 ))
   (( segid "AREF" and resid 39   and name HN  ))
 OR {  468}
   (( segid "AREF" and resid 82   and name HA1 ))
   (( segid "AREF" and resid 83   and name HN  ))
 ASSI {  508}
   (( segid "AREF" and resid 43   and name HD1 ))
   (( segid "AREF" and resid 42   and name HD2 ))
      2.000     2.000     4.000 peak   508 spectrum    2 weight  0.10000E+01 volume  0.50165E-02 ppm1      3.201 ppm2      3.814 CV     1
 OR {  508}
   (( segid "AREF" and resid 43   and name HD2 ))
   (( segid "AREF" and resid 42   and name HD2 ))
 OR {  508}
   (( segid "AREF" and resid 12   and name HD2 ))
   (( segid "AREF" and resid 14   and name HD2 ))
 ASSI {  509}
   (( segid "AREF" and resid 38   and name HD1 ))
   (( segid "AREF" and resid 38   and name HB1 ))
      3.000     3.000     3.000 peak   509 spectrum    2 weight  0.10000E+01 volume  0.21753E-02 ppm1      3.200 ppm2      1.826 CV     1
 OR {  509}
   (( segid "AREF" and resid 44   and name HD2 ))
   (( segid "AREF" and resid 44   and name HB1 ))
 OR {  509}
   (( segid "AREF" and resid 12   and name HD2 ))
   (( segid "AREF" and resid 12   and name HB2 ))
 OR {  509}
   (( segid "AREF" and resid 38   and name HD2 ))
   (( segid "AREF" and resid 38   and name HB1 ))
 OR {  509}
   (( segid "AREF" and resid 35   and name HD1 ))
   (( segid "AREF" and resid 35   and name HB2 ))
 OR {  509}
   (( segid "AREF" and resid 44   and name HD1 ))
   (( segid "AREF" and resid 44   and name HB1 ))
 OR {  509}
   (( segid "AREF" and resid 44   and name HD2 ))
   (( segid "AREF" and resid 44   and name HB2 ))
 OR {  509}
   (( segid "AREF" and resid 38   and name HD2 ))
   (( segid "AREF" and resid 38   and name HB2 ))
 OR {  509}
   (( segid "AREF" and resid 51   and name HD2 ))
   (( segid "AREF" and resid 51   and name HB1 ))
 OR {  509}
   (( segid "AREF" and resid 38   and name HD1 ))
   (( segid "AREF" and resid 38   and name HB2 ))
 OR {  509}
   (( segid "AREF" and resid 51   and name HD1 ))
   (( segid "AREF" and resid 51   and name HB1 ))
 OR {  509}
   (( segid "AREF" and resid 44   and name HD1 ))
   (( segid "AREF" and resid 44   and name HB2 ))
 OR {  509}
   (( segid "AREF" and resid 34   and name HD1 ))
   (( segid "AREF" and resid 34   and name HB2 ))
 OR {  509}
   (( segid "AREF" and resid 35   and name HD2 ))
   (( segid "AREF" and resid 35   and name HB2 ))
 ASSI {  510}
   (( segid "AREF" and resid 35   and name HD2 ))
   (( segid "AREF" and resid 35   and name HG2 ))
      2.800     2.800     3.200 peak   510 spectrum    2 weight  0.10000E+01 volume  0.21429E-02 ppm1      3.199 ppm2      1.652 CV     1
 OR {  510}
   (( segid "AREF" and resid 43   and name HD2 ))
   (( segid "AREF" and resid 43   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 46   and name HD2 ))
   (( segid "AREF" and resid 46   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 44   and name HD1 ))
   (( segid "AREF" and resid 44   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 54   and name HD2 ))
   (( segid "AREF" and resid 54   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 54   and name HD1 ))
   (( segid "AREF" and resid 54   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 51   and name HD2 ))
   (( segid "AREF" and resid 51   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 34   and name HD1 ))
   (( segid "AREF" and resid 34   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 51   and name HD1 ))
   (( segid "AREF" and resid 51   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 38   and name HD1 ))
   (( segid "AREF" and resid 38   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 43   and name HD1 ))
   (( segid "AREF" and resid 43   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 44   and name HD2 ))
   (( segid "AREF" and resid 44   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 35   and name HD1 ))
   (( segid "AREF" and resid 35   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 35   and name HD2 ))
   (( segid "AREF" and resid 35   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 44   and name HD2 ))
   (( segid "AREF" and resid 44   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 44   and name HD1 ))
   (( segid "AREF" and resid 44   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 35   and name HD1 ))
   (( segid "AREF" and resid 35   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 38   and name HD1 ))
   (( segid "AREF" and resid 38   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 34   and name HD1 ))
   (( segid "AREF" and resid 34   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 46   and name HD1 ))
   (( segid "AREF" and resid 46   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 51   and name HD2 ))
   (( segid "AREF" and resid 51   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 46   and name HD2 ))
   (( segid "AREF" and resid 46   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 51   and name HD1 ))
   (( segid "AREF" and resid 51   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 54   and name HD1 ))
   (( segid "AREF" and resid 54   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 54   and name HD2 ))
   (( segid "AREF" and resid 54   and name HG2 ))
 OR {  510}
   (( segid "AREF" and resid 43   and name HD1 ))
   (( segid "AREF" and resid 43   and name HG1 ))
 OR {  510}
   (( segid "AREF" and resid 43   and name HD2 ))
   (( segid "AREF" and resid 43   and name HG2 ))
 ASSI {  512}
   (( segid "AREF" and resid 43   and name HD1 ))
   (( segid "AREF" and resid 43   and name HA  ))
      3.400     1.400     1.400 peak   512 spectrum    2 weight  0.10000E+01 volume  0.29870E-02 ppm1      3.197 ppm2      4.339 CV     1
 OR {  512}
   (( segid "AREF" and resid 51   and name HD2 ))
   (( segid "AREF" and resid 51   and name HA  ))
 OR {  512}
   (( segid "AREF" and resid 51   and name HD1 ))
   (( segid "AREF" and resid 51   and name HA  ))
 OR {  512}
   (( segid "AREF" and resid 54   and name HD1 ))
   (( segid "AREF" and resid 54   and name HA  ))
 OR {  512}
   (( segid "AREF" and resid 43   and name HD2 ))
   (( segid "AREF" and resid 43   and name HA  ))
 OR {  512}
   (( segid "AREF" and resid 38   and name HD1 ))
   (( segid "AREF" and resid 38   and name HA  ))
 OR {  512}
   (( segid "AREF" and resid 44   and name HD2 ))
   (( segid "AREF" and resid 44   and name HA  ))
 OR {  512}
   (( segid "AREF" and resid 38   and name HD2 ))
   (( segid "AREF" and resid 38   and name HA  ))
 ASSI {  525}
   (( segid "AREF" and resid 31   and name HD1 ))
   (( segid "AREF" and resid 30   and name HD21))
      1.900     1.900     4.100 peak   525 spectrum    2 weight  0.10000E+01 volume  0.81168E-02 ppm1      3.197 ppm2      7.552 CV     1
 OR {  525}
   (( segid "AREF" and resid 31   and name HD2 ))
   (( segid "AREF" and resid 30   and name HD21))
 OR {  525}
   (( segid "AREF" and resid 44   and name HD2 ))
   (( segid "AREF" and resid 45   and name HD21))
 OR {  525}
   (( segid "AREF" and resid 56   and name HD1 ))
   (( segid "AREF" and resid 55   and name HD21))
 OR {  525}
   (( segid "AREF" and resid 44   and name HD1 ))
   (( segid "AREF" and resid 45   and name HD21))
 OR {  525}
   (( segid "AREF" and resid 56   and name HD2 ))
   (( segid "AREF" and resid 55   and name HD21))
 OR {  525}
   (( segid "AREF" and resid 34   and name HD1 ))
   (( segid "AREF" and resid 37   and name HD21))
 ASSI {  543}
   (( segid "AREF" and resid 28   and name HE1 ))
   (( segid "AREF" and resid 28   and name HD2 ))
      2.600     0.800     0.800 peak   543 spectrum    2 weight  0.10000E+01 volume  0.30682E-02 ppm1      2.999 ppm2      1.695 CV     1
 OR {  543}
   (( segid "AREF" and resid 64   and name HE1 ))
   (( segid "AREF" and resid 64   and name HD2 ))
 OR {  543}
   (( segid "AREF" and resid 64   and name HE2 ))
   (( segid "AREF" and resid 64   and name HD1 ))
 OR {  543}
   (( segid "AREF" and resid 28   and name HE2 ))
   (( segid "AREF" and resid 28   and name HD2 ))
 OR {  543}
   (( segid "AREF" and resid 28   and name HE1 ))
   (( segid "AREF" and resid 28   and name HD1 ))
 OR {  543}
   (( segid "AREF" and resid 64   and name HE2 ))
   (( segid "AREF" and resid 64   and name HD2 ))
 OR {  543}
   (( segid "AREF" and resid 64   and name HE1 ))
   (( segid "AREF" and resid 64   and name HD1 ))
 ASSI {  572}
   (( segid "AREF" and resid 169  and name HB2 ))
   (( segid "AREF" and resid 169  and name HA  ))
      2.900     1.100     1.100 peak   572 spectrum    2 weight  0.10000E+01 volume  0.27110E-02 ppm1      2.729 ppm2      4.616 CV     1
 OR {  572}
   (( segid "AREF" and resid 20   and name HB2 ))
   (( segid "AREF" and resid 20   and name HA  ))
 ASSI {  574}
   (( segid "AREF" and resid 20   and name HB2 ))
   (( segid "AREF" and resid 21   and name HN  ))
      2.700     0.900     0.900 peak   574 spectrum    2 weight  0.10000E+01 volume  0.53895E-02 ppm1      2.722 ppm2      8.162 CV     1
 OR {  574}
   (( segid "AREF" and resid 169  and name HB2 ))
   (( segid "AREF" and resid 170  and name HN  ))
 OR {  574}
   (( segid "AREF" and resid 25   and name HB2 ))
   (( segid "AREF" and resid 24   and name HN  ))
 ASSI {  576}
   (( segid "AREF" and resid 20   and name HB2 ))
   (  segid "AREF" and resid 23   and name HD1%)
      3.100     1.200     1.200 peak   576 spectrum    2 weight  0.10000E+01 volume  0.60392E-02 ppm1      2.722 ppm2      0.912 CV     1
 OR {  576}
   (( segid "AREF" and resid 20   and name HB2 ))
   (  segid "AREF" and resid 23   and name HD2%)
 OR {  576}
   (( segid "AREF" and resid 25   and name HB1 ))
   (  segid "AREF" and resid 29   and name HD1%)
 OR {  576}
   (( segid "AREF" and resid 25   and name HB1 ))
   (  segid "AREF" and resid 26   and name HG2%)
 OR {  576}
   (( segid "AREF" and resid 20   and name HB2 ))
   (  segid "AREF" and resid 26   and name HG2%)
 OR {  576}
   (( segid "AREF" and resid 25   and name HB2 ))
   (  segid "AREF" and resid 26   and name HG2%)
 ASSI {  612}
   (( segid "AREF" and resid 37   and name HB2 ))
   (( segid "AREF" and resid 37   and name HD21))
      2.400     0.700     0.700 peak   612 spectrum    2 weight  0.10000E+01 volume  0.66233E-02 ppm1      2.856 ppm2      7.605 CV     1
 OR {  612}
   (( segid "AREF" and resid 30   and name HB1 ))
   (( segid "AREF" and resid 30   and name HD21))
 OR {  612}
   (( segid "AREF" and resid 30   and name HB2 ))
   (( segid "AREF" and resid 30   and name HD21))
 ASSI {  656}
   (( segid "AREF" and resid 145  and name HA  ))
   (( segid "AREF" and resid 149  and name HN  ))
      1.900     0.500     0.500 peak   656 spectrum    2 weight  0.10000E+01 volume  0.97563E-02 ppm1      2.444 ppm2      7.530 CV     1
 OR {  656}
   (( segid "AREF" and resid 145  and name HA  ))
   (( segid "AREF" and resid 145  and name HN  ))
 ASSI {  666}
   (( segid "AREF" and resid 20   and name HB1 ))
   (( segid "AREF" and resid 23   and name HG  ))
      2.900     1.000     1.000 peak   666 spectrum    2 weight  0.10000E+01 volume  0.49673E-02 ppm1      2.604 ppm2      1.665 CV     1
 OR {  666}
   (( segid "AREF" and resid 20   and name HB1 ))
   (( segid "AREF" and resid 23   and name HB2 ))
 OR {  666}
   (( segid "AREF" and resid 20   and name HB1 ))
   (( segid "AREF" and resid 23   and name HB1 ))
 OR {  666}
   (( segid "AREF" and resid 17   and name HB1 ))
   (( segid "AREF" and resid 18   and name HD1 ))
 ASSI {  669}
   (( segid "AREF" and resid 169  and name HB1 ))
   (( segid "AREF" and resid 170  and name HA  ))
      3.100     1.200     1.200 peak   669 spectrum    2 weight  0.10000E+01 volume  0.46429E-02 ppm1      2.635 ppm2      4.194 CV     1
 OR {  669}
   (( segid "AREF" and resid 73   and name HB2 ))
   (( segid "AREF" and resid 74   and name HA  ))
 OR {  669}
   (( segid "AREF" and resid 73   and name HB1 ))
   (( segid "AREF" and resid 74   and name HA  ))
 OR {  669}
   (( segid "AREF" and resid 17   and name HB1 ))
   (( segid "AREF" and resid 16   and name HA  ))
 ASSI {  670}
   (( segid "AREF" and resid 20   and name HB1 ))
   (( segid "AREF" and resid 20   and name HA  ))
      2.900     1.000     1.000 peak   670 spectrum    2 weight  0.10000E+01 volume  0.24676E-02 ppm1      2.630 ppm2      4.596 CV     1
 OR {  670}
   (( segid "AREF" and resid 169  and name HB1 ))
   (( segid "AREF" and resid 169  and name HA  ))
 ASSI {  672}
   (( segid "AREF" and resid 73   and name HB1 ))
   (( segid "AREF" and resid 73   and name HN  ))
      2.900     1.100     1.100 peak   672 spectrum    2 weight  0.10000E+01 volume  0.35714E-02 ppm1      2.601 ppm2      8.279 CV     1
 OR {  672}
   (( segid "AREF" and resid 20   and name HB1 ))
   (( segid "AREF" and resid 20   and name HN  ))
 OR {  672}
   (( segid "AREF" and resid 73   and name HB2 ))
   (( segid "AREF" and resid 73   and name HN  ))
 ASSI {  681}
   (( segid "AREF" and resid 169  and name HB1 ))
   (( segid "AREF" and resid 170  and name HN  ))
      3.100     1.200     1.200 peak   681 spectrum    2 weight  0.10000E+01 volume  0.29546E-02 ppm1      2.637 ppm2      8.157 CV     1
 OR {  681}
   (( segid "AREF" and resid 17   and name HB1 ))
   (( segid "AREF" and resid 17   and name HN  ))
 OR {  681}
   (( segid "AREF" and resid 76   and name HB1 ))
   (( segid "AREF" and resid 76   and name HN  ))
 ASSI {  682}
   (( segid "AREF" and resid 169  and name HB1 ))
   (( segid "AREF" and resid 170  and name HA  ))
      3.000     1.200     1.200 peak   682 spectrum    2 weight  0.10000E+01 volume  0.46591E-02 ppm1      2.628 ppm2      4.177 CV     1
 OR {  682}
   (( segid "AREF" and resid 73   and name HB2 ))
   (( segid "AREF" and resid 74   and name HA  ))
 OR {  682}
   (( segid "AREF" and resid 73   and name HB1 ))
   (( segid "AREF" and resid 74   and name HA  ))
 ASSI {  684}
   (( segid "AREF" and resid 24   and name HB2 ))
   (( segid "AREF" and resid 23   and name HB1 ))
      3.500     1.500     1.500 peak   684 spectrum    2 weight  0.10000E+01 volume  0.49187E-02 ppm1      2.589 ppm2      1.631 CV     1
 OR {  684}
   (( segid "AREF" and resid 24   and name HB2 ))
   (( segid "AREF" and resid 23   and name HB2 ))
 OR {  684}
   (( segid "AREF" and resid 68   and name HB1 ))
   (( segid "AREF" and resid 69   and name HB2 ))
 OR {  684}
   (( segid "AREF" and resid 24   and name HB1 ))
   (( segid "AREF" and resid 23   and name HB1 ))
 OR {  684}
   (( segid "AREF" and resid 24   and name HB1 ))
   (( segid "AREF" and resid 23   and name HB2 ))
 OR {  684}
   (( segid "AREF" and resid 68   and name HB2 ))
   (( segid "AREF" and resid 69   and name HB2 ))
 ASSI {  685}
   (( segid "AREF" and resid 17   and name HB2 ))
   (( segid "AREF" and resid 18   and name HA  ))
      3.300     1.400     1.400 peak   685 spectrum    2 weight  0.10000E+01 volume  0.56493E-02 ppm1      2.682 ppm2      4.266 CV     1
 OR {  685}
   (( segid "AREF" and resid 17   and name HB2 ))
   (( segid "AREF" and resid 16   and name HA  ))
 ASSI {  744}
   (( segid "AREF" and resid 9    and name HG1 ))
   (( segid "AREF" and resid 9    and name HB2 ))
      2.800     1.000     1.000 peak   744 spectrum    2 weight  0.10000E+01 volume  0.25162E-02 ppm1      2.368 ppm2      2.119 CV     1
 OR {  744}
   (( segid "AREF" and resid 8    and name HG1 ))
   (( segid "AREF" and resid 8    and name HB2 ))
 OR {  744}
   (( segid "AREF" and resid 33   and name HG2 ))
   (( segid "AREF" and resid 33   and name HB1 ))
 OR {  744}
   (( segid "AREF" and resid 9    and name HG2 ))
   (( segid "AREF" and resid 9    and name HB2 ))
 OR {  744}
   (( segid "AREF" and resid 8    and name HG2 ))
   (( segid "AREF" and resid 8    and name HB2 ))
 ASSI {  747}
   (( segid "AREF" and resid 8    and name HG2 ))
   (( segid "AREF" and resid 8    and name HA  ))
      2.800     1.000     1.000 peak   747 spectrum    2 weight  0.10000E+01 volume  0.33929E-02 ppm1      2.356 ppm2      4.343 CV     1
 OR {  747}
   (( segid "AREF" and resid 9    and name HG2 ))
   (( segid "AREF" and resid 9    and name HA  ))
 OR {  747}
   (( segid "AREF" and resid 8    and name HG1 ))
   (( segid "AREF" and resid 8    and name HA  ))
 OR {  747}
   (( segid "AREF" and resid 9    and name HG1 ))
   (( segid "AREF" and resid 9    and name HA  ))
 ASSI {  749}
   (( segid "AREF" and resid 167  and name HG2 ))
   (( segid "AREF" and resid 167  and name HE22))
      3.100     1.200     1.200 peak   749 spectrum    2 weight  0.10000E+01 volume  0.61852E-02 ppm1      2.348 ppm2      6.806 CV     1
 OR {  749}
   (( segid "AREF" and resid 33   and name HG1 ))
   (( segid "AREF" and resid 33   and name HE22))
 OR {  749}
   (( segid "AREF" and resid 9    and name HG2 ))
   (( segid "AREF" and resid 9    and name HE22))
 OR {  749}
   (( segid "AREF" and resid 8    and name HG1 ))
   (( segid "AREF" and resid 8    and name HE22))
 OR {  749}
   (( segid "AREF" and resid 8    and name HG2 ))
   (( segid "AREF" and resid 8    and name HE22))
 OR {  749}
   (( segid "AREF" and resid 9    and name HG1 ))
   (( segid "AREF" and resid 9    and name HE22))
 ASSI {  750}
   (( segid "AREF" and resid 167  and name HG2 ))
   (  segid "AREF" and resid 170  and name HD2%)
      3.200     1.300     1.300 peak   750 spectrum    2 weight  0.10000E+01 volume  0.40098E-02 ppm1      2.341 ppm2      0.859 CV     1
 OR {  750}
   (( segid "AREF" and resid 167  and name HG1 ))
   (  segid "AREF" and resid 170  and name HD2%)
 OR {  750}
   (( segid "AREF" and resid 167  and name HG1 ))
   (  segid "AREF" and resid 168  and name HG2%)
 OR {  750}
   (( segid "AREF" and resid 167  and name HG2 ))
   (  segid "AREF" and resid 168  and name HG2%)
 OR {  750}
   (( segid "AREF" and resid 167  and name HG2 ))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI {  771}
   (( segid "AREF" and resid 15   and name HG1 ))
   (( segid "AREF" and resid 15   and name HB1 ))
      2.700     0.900     0.900 peak   771 spectrum    2 weight  0.10000E+01 volume  0.31981E-02 ppm1      2.545 ppm2      2.076 CV     1
 OR {  771}
   (( segid "AREF" and resid 19   and name HG1 ))
   (( segid "AREF" and resid 19   and name HB1 ))
 OR {  771}
   (( segid "AREF" and resid 19   and name HG1 ))
   (( segid "AREF" and resid 19   and name HB2 ))
 OR {  771}
   (( segid "AREF" and resid 10   and name HG1 ))
   (  segid "AREF" and resid 10   and name HE% )
 OR {  771}
   (( segid "AREF" and resid 15   and name HG1 ))
   (( segid "AREF" and resid 15   and name HB2 ))
 ASSI {  772}
   (( segid "AREF" and resid 21   and name HG1 ))
   (( segid "AREF" and resid 21   and name HA  ))
      2.700     0.900     0.900 peak   772 spectrum    2 weight  0.10000E+01 volume  0.47728E-02 ppm1      2.542 ppm2      4.486 CV     1
 OR {  772}
   (( segid "AREF" and resid 15   and name HG1 ))
   (( segid "AREF" and resid 15   and name HA  ))
 OR {  772}
   (( segid "AREF" and resid 10   and name HG1 ))
   (( segid "AREF" and resid 10   and name HA  ))
 ASSI {  780}
   (( segid "AREF" and resid 47   and name HB1 ))
   (( segid "AREF" and resid 47   and name HA  ))
      2.500     0.800     0.800 peak   780 spectrum    2 weight  0.10000E+01 volume  0.26461E-02 ppm1      2.270 ppm2      4.406 CV     1
 OR {  780}
   (( segid "AREF" and resid 42   and name HB1 ))
   (( segid "AREF" and resid 42   and name HA  ))
 ASSI {  782}
   (( segid "AREF" and resid 63   and name HB1 ))
   (( segid "AREF" and resid 64   and name HN  ))
      3.200     1.300     1.300 peak   782 spectrum    2 weight  0.10000E+01 volume  0.40260E-02 ppm1      2.269 ppm2      8.301 CV     1
 OR {  782}
   (( segid "AREF" and resid 57   and name HB1 ))
   (( segid "AREF" and resid 58   and name HN  ))
 ASSI {  784}
   (( segid "AREF" and resid 63   and name HB1 ))
   (( segid "AREF" and resid 64   and name HN  ))
      3.200     1.300     1.300 peak   784 spectrum    2 weight  0.10000E+01 volume  0.43182E-02 ppm1      2.253 ppm2      8.261 CV     1
 OR {  784}
   (( segid "AREF" and resid 67   and name HB1 ))
   (( segid "AREF" and resid 68   and name HN  ))
 ASSI {  786}
   (( segid "AREF" and resid 63   and name HB1 ))
   (( segid "AREF" and resid 64   and name HA  ))
      3.500     1.600     1.600 peak   786 spectrum    2 weight  0.10000E+01 volume  0.55196E-02 ppm1      2.255 ppm2      4.602 CV     1
 OR {  786}
   (( segid "AREF" and resid 67   and name HB1 ))
   (( segid "AREF" and resid 66   and name HA  ))
 ASSI {  787}
   (( segid "AREF" and resid 67   and name HB1 ))
   (( segid "AREF" and resid 67   and name HD2 ))
      3.400     1.400     1.400 peak   787 spectrum    2 weight  0.10000E+01 volume  0.40423E-02 ppm1      2.222 ppm2      3.786 CV     1
 OR {  787}
   (( segid "AREF" and resid 65   and name HB1 ))
   (( segid "AREF" and resid 65   and name HD2 ))
 ASSI {  802}
   (( segid "AREF" and resid 9    and name HB2 ))
   (( segid "AREF" and resid 9    and name HA  ))
      2.700     0.900     0.900 peak   802 spectrum    2 weight  0.10000E+01 volume  0.34416E-02 ppm1      2.127 ppm2      4.320 CV     1
 OR {  802}
   (( segid "AREF" and resid 8    and name HB2 ))
   (( segid "AREF" and resid 8    and name HA  ))
 ASSI {  834}
   (( segid "AREF" and resid 74   and name HB1 ))
   (  segid "AREF" and resid 74   and name HD2%)
      2.700     0.900     0.900 peak   834 spectrum    2 weight  0.10000E+01 volume  0.31494E-02 ppm1      1.374 ppm2      0.806 CV     1
 OR {  834}
   (( segid "AREF" and resid 108  and name HB2 ))
   (  segid "AREF" and resid 108  and name HD2%)
 OR {  834}
   (( segid "AREF" and resid 74   and name HB1 ))
   (  segid "AREF" and resid 74   and name HD1%)
 ASSI {  852}
   (( segid "AREF" and resid 74   and name HB1 ))
   (( segid "AREF" and resid 75   and name HN  ))
      2.200     0.600     0.600 peak   852 spectrum    2 weight  0.10000E+01 volume  0.61201E-02 ppm1      1.367 ppm2      8.046 CV     1
 OR {  852}
   (( segid "AREF" and resid 74   and name HB1 ))
   (( segid "AREF" and resid 74   and name HN  ))
 ASSI {  859}
   (( segid "AREF" and resid 23   and name HB2 ))
   (( segid "AREF" and resid 23   and name HA  ))
      2.600     0.800     0.800 peak   859 spectrum    2 weight  0.10000E+01 volume  0.31981E-02 ppm1      1.625 ppm2      4.221 CV     1
 OR {  859}
   (( segid "AREF" and resid 23   and name HB1 ))
   (( segid "AREF" and resid 23   and name HA  ))
 OR {  859}
   (( segid "AREF" and resid 170  and name HB2 ))
   (( segid "AREF" and resid 170  and name HA  ))
 ASSI {  870}
   (( segid "AREF" and resid 170  and name HB1 ))
   (( segid "AREF" and resid 171  and name HN  ))
      2.900     1.100     1.100 peak   870 spectrum    2 weight  0.10000E+01 volume  0.43020E-02 ppm1      1.526 ppm2      8.225 CV     1
 OR {  870}
   (( segid "AREF" and resid 66   and name HB1 ))
   (( segid "AREF" and resid 66   and name HN  ))
 ASSI {  873}
   (( segid "AREF" and resid 49   and name HB  ))
   (( segid "AREF" and resid 49   and name HN  ))
      2.700     0.900     0.900 peak   873 spectrum    2 weight  0.10000E+01 volume  0.45942E-02 ppm1      1.833 ppm2      8.033 CV     1
 OR {  873}
   (( segid "AREF" and resid 168  and name HB  ))
   (( segid "AREF" and resid 168  and name HN  ))
 ASSI {  874}
   (( segid "AREF" and resid 168  and name HB  ))
   (( segid "AREF" and resid 168  and name HG11))
      2.600     0.800     0.800 peak   874 spectrum    2 weight  0.10000E+01 volume  0.38312E-02 ppm1      1.821 ppm2      1.435 CV     1
 OR {  874}
   (( segid "AREF" and resid 49   and name HB  ))
   (( segid "AREF" and resid 49   and name HG11))
 ASSI {  875}
   (( segid "AREF" and resid 168  and name HB  ))
   (  segid "AREF" and resid 168  and name HG2%)
      2.600     0.900     0.900 peak   875 spectrum    2 weight  0.10000E+01 volume  0.29708E-02 ppm1      1.821 ppm2      0.863 CV     1
 OR {  875}
   (( segid "AREF" and resid 49   and name HB  ))
   (  segid "AREF" and resid 49   and name HG2%)
 OR {  875}
   (( segid "AREF" and resid 49   and name HB  ))
   (  segid "AREF" and resid 49   and name HD1%)
 OR {  875}
   (( segid "AREF" and resid 168  and name HB  ))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI {  876}
   (( segid "AREF" and resid 168  and name HB  ))
   (( segid "AREF" and resid 168  and name HA  ))
      2.500     0.800     0.800 peak   876 spectrum    2 weight  0.10000E+01 volume  0.37987E-02 ppm1      1.814 ppm2      4.122 CV     1
 OR {  876}
   (( segid "AREF" and resid 49   and name HB  ))
   (( segid "AREF" and resid 49   and name HA  ))
 ASSI {  883}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 26   and name HA  ))
      2.400     0.700     0.700 peak   883 spectrum    2 weight  0.10000E+01 volume  0.68671E-02 ppm1      1.982 ppm2      3.915 CV     1
 OR {  883}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 27   and name HA  ))
 ASSI {  886}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 26   and name HG11))
      2.200     0.600     0.600 peak   886 spectrum    2 weight  0.10000E+01 volume  0.43994E-02 ppm1      1.972 ppm2      1.595 CV     1
 OR {  886}
   (( segid "AREF" and resid 26   and name HB  ))
   (( segid "AREF" and resid 27   and name HG12))
 ASSI {  920}
   (( segid "AREF" and resid 85   and name HB  ))
   (( segid "AREF" and resid 85   and name HA  ))
      2.600     0.900     0.900 peak   920 spectrum    2 weight  0.10000E+01 volume  0.39448E-02 ppm1      2.090 ppm2      4.158 CV     1
 OR {  920}
   (( segid "AREF" and resid 71   and name HG2 ))
   (( segid "AREF" and resid 71   and name HA  ))
 OR {  920}
   (( segid "AREF" and resid 71   and name HG1 ))
   (( segid "AREF" and resid 71   and name HA  ))
 ASSI {  928}
   (( segid "AREF" and resid 85   and name HB  ))
   (  segid "AREF" and resid 85   and name HG2%)
      2.700     2.700     3.300 peak   928 spectrum    2 weight  0.10000E+01 volume  0.26786E-02 ppm1      2.078 ppm2      0.912 CV     1
 OR {  928}
   (( segid "AREF" and resid 36   and name HB  ))
   (  segid "AREF" and resid 36   and name HG2%)
 OR {  928}
   (( segid "AREF" and resid 85   and name HB  ))
   (  segid "AREF" and resid 85   and name HG1%)
 OR {  928}
   (( segid "AREF" and resid 36   and name HB  ))
   (  segid "AREF" and resid 36   and name HG1%)
 ASSI {  931}
   (( segid "AREF" and resid 21   and name HB1 ))
   (  segid "AREF" and resid 26   and name HD1%)
      3.400     3.400     2.600 peak   931 spectrum    2 weight  0.10000E+01 volume  0.39610E-02 ppm1      2.016 ppm2      0.862 CV     1
 OR {  931}
   (( segid "AREF" and resid 21   and name HB1 ))
   (  segid "AREF" and resid 23   and name HD2%)
 ASSI {  950}
   (( segid "AREF" and resid 150  and name HB1 ))
   (( segid "AREF" and resid 162  and name HA  ))
      3.300     3.300     2.700 peak   950 spectrum    2 weight  0.10000E+01 volume  0.39610E-02 ppm1      1.959 ppm2      4.745 CV     1
 OR {  950}
   (( segid "AREF" and resid 150  and name HB1 ))
   (( segid "AREF" and resid 163  and name HA  ))
 ASSI {  955}
   (( segid "AREF" and resid 93   and name HB  ))
   (  segid "AREF" and resid 161  and name HG2%)
      2.700     0.900     0.900 peak   955 spectrum    2 weight  0.10000E+01 volume  0.34740E-02 ppm1      1.873 ppm2      0.860 CV     1
 OR {  955}
   (( segid "AREF" and resid 93   and name HB  ))
   (  segid "AREF" and resid 91   and name HD2%)
 ASSI {  959}
   (( segid "AREF" and resid 93   and name HB  ))
   (( segid "AREF" and resid 161  and name HB  ))
      3.800     1.800     1.800 peak   959 spectrum    2 weight  0.10000E+01 volume  0.25162E-02 ppm1      1.863 ppm2      1.482 CV     1
 OR {  959}
   (( segid "AREF" and resid 63   and name HB2 ))
   (( segid "AREF" and resid 64   and name HG2 ))
 OR {  959}
   (( segid "AREF" and resid 63   and name HB2 ))
   (( segid "AREF" and resid 64   and name HG1 ))
 ASSI {  962}
   (( segid "AREF" and resid 28   and name HB2 ))
   (  segid "AREF" and resid 29   and name HD2%)
      3.400     1.500     1.500 peak   962 spectrum    2 weight  0.10000E+01 volume  0.38150E-02 ppm1      1.851 ppm2      0.862 CV     1
 OR {  962}
   (( segid "AREF" and resid 28   and name HB2 ))
   (  segid "AREF" and resid 27   and name HG2%)
 OR {  962}
   (( segid "AREF" and resid 28   and name HB2 ))
   (  segid "AREF" and resid 29   and name HD1%)
 OR {  962}
   (( segid "AREF" and resid 28   and name HB1 ))
   (  segid "AREF" and resid 27   and name HG2%)
 OR {  962}
   (( segid "AREF" and resid 28   and name HB1 ))
   (  segid "AREF" and resid 29   and name HD1%)
 ASSI {  963}
   (( segid "AREF" and resid 64   and name HB2 ))
   (( segid "AREF" and resid 64   and name HA  ))
      2.600     0.900     0.900 peak   963 spectrum    2 weight  0.10000E+01 volume  0.37987E-02 ppm1      1.838 ppm2      4.541 CV     1
 OR {  963}
   (( segid "AREF" and resid 63   and name HB2 ))
   (( segid "AREF" and resid 62   and name HA  ))
 ASSI {  964}
   (( segid "AREF" and resid 28   and name HB1 ))
   (( segid "AREF" and resid 28   and name HG2 ))
      2.600     0.800     0.800 peak   964 spectrum    2 weight  0.10000E+01 volume  0.25325E-02 ppm1      1.827 ppm2      1.482 CV     1
 OR {  964}
   (( segid "AREF" and resid 28   and name HB2 ))
   (( segid "AREF" and resid 28   and name HG2 ))
 OR {  964}
   (( segid "AREF" and resid 64   and name HB2 ))
   (( segid "AREF" and resid 64   and name HG1 ))
 OR {  964}
   (( segid "AREF" and resid 64   and name HB2 ))
   (( segid "AREF" and resid 64   and name HG2 ))
 ASSI {  973}
   (( segid "AREF" and resid 116  and name HB1 ))
   (( segid "AREF" and resid 116  and name HG2 ))
      2.400     0.700     0.700 peak   973 spectrum    2 weight  0.10000E+01 volume  0.31981E-02 ppm1      1.658 ppm2      1.202 CV     1
 OR {  973}
   (( segid "AREF" and resid 116  and name HB2 ))
   (( segid "AREF" and resid 116  and name HG1 ))
 OR {  973}
   (( segid "AREF" and resid 69   and name HB2 ))
   (( segid "AREF" and resid 69   and name HG1 ))
 OR {  973}
   (( segid "AREF" and resid 69   and name HB2 ))
   (( segid "AREF" and resid 69   and name HG2 ))
 OR {  973}
   (( segid "AREF" and resid 116  and name HB1 ))
   (( segid "AREF" and resid 116  and name HG1 ))
 ASSI {  981}
   (( segid "AREF" and resid 10   and name HB1 ))
   (( segid "AREF" and resid 12   and name HG2 ))
      2.600     0.800     0.800 peak   981 spectrum    2 weight  0.10000E+01 volume  0.36688E-02 ppm1      1.999 ppm2      1.655 CV     1
 OR {  981}
   (( segid "AREF" and resid 150  and name HB2 ))
   (( segid "AREF" and resid 163  and name HB2 ))
 ASSI {  986}
   (( segid "AREF" and resid 147  and name HB1 ))
   (( segid "AREF" and resid 147  and name HE1 ))
      3.000     1.100     1.100 peak   986 spectrum    2 weight  0.10000E+01 volume  0.68185E-02 ppm1      1.856 ppm2      2.961 CV     1
 OR {  986}
   (( segid "AREF" and resid 28   and name HB1 ))
   (( segid "AREF" and resid 28   and name HE1 ))
 OR {  986}
   (( segid "AREF" and resid 28   and name HB1 ))
   (( segid "AREF" and resid 28   and name HE2 ))
 OR {  986}
   (( segid "AREF" and resid 147  and name HB2 ))
   (( segid "AREF" and resid 147  and name HE1 ))
 OR {  986}
   (( segid "AREF" and resid 28   and name HB2 ))
   (( segid "AREF" and resid 28   and name HE2 ))
 OR {  986}
   (( segid "AREF" and resid 28   and name HB2 ))
   (( segid "AREF" and resid 28   and name HE1 ))
 OR {  986}
   (( segid "AREF" and resid 147  and name HB2 ))
   (( segid "AREF" and resid 147  and name HE2 ))
 ASSI {  996}
   (( segid "AREF" and resid 42   and name HB2 ))
   (( segid "AREF" and resid 42   and name HD2 ))
      3.400     1.400     1.400 peak   996 spectrum    2 weight  0.10000E+01 volume  0.27760E-02 ppm1      1.872 ppm2      3.809 CV     1
 OR {  996}
   (( segid "AREF" and resid 14   and name HB2 ))
   (( segid "AREF" and resid 14   and name HD2 ))
 ASSI {  997}
   (( segid "AREF" and resid 42   and name HB2 ))
   (( segid "AREF" and resid 42   and name HD1 ))
      3.500     1.600     1.600 peak   997 spectrum    2 weight  0.10000E+01 volume  0.30357E-02 ppm1      1.875 ppm2      3.623 CV     1
 OR {  997}
   (( segid "AREF" and resid 14   and name HB2 ))
   (( segid "AREF" and resid 14   and name HD1 ))
 OR {  997}
   (( segid "AREF" and resid 57   and name HB2 ))
   (( segid "AREF" and resid 57   and name HD1 ))
 ASSI {  998}
   (( segid "AREF" and resid 57   and name HB2 ))
   (( segid "AREF" and resid 57   and name HB1 ))
      2.100     2.100     3.900 peak   998 spectrum    2 weight  0.10000E+01 volume  0.22565E-02 ppm1      1.874 ppm2      2.266 CV     1
 OR {  998}
   (( segid "AREF" and resid 47   and name HB2 ))
   (( segid "AREF" and resid 47   and name HB1 ))
 OR {  998}
   (( segid "AREF" and resid 42   and name HB2 ))
   (( segid "AREF" and resid 42   and name HB1 ))
 ASSI { 1002}
   (( segid "AREF" and resid 14   and name HB2 ))
   (( segid "AREF" and resid 14   and name HA  ))
      3.000     1.200     1.200 peak  1002 spectrum    2 weight  0.10000E+01 volume  0.25162E-02 ppm1      1.869 ppm2      4.382 CV     1
 OR { 1002}
   (( segid "AREF" and resid 57   and name HB2 ))
   (( segid "AREF" and resid 57   and name HA  ))
 OR { 1002}
   (( segid "AREF" and resid 47   and name HB2 ))
   (( segid "AREF" and resid 47   and name HA  ))
 ASSI { 1003}
   (( segid "AREF" and resid 67   and name HB2 ))
   (( segid "AREF" and resid 68   and name HN  ))
      2.700     0.900     0.900 peak  1003 spectrum    2 weight  0.10000E+01 volume  0.32468E-02 ppm1      1.854 ppm2      8.269 CV     1
 OR { 1003}
   (( segid "AREF" and resid 63   and name HB2 ))
   (( segid "AREF" and resid 64   and name HN  ))
 ASSI { 1004}
   (( segid "AREF" and resid 147  and name HB1 ))
   (( segid "AREF" and resid 146  and name HN  ))
      3.400     1.500     1.500 peak  1004 spectrum    2 weight  0.10000E+01 volume  0.43344E-02 ppm1      1.851 ppm2      8.104 CV     1
 OR { 1004}
   (( segid "AREF" and resid 57   and name HB2 ))
   (( segid "AREF" and resid 56   and name HN  ))
 OR { 1004}
   (( segid "AREF" and resid 147  and name HB2 ))
   (( segid "AREF" and resid 146  and name HN  ))
 ASSI { 1011}
   (( segid "AREF" and resid 44   and name HB1 ))
   (( segid "AREF" and resid 44   and name HD2 ))
      2.800     1.000     1.000 peak  1011 spectrum    2 weight  0.10000E+01 volume  0.31331E-02 ppm1      1.786 ppm2      3.191 CV     1
 OR { 1011}
   (( segid "AREF" and resid 54   and name HB2 ))
   (( segid "AREF" and resid 54   and name HD2 ))
 OR { 1011}
   (( segid "AREF" and resid 54   and name HB2 ))
   (( segid "AREF" and resid 54   and name HD1 ))
 OR { 1011}
   (( segid "AREF" and resid 43   and name HB1 ))
   (( segid "AREF" and resid 43   and name HD2 ))
 OR { 1011}
   (( segid "AREF" and resid 44   and name HB1 ))
   (( segid "AREF" and resid 44   and name HD1 ))
 OR { 1011}
   (( segid "AREF" and resid 44   and name HB2 ))
   (( segid "AREF" and resid 44   and name HD2 ))
 OR { 1011}
   (( segid "AREF" and resid 54   and name HB1 ))
   (( segid "AREF" and resid 54   and name HD1 ))
 OR { 1011}
   (( segid "AREF" and resid 54   and name HB1 ))
   (( segid "AREF" and resid 54   and name HD2 ))
 ASSI { 1012}
   (( segid "AREF" and resid 12   and name HB1 ))
   (( segid "AREF" and resid 12   and name HA  ))
      2.700     0.900     0.900 peak  1012 spectrum    2 weight  0.10000E+01 volume  0.30195E-02 ppm1      1.781 ppm2      4.337 CV     1
 OR { 1012}
   (( segid "AREF" and resid 54   and name HB2 ))
   (( segid "AREF" and resid 54   and name HA  ))
 OR { 1012}
   (( segid "AREF" and resid 44   and name HB1 ))
   (( segid "AREF" and resid 44   and name HA  ))
 OR { 1012}
   (( segid "AREF" and resid 51   and name HB2 ))
   (( segid "AREF" and resid 51   and name HA  ))
 OR { 1012}
   (( segid "AREF" and resid 54   and name HB1 ))
   (( segid "AREF" and resid 54   and name HA  ))
 ASSI { 1016}
   (( segid "AREF" and resid 35   and name HB2 ))
   (( segid "AREF" and resid 35   and name HD1 ))
      2.800     1.000     1.000 peak  1016 spectrum    2 weight  0.10000E+01 volume  0.26948E-02 ppm1      1.851 ppm2      3.194 CV     1
 OR { 1016}
   (( segid "AREF" and resid 31   and name HB1 ))
   (( segid "AREF" and resid 31   and name HD2 ))
 OR { 1016}
   (( segid "AREF" and resid 43   and name HB2 ))
   (( segid "AREF" and resid 43   and name HD1 ))
 OR { 1016}
   (( segid "AREF" and resid 31   and name HB2 ))
   (( segid "AREF" and resid 31   and name HD2 ))
 OR { 1016}
   (( segid "AREF" and resid 43   and name HB2 ))
   (( segid "AREF" and resid 43   and name HD2 ))
 OR { 1016}
   (( segid "AREF" and resid 35   and name HB2 ))
   (( segid "AREF" and resid 35   and name HD2 ))
 ASSI { 1038}
   (( segid "AREF" and resid 167  and name HB2 ))
   (( segid "AREF" and resid 167  and name HA  ))
      2.800     1.000     1.000 peak  1038 spectrum    2 weight  0.10000E+01 volume  0.34578E-02 ppm1      2.090 ppm2      4.317 CV     1
 OR { 1038}
   (( segid "AREF" and resid 83   and name HB2 ))
   (( segid "AREF" and resid 83   and name HA  ))
 ASSI { 1042}
   (( segid "AREF" and resid 107  and name HB2 ))
   (( segid "AREF" and resid 107  and name HA  ))
      2.600     0.800     0.800 peak  1042 spectrum    2 weight  0.10000E+01 volume  0.42533E-02 ppm1      2.056 ppm2      4.291 CV     1
 OR { 1042}
   (( segid "AREF" and resid 107  and name HB1 ))
   (( segid "AREF" and resid 107  and name HA  ))
 OR { 1042}
   (( segid "AREF" and resid 83   and name HB2 ))
   (( segid "AREF" and resid 83   and name HA  ))
 ASSI { 1049}
   (( segid "AREF" and resid 83   and name HB1 ))
   (( segid "AREF" and resid 83   and name HN  ))
      2.400     0.700     0.700 peak  1049 spectrum    2 weight  0.10000E+01 volume  0.87014E-02 ppm1      1.953 ppm2      8.442 CV     1
 OR { 1049}
   (( segid "AREF" and resid 83   and name HB1 ))
   (( segid "AREF" and resid 84   and name HN  ))
 ASSI { 1050}
   (( segid "AREF" and resid 71   and name HB2 ))
   (( segid "AREF" and resid 71   and name HA  ))
      2.700     0.900     0.900 peak  1050 spectrum    2 weight  0.10000E+01 volume  0.32792E-02 ppm1      1.947 ppm2      4.166 CV     1
 OR { 1050}
   (( segid "AREF" and resid 124  and name HB2 ))
   (( segid "AREF" and resid 124  and name HA  ))
 OR { 1050}
   (( segid "AREF" and resid 124  and name HB1 ))
   (( segid "AREF" and resid 124  and name HA  ))
 ASSI { 1059}
   (( segid "AREF" and resid 167  and name HB1 ))
   (( segid "AREF" and resid 167  and name HA  ))
      2.700     0.900     0.900 peak  1059 spectrum    2 weight  0.10000E+01 volume  0.33279E-02 ppm1      2.000 ppm2      4.339 CV     1
 OR { 1059}
   (( segid "AREF" and resid 8    and name HB1 ))
   (( segid "AREF" and resid 8    and name HA  ))
 OR { 1059}
   (( segid "AREF" and resid 9    and name HB1 ))
   (( segid "AREF" and resid 9    and name HA  ))
 ASSI { 1070}
   (( segid "AREF" and resid 167  and name HB1 ))
   (( segid "AREF" and resid 167  and name HG2 ))
      2.800     1.000     1.000 peak  1070 spectrum    2 weight  0.10000E+01 volume  0.28896E-02 ppm1      2.001 ppm2      2.355 CV     1
 OR { 1070}
   (( segid "AREF" and resid 8    and name HB1 ))
   (( segid "AREF" and resid 8    and name HG2 ))
 OR { 1070}
   (( segid "AREF" and resid 9    and name HB1 ))
   (( segid "AREF" and resid 9    and name HG2 ))
 OR { 1070}
   (( segid "AREF" and resid 9    and name HB1 ))
   (( segid "AREF" and resid 9    and name HG1 ))
 OR { 1070}
   (( segid "AREF" and resid 167  and name HB1 ))
   (( segid "AREF" and resid 167  and name HG1 ))
 OR { 1070}
   (( segid "AREF" and resid 8    and name HB1 ))
   (( segid "AREF" and resid 8    and name HG1 ))
 ASSI { 1074}
   (( segid "AREF" and resid 28   and name HD2 ))
   (( segid "AREF" and resid 28   and name HE1 ))
      2.600     0.800     0.800 peak  1074 spectrum    2 weight  0.10000E+01 volume  0.29221E-02 ppm1      1.681 ppm2      2.972 CV     1
 OR { 1074}
   (( segid "AREF" and resid 64   and name HD2 ))
   (( segid "AREF" and resid 64   and name HE1 ))
 OR { 1074}
   (( segid "AREF" and resid 18   and name HD2 ))
   (( segid "AREF" and resid 18   and name HE2 ))
 OR { 1074}
   (( segid "AREF" and resid 64   and name HD1 ))
   (( segid "AREF" and resid 64   and name HE2 ))
 OR { 1074}
   (( segid "AREF" and resid 18   and name HD1 ))
   (( segid "AREF" and resid 18   and name HE1 ))
 OR { 1074}
   (( segid "AREF" and resid 28   and name HD1 ))
   (( segid "AREF" and resid 28   and name HE1 ))
 OR { 1074}
   (( segid "AREF" and resid 18   and name HD1 ))
   (( segid "AREF" and resid 18   and name HE2 ))
 OR { 1074}
   (( segid "AREF" and resid 18   and name HD2 ))
   (( segid "AREF" and resid 18   and name HE1 ))
 OR { 1074}
   (( segid "AREF" and resid 64   and name HD2 ))
   (( segid "AREF" and resid 64   and name HE2 ))
 OR { 1074}
   (( segid "AREF" and resid 64   and name HD1 ))
   (( segid "AREF" and resid 64   and name HE1 ))
 ASSI { 1086}
   (( segid "AREF" and resid 26   and name HG11))
   (( segid "AREF" and resid 26   and name HG12))
      2.200     0.600     0.600 peak  1086 spectrum    2 weight  0.10000E+01 volume  0.29383E-02 ppm1      1.570 ppm2      1.206 CV     1
 OR { 1086}
   (( segid "AREF" and resid 69   and name HD1 ))
   (( segid "AREF" and resid 69   and name HG1 ))
 OR { 1086}
   (( segid "AREF" and resid 69   and name HD2 ))
   (( segid "AREF" and resid 69   and name HG2 ))
 OR { 1086}
   (( segid "AREF" and resid 69   and name HD1 ))
   (( segid "AREF" and resid 69   and name HG2 ))
 ASSI { 1093}
   (( segid "AREF" and resid 27   and name HG12))
   (( segid "AREF" and resid 27   and name HN  ))
      3.100     1.200     1.200 peak  1093 spectrum    2 weight  0.10000E+01 volume  0.42533E-02 ppm1      1.576 ppm2      8.050 CV     1
 OR { 1093}
   (( segid "AREF" and resid 26   and name HG11))
   (( segid "AREF" and resid 27   and name HN  ))
 ASSI { 1094}
   (( segid "AREF" and resid 26   and name HG11))
   (( segid "AREF" and resid 25   and name HN  ))
      3.000     1.100     1.100 peak  1094 spectrum    2 weight  0.10000E+01 volume  0.47403E-02 ppm1      1.575 ppm2      7.956 CV     1
 OR { 1094}
   (( segid "AREF" and resid 27   and name HG12))
   (( segid "AREF" and resid 29   and name HN  ))
 ASSI { 1099}
   (( segid "AREF" and resid 27   and name HG11))
   (( segid "AREF" and resid 27   and name HN  ))
      1.700     0.400     0.500 peak  1099 spectrum    2 weight  0.10000E+01 volume  0.68021E-02 ppm1      1.234 ppm2      8.066 CV     1
 OR { 1099}
   (( segid "AREF" and resid 26   and name HG12))
   (( segid "AREF" and resid 27   and name HN  ))
 ASSI { 1100}
   (( segid "AREF" and resid 27   and name HG11))
   (( segid "AREF" and resid 27   and name HB  ))
      2.300     0.700     0.700 peak  1100 spectrum    2 weight  0.10000E+01 volume  0.63963E-02 ppm1      1.230 ppm2      1.946 CV     1
 OR { 1100}
   (( segid "AREF" and resid 26   and name HG12))
   (( segid "AREF" and resid 26   and name HB  ))
 OR { 1100}
   (( segid "AREF" and resid 27   and name HG11))
   (( segid "AREF" and resid 26   and name HB  ))
 ASSI { 1111}
   (( segid "AREF" and resid 27   and name HG11))
   (( segid "AREF" and resid 27   and name HG12))
      1.700     0.400     0.500 peak  1111 spectrum    2 weight  0.10000E+01 volume  0.32468E-02 ppm1      1.231 ppm2      1.577 CV     1
 OR { 1111}
   (( segid "AREF" and resid 26   and name HG12))
   (( segid "AREF" and resid 26   and name HG11))
 ASSI { 1112}
   (( segid "AREF" and resid 27   and name HG11))
   (  segid "AREF" and resid 27   and name HD1%)
      2.400     0.700     0.700 peak  1112 spectrum    2 weight  0.10000E+01 volume  0.35390E-02 ppm1      1.217 ppm2      0.880 CV     1
 OR { 1112}
   (( segid "AREF" and resid 26   and name HG12))
   (  segid "AREF" and resid 26   and name HD1%)
 OR { 1112}
   (( segid "AREF" and resid 26   and name HG12))
   (  segid "AREF" and resid 26   and name HG2%)
 OR { 1112}
   (( segid "AREF" and resid 27   and name HG11))
   (  segid "AREF" and resid 27   and name HG2%)
 ASSI { 1132}
   (( segid "AREF" and resid 168  and name HG12))
   (( segid "AREF" and resid 168  and name HB  ))
      2.600     0.800     0.800 peak  1132 spectrum    2 weight  0.10000E+01 volume  0.51461E-02 ppm1      1.165 ppm2      1.832 CV     1
 OR { 1132}
   (( segid "AREF" and resid 49   and name HG12))
   (( segid "AREF" and resid 49   and name HB  ))
 ASSI { 1133}
   (( segid "AREF" and resid 168  and name HG12))
   (  segid "AREF" and resid 168  and name HD1%)
      2.600     0.900     0.900 peak  1133 spectrum    2 weight  0.10000E+01 volume  0.28572E-02 ppm1      1.155 ppm2      0.847 CV     1
 OR { 1133}
   (( segid "AREF" and resid 49   and name HG12))
   (  segid "AREF" and resid 49   and name HD1%)
 OR { 1133}
   (( segid "AREF" and resid 168  and name HG12))
   (  segid "AREF" and resid 168  and name HG2%)
 ASSI { 1134}
   (( segid "AREF" and resid 65   and name HG1 ))
   (( segid "AREF" and resid 64   and name HA  ))
      3.800     1.800     1.800 peak  1134 spectrum    2 weight  0.10000E+01 volume  0.35065E-02 ppm1      2.008 ppm2      4.591 CV     1
 OR { 1134}
   (( segid "AREF" and resid 63   and name HG2 ))
   (( segid "AREF" and resid 62   and name HA  ))
 OR { 1134}
   (( segid "AREF" and resid 63   and name HG1 ))
   (( segid "AREF" and resid 62   and name HA  ))
 OR { 1134}
   (( segid "AREF" and resid 65   and name HG2 ))
   (( segid "AREF" and resid 64   and name HA  ))
 ASSI { 1136}
   (( segid "AREF" and resid 42   and name HG1 ))
   (( segid "AREF" and resid 42   and name HD1 ))
      2.500     0.800     0.800 peak  1136 spectrum    2 weight  0.10000E+01 volume  0.25000E-02 ppm1      2.001 ppm2      3.624 CV     1
 OR { 1136}
   (( segid "AREF" and resid 63   and name HG1 ))
   (( segid "AREF" and resid 63   and name HD1 ))
 OR { 1136}
   (( segid "AREF" and resid 63   and name HG2 ))
   (( segid "AREF" and resid 63   and name HD2 ))
 OR { 1136}
   (( segid "AREF" and resid 67   and name HG1 ))
   (( segid "AREF" and resid 67   and name HD1 ))
 OR { 1136}
   (( segid "AREF" and resid 67   and name HG2 ))
   (( segid "AREF" and resid 67   and name HD1 ))
 OR { 1136}
   (( segid "AREF" and resid 63   and name HG2 ))
   (( segid "AREF" and resid 63   and name HD1 ))
 OR { 1136}
   (( segid "AREF" and resid 42   and name HG2 ))
   (( segid "AREF" and resid 42   and name HD1 ))
 OR { 1136}
   (( segid "AREF" and resid 63   and name HG1 ))
   (( segid "AREF" and resid 63   and name HD2 ))
 ASSI { 1137}
   (( segid "AREF" and resid 65   and name HG1 ))
   (( segid "AREF" and resid 65   and name HB1 ))
      2.600     0.900     0.900 peak  1137 spectrum    2 weight  0.10000E+01 volume  0.24676E-02 ppm1      1.996 ppm2      2.260 CV     1
 OR { 1137}
   (( segid "AREF" and resid 57   and name HG1 ))
   (( segid "AREF" and resid 57   and name HB1 ))
 OR { 1137}
   (( segid "AREF" and resid 47   and name HG1 ))
   (( segid "AREF" and resid 47   and name HB1 ))
 OR { 1137}
   (( segid "AREF" and resid 42   and name HG2 ))
   (( segid "AREF" and resid 42   and name HB1 ))
 OR { 1137}
   (( segid "AREF" and resid 42   and name HG1 ))
   (( segid "AREF" and resid 42   and name HB1 ))
 OR { 1137}
   (( segid "AREF" and resid 47   and name HG2 ))
   (( segid "AREF" and resid 47   and name HB1 ))
 OR { 1137}
   (( segid "AREF" and resid 57   and name HG2 ))
   (( segid "AREF" and resid 57   and name HB1 ))
 OR { 1137}
   (( segid "AREF" and resid 65   and name HG2 ))
   (( segid "AREF" and resid 65   and name HB1 ))
 ASSI { 1139}
   (( segid "AREF" and resid 57   and name HG1 ))
   (( segid "AREF" and resid 56   and name HG1 ))
      3.300     1.400     1.400 peak  1139 spectrum    2 weight  0.10000E+01 volume  0.68994E-02 ppm1      1.992 ppm2      1.633 CV     1
 OR { 1139}
   (( segid "AREF" and resid 57   and name HG2 ))
   (( segid "AREF" and resid 56   and name HG1 ))
 OR { 1139}
   (( segid "AREF" and resid 57   and name HG1 ))
   (( segid "AREF" and resid 56   and name HG2 ))
 OR { 1139}
   (( segid "AREF" and resid 47   and name HG1 ))
   (( segid "AREF" and resid 46   and name HG1 ))
 OR { 1139}
   (( segid "AREF" and resid 47   and name HG1 ))
   (( segid "AREF" and resid 46   and name HG2 ))
 OR { 1139}
   (( segid "AREF" and resid 57   and name HG2 ))
   (( segid "AREF" and resid 56   and name HG2 ))
 ASSI { 1140}
   (( segid "AREF" and resid 59   and name HG2 ))
   (( segid "AREF" and resid 59   and name HA  ))
      3.400     1.500     1.500 peak  1140 spectrum    2 weight  0.10000E+01 volume  0.29058E-02 ppm1      1.985 ppm2      4.398 CV     1
 OR { 1140}
   (( segid "AREF" and resid 47   and name HG1 ))
   (( segid "AREF" and resid 47   and name HA  ))
 OR { 1140}
   (( segid "AREF" and resid 57   and name HG1 ))
   (( segid "AREF" and resid 57   and name HA  ))
 OR { 1140}
   (( segid "AREF" and resid 14   and name HG1 ))
   (( segid "AREF" and resid 14   and name HA  ))
 OR { 1140}
   (( segid "AREF" and resid 65   and name HG1 ))
   (( segid "AREF" and resid 65   and name HA  ))
 OR { 1140}
   (( segid "AREF" and resid 67   and name HG1 ))
   (( segid "AREF" and resid 67   and name HA  ))
 OR { 1140}
   (( segid "AREF" and resid 14   and name HG2 ))
   (( segid "AREF" and resid 14   and name HA  ))
 OR { 1140}
   (( segid "AREF" and resid 59   and name HG1 ))
   (( segid "AREF" and resid 59   and name HA  ))
 OR { 1140}
   (( segid "AREF" and resid 47   and name HG2 ))
   (( segid "AREF" and resid 47   and name HA  ))
 OR { 1140}
   (( segid "AREF" and resid 65   and name HG2 ))
   (( segid "AREF" and resid 65   and name HA  ))
 ASSI { 1143}
   (( segid "AREF" and resid 67   and name HG1 ))
   (( segid "AREF" and resid 66   and name HA  ))
      3.800     1.800     1.800 peak  1143 spectrum    2 weight  0.10000E+01 volume  0.33929E-02 ppm1      1.972 ppm2      4.576 CV     1
 OR { 1143}
   (( segid "AREF" and resid 59   and name HG2 ))
   (( segid "AREF" and resid 58   and name HA  ))
 OR { 1143}
   (( segid "AREF" and resid 59   and name HG1 ))
   (( segid "AREF" and resid 58   and name HA  ))
 OR { 1143}
   (( segid "AREF" and resid 67   and name HG2 ))
   (( segid "AREF" and resid 66   and name HA  ))
 ASSI { 1147}
   (( segid "AREF" and resid 54   and name HG1 ))
   (( segid "AREF" and resid 54   and name HN  ))
      3.000     1.100     1.100 peak  1147 spectrum    2 weight  0.10000E+01 volume  0.35390E-02 ppm1      1.618 ppm2      8.231 CV     1
 OR { 1147}
   (( segid "AREF" and resid 54   and name HG2 ))
   (( segid "AREF" and resid 54   and name HN  ))
 OR { 1147}
   (( segid "AREF" and resid 170  and name HG  ))
   (( segid "AREF" and resid 171  and name HN  ))
 ASSI { 1153}
   (( segid "AREF" and resid 168  and name HG11))
   (( segid "AREF" and resid 168  and name HG12))
      1.900     0.500     0.500 peak  1153 spectrum    2 weight  0.10000E+01 volume  0.27598E-02 ppm1      1.458 ppm2      1.167 CV     1
 OR { 1153}
   (( segid "AREF" and resid 49   and name HG11))
   (( segid "AREF" and resid 49   and name HG12))
 ASSI { 1154}
   (( segid "AREF" and resid 74   and name HG  ))
   (  segid "AREF" and resid 74   and name HD2%)
      2.700     0.900     0.900 peak  1154 spectrum    2 weight  0.10000E+01 volume  0.24838E-02 ppm1      1.451 ppm2      0.832 CV     1
 OR { 1154}
   (( segid "AREF" and resid 49   and name HG11))
   (  segid "AREF" and resid 49   and name HD1%)
 OR { 1154}
   (( segid "AREF" and resid 168  and name HG11))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI { 1165}
   (( segid "AREF" and resid 35   and name HG2 ))
   (( segid "AREF" and resid 35   and name HD2 ))
      2.700     2.700     3.300 peak  1165 spectrum    2 weight  0.10000E+01 volume  0.24026E-02 ppm1      1.649 ppm2      3.196 CV     1
 OR { 1165}
   (( segid "AREF" and resid 43   and name HG1 ))
   (( segid "AREF" and resid 43   and name HD2 ))
 OR { 1165}
   (( segid "AREF" and resid 46   and name HG1 ))
   (( segid "AREF" and resid 46   and name HD2 ))
 OR { 1165}
   (( segid "AREF" and resid 44   and name HG1 ))
   (( segid "AREF" and resid 44   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 51   and name HG1 ))
   (( segid "AREF" and resid 51   and name HD2 ))
 OR { 1165}
   (( segid "AREF" and resid 34   and name HG1 ))
   (( segid "AREF" and resid 34   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 51   and name HG2 ))
   (( segid "AREF" and resid 51   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 38   and name HG1 ))
   (( segid "AREF" and resid 38   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 43   and name HG2 ))
   (( segid "AREF" and resid 43   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 46   and name HG2 ))
   (( segid "AREF" and resid 46   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 44   and name HG2 ))
   (( segid "AREF" and resid 44   and name HD2 ))
 OR { 1165}
   (( segid "AREF" and resid 35   and name HG2 ))
   (( segid "AREF" and resid 35   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 35   and name HG1 ))
   (( segid "AREF" and resid 35   and name HD2 ))
 OR { 1165}
   (( segid "AREF" and resid 44   and name HG1 ))
   (( segid "AREF" and resid 44   and name HD2 ))
 OR { 1165}
   (( segid "AREF" and resid 44   and name HG2 ))
   (( segid "AREF" and resid 44   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 35   and name HG1 ))
   (( segid "AREF" and resid 35   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 56   and name HG1 ))
   (( segid "AREF" and resid 56   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 38   and name HG2 ))
   (( segid "AREF" and resid 38   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 34   and name HG2 ))
   (( segid "AREF" and resid 34   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 46   and name HG1 ))
   (( segid "AREF" and resid 46   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 51   and name HG2 ))
   (( segid "AREF" and resid 51   and name HD2 ))
 OR { 1165}
   (( segid "AREF" and resid 46   and name HG2 ))
   (( segid "AREF" and resid 46   and name HD2 ))
 OR { 1165}
   (( segid "AREF" and resid 51   and name HG1 ))
   (( segid "AREF" and resid 51   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 43   and name HG1 ))
   (( segid "AREF" and resid 43   and name HD1 ))
 OR { 1165}
   (( segid "AREF" and resid 43   and name HG2 ))
   (( segid "AREF" and resid 43   and name HD2 ))
 ASSI { 1166}
   (( segid "AREF" and resid 31   and name HG2 ))
   (( segid "AREF" and resid 29   and name HN  ))
      3.000     3.000     3.000 peak  1166 spectrum    2 weight  0.10000E+01 volume  0.55842E-02 ppm1      1.648 ppm2      7.968 CV     1
 OR { 1166}
   (( segid "AREF" and resid 31   and name HG1 ))
   (( segid "AREF" and resid 29   and name HN  ))
 OR { 1166}
   (( segid "AREF" and resid 23   and name HG  ))
   (( segid "AREF" and resid 25   and name HN  ))
 ASSI { 1167}
   (( segid "AREF" and resid 170  and name HG  ))
   (( segid "AREF" and resid 170  and name HN  ))
      3.000     1.100     1.100 peak  1167 spectrum    2 weight  0.10000E+01 volume  0.40098E-02 ppm1      1.640 ppm2      8.162 CV     1
 OR { 1167}
   (( segid "AREF" and resid 34   and name HG1 ))
   (( segid "AREF" and resid 34   and name HN  ))
 OR { 1167}
   (( segid "AREF" and resid 35   and name HG1 ))
   (( segid "AREF" and resid 35   and name HN  ))
 OR { 1167}
   (( segid "AREF" and resid 35   and name HG2 ))
   (( segid "AREF" and resid 35   and name HN  ))
 OR { 1167}
   (( segid "AREF" and resid 34   and name HG2 ))
   (( segid "AREF" and resid 34   and name HN  ))
 OR { 1167}
   (( segid "AREF" and resid 56   and name HG1 ))
   (( segid "AREF" and resid 56   and name HN  ))
 OR { 1167}
   (( segid "AREF" and resid 56   and name HG2 ))
   (( segid "AREF" and resid 56   and name HN  ))
 ASSI { 1168}
   (( segid "AREF" and resid 38   and name HG1 ))
   (( segid "AREF" and resid 39   and name HA2 ))
      3.000     1.100     1.100 peak  1168 spectrum    2 weight  0.10000E+01 volume  0.52271E-02 ppm1      1.637 ppm2      3.977 CV     1
 OR { 1168}
   (( segid "AREF" and resid 38   and name HG1 ))
   (( segid "AREF" and resid 39   and name HA1 ))
 OR { 1168}
   (( segid "AREF" and resid 38   and name HG2 ))
   (( segid "AREF" and resid 39   and name HA2 ))
 OR { 1168}
   (( segid "AREF" and resid 38   and name HG2 ))
   (( segid "AREF" and resid 39   and name HA1 ))
 OR { 1168}
   (( segid "AREF" and resid 31   and name HG1 ))
   (( segid "AREF" and resid 27   and name HA  ))
 OR { 1168}
   (( segid "AREF" and resid 51   and name HG1 ))
   (( segid "AREF" and resid 52   and name HA1 ))
 OR { 1168}
   (( segid "AREF" and resid 51   and name HG1 ))
   (( segid "AREF" and resid 52   and name HA2 ))
 ASSI { 1169}
   (( segid "AREF" and resid 35   and name HG2 ))
   (( segid "AREF" and resid 35   and name HD2 ))
      2.700     2.700     3.300 peak  1169 spectrum    2 weight  0.10000E+01 volume  0.24026E-02 ppm1      1.634 ppm2      3.195 CV     1
 OR { 1169}
   (( segid "AREF" and resid 43   and name HG1 ))
   (( segid "AREF" and resid 43   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 46   and name HG1 ))
   (( segid "AREF" and resid 46   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 44   and name HG1 ))
   (( segid "AREF" and resid 44   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 54   and name HG1 ))
   (( segid "AREF" and resid 54   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 54   and name HG2 ))
   (( segid "AREF" and resid 54   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 51   and name HG1 ))
   (( segid "AREF" and resid 51   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 34   and name HG1 ))
   (( segid "AREF" and resid 34   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 51   and name HG2 ))
   (( segid "AREF" and resid 51   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 38   and name HG1 ))
   (( segid "AREF" and resid 38   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 43   and name HG2 ))
   (( segid "AREF" and resid 43   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 46   and name HG2 ))
   (( segid "AREF" and resid 46   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 44   and name HG2 ))
   (( segid "AREF" and resid 44   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 35   and name HG2 ))
   (( segid "AREF" and resid 35   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 35   and name HG1 ))
   (( segid "AREF" and resid 35   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 44   and name HG1 ))
   (( segid "AREF" and resid 44   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 44   and name HG2 ))
   (( segid "AREF" and resid 44   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 35   and name HG1 ))
   (( segid "AREF" and resid 35   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 38   and name HG2 ))
   (( segid "AREF" and resid 38   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 34   and name HG2 ))
   (( segid "AREF" and resid 34   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 46   and name HG1 ))
   (( segid "AREF" and resid 46   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 51   and name HG2 ))
   (( segid "AREF" and resid 51   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 46   and name HG2 ))
   (( segid "AREF" and resid 46   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 51   and name HG1 ))
   (( segid "AREF" and resid 51   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 54   and name HG1 ))
   (( segid "AREF" and resid 54   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 54   and name HG2 ))
   (( segid "AREF" and resid 54   and name HD2 ))
 OR { 1169}
   (( segid "AREF" and resid 43   and name HG1 ))
   (( segid "AREF" and resid 43   and name HD1 ))
 OR { 1169}
   (( segid "AREF" and resid 43   and name HG2 ))
   (( segid "AREF" and resid 43   and name HD2 ))
 ASSI { 1170}
   (( segid "AREF" and resid 43   and name HG2 ))
   (( segid "AREF" and resid 43   and name HA  ))
      2.800     1.000     1.000 peak  1170 spectrum    2 weight  0.10000E+01 volume  0.26624E-02 ppm1      1.629 ppm2      4.334 CV     1
 OR { 1170}
   (( segid "AREF" and resid 43   and name HG1 ))
   (( segid "AREF" and resid 43   and name HA  ))
 OR { 1170}
   (( segid "AREF" and resid 54   and name HG2 ))
   (( segid "AREF" and resid 54   and name HA  ))
 OR { 1170}
   (( segid "AREF" and resid 12   and name HG2 ))
   (( segid "AREF" and resid 12   and name HA  ))
 ASSI { 1171}
   (( segid "AREF" and resid 43   and name HG1 ))
   (( segid "AREF" and resid 43   and name HB2 ))
      2.900     1.100     1.100 peak  1171 spectrum    2 weight  0.10000E+01 volume  0.18020E-02 ppm1      1.625 ppm2      1.842 CV     1
 OR { 1171}
   (( segid "AREF" and resid 12   and name HG1 ))
   (( segid "AREF" and resid 12   and name HB2 ))
 OR { 1171}
   (( segid "AREF" and resid 43   and name HG2 ))
   (( segid "AREF" and resid 43   and name HB2 ))
 OR { 1171}
   (( segid "AREF" and resid 12   and name HG2 ))
   (( segid "AREF" and resid 12   and name HB2 ))
 ASSI { 1172}
   (( segid "AREF" and resid 29   and name HG  ))
   (( segid "AREF" and resid 33   and name HN  ))
      3.100     3.100     2.900 peak  1172 spectrum    2 weight  0.10000E+01 volume  0.38312E-02 ppm1      1.608 ppm2      8.168 CV     1
 OR { 1172}
   (( segid "AREF" and resid 54   and name HG1 ))
   (( segid "AREF" and resid 56   and name HN  ))
 OR { 1172}
   (( segid "AREF" and resid 54   and name HG2 ))
   (( segid "AREF" and resid 56   and name HN  ))
 ASSI { 1178}
   (( segid "AREF" and resid 74   and name HG  ))
   (( segid "AREF" and resid 74   and name HN  ))
      3.100     1.200     1.200 peak  1178 spectrum    2 weight  0.10000E+01 volume  0.44643E-02 ppm1      1.467 ppm2      8.035 CV     1
 OR { 1178}
   (( segid "AREF" and resid 74   and name HG  ))
   (( segid "AREF" and resid 75   and name HN  ))
 ASSI { 1225}
   (( segid "AREF" and resid 144  and name HG2 ))
   (( segid "AREF" and resid 148  and name HN  ))
      2.600     0.900     0.900 peak  1225 spectrum    2 weight  0.10000E+01 volume  0.54869E-02 ppm1      1.503 ppm2      7.521 CV     1
 OR { 1225}
   (( segid "AREF" and resid 144  and name HG2 ))
   (( segid "AREF" and resid 145  and name HN  ))
 ASSI { 1249}
   (( segid "AREF" and resid 144  and name HG2 ))
   (( segid "AREF" and resid 148  and name HA  ))
      3.400     1.500     1.500 peak  1249 spectrum    2 weight  0.10000E+01 volume  0.44156E-02 ppm1      1.499 ppm2      3.914 CV     1
 OR { 1249}
   (( segid "AREF" and resid 28   and name HG2 ))
   (( segid "AREF" and resid 27   and name HA  ))
 ASSI { 1254}
   (( segid "AREF" and resid 28   and name HG1 ))
   (( segid "AREF" and resid 28   and name HB2 ))
      2.500     0.800     0.800 peak  1254 spectrum    2 weight  0.10000E+01 volume  0.32305E-02 ppm1      1.407 ppm2      1.870 CV     1
 OR { 1254}
   (( segid "AREF" and resid 18   and name HG1 ))
   (( segid "AREF" and resid 18   and name HB2 ))
 OR { 1254}
   (( segid "AREF" and resid 18   and name HG2 ))
   (( segid "AREF" and resid 18   and name HB2 ))
 OR { 1254}
   (( segid "AREF" and resid 28   and name HG1 ))
   (( segid "AREF" and resid 28   and name HB1 ))
 ASSI { 1269}
   (  segid "AREF" and resid 170  and name HD2%)
   (( segid "AREF" and resid 170  and name HG  ))
      2.700     0.900     0.900 peak  1269 spectrum    2 weight  0.10000E+01 volume  0.25325E-02 ppm1      0.829 ppm2      1.667 CV     1
 OR { 1269}
   (  segid "AREF" and resid 143  and name HD2%)
   (( segid "AREF" and resid 143  and name HG  ))
 OR { 1269}
   (  segid "AREF" and resid 143  and name HD2%)
   (( segid "AREF" and resid 143  and name HB2 ))
 ASSI { 1289}
   (( segid "AREF" and resid 28   and name HG1 ))
   (  segid "AREF" and resid 27   and name HG2%)
      3.400     1.400     1.400 peak  1289 spectrum    2 weight  0.10000E+01 volume  0.81009E-02 ppm1      1.405 ppm2      0.874 CV     1
 OR { 1289}
   (( segid "AREF" and resid 28   and name HG1 ))
   (  segid "AREF" and resid 29   and name HD1%)
 ASSI { 1299}
   (  segid "AREF" and resid 74   and name HD2%)
   (( segid "AREF" and resid 74   and name HG  ))
      2.600     0.900     0.900 peak  1299 spectrum    2 weight  0.10000E+01 volume  0.25325E-02 ppm1      0.827 ppm2      1.445 CV     1
 OR { 1299}
   (  segid "AREF" and resid 143  and name HD2%)
   (( segid "AREF" and resid 143  and name HB1 ))
 OR { 1299}
   (  segid "AREF" and resid 74   and name HD2%)
   (( segid "AREF" and resid 74   and name HB2 ))
 ASSI { 1321}
   (  segid "AREF" and resid 170  and name HD2%)
   (( segid "AREF" and resid 169  and name HB1 ))
      3.000     1.100     1.100 peak  1321 spectrum    2 weight  0.10000E+01 volume  0.35227E-02 ppm1      0.825 ppm2      2.621 CV     1
 OR { 1321}
   (  segid "AREF" and resid 74   and name HD2%)
   (( segid "AREF" and resid 73   and name HB2 ))
 OR { 1321}
   (  segid "AREF" and resid 74   and name HD2%)
   (( segid "AREF" and resid 73   and name HB1 ))
 ASSI { 1368}
   (  segid "AREF" and resid 129  and name HD2%)
   (  segid "AREF" and resid 120  and name HG1%)
      3.000     3.000     3.000 peak  1368 spectrum    2 weight  0.10000E+01 volume  0.25162E-02 ppm1      0.939 ppm2      0.730 CV     1
 OR { 1368}
   (  segid "AREF" and resid 129  and name HD2%)
   (  segid "AREF" and resid 93   and name HG2%)
 ASSI { 1387}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 143  and name HB2 ))
      2.500     0.800     0.800 peak  1387 spectrum    2 weight  0.10000E+01 volume  0.28409E-02 ppm1      0.777 ppm2      1.669 CV     1
 OR { 1387}
   (  segid "AREF" and resid 143  and name HD1%)
   (( segid "AREF" and resid 143  and name HG  ))
 OR { 1387}
   (  segid "AREF" and resid 170  and name HD1%)
   (( segid "AREF" and resid 170  and name HG  ))
 ASSI { 1399}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 141  and name HB1 ))
      3.200     3.200     2.800 peak  1399 spectrum    2 weight  0.10000E+01 volume  0.59090E-02 ppm1     -0.058 ppm2      2.836 CV     1
 OR { 1399}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 142  and name HA  ))
 ASSI { 1400}
   (  segid "AREF" and resid 115  and name HD1%)
   (( segid "AREF" and resid 91   and name HG  ))
      3.500     1.500     1.500 peak  1400 spectrum    2 weight  0.10000E+01 volume  0.44643E-02 ppm1     -0.058 ppm2      1.034 CV     1
 OR { 1400}
   (  segid "AREF" and resid 115  and name HD1%)
   (  segid "AREF" and resid 93   and name HG1%)
 ASSI { 1418}
   (  segid "AREF" and resid 132  and name HB% )
   (  segid "AREF" and resid 93   and name HG1%)
      2.900     2.900     3.100 peak  1418 spectrum    2 weight  0.10000E+01 volume  0.39773E-02 ppm1      0.917 ppm2      1.061 CV     1
 OR { 1418}
   (  segid "AREF" and resid 129  and name HD2%)
   (  segid "AREF" and resid 131  and name HG2%)
 ASSI { 1441}
   (  segid "AREF" and resid 89   and name HB% )
   (  segid "AREF" and resid 91   and name HD2%)
      3.700     1.700     1.700 peak  1441 spectrum    2 weight  0.10000E+01 volume  0.34091E-02 ppm1      1.238 ppm2      0.798 CV     1
 OR { 1441}
   (  segid "AREF" and resid 89   and name HB% )
   (  segid "AREF" and resid 91   and name HD1%)
 OR { 1441}
   (  segid "AREF" and resid 89   and name HB% )
   (  segid "AREF" and resid 164  and name HG1%)
 ASSI { 1455}
   (  segid "AREF" and resid 134  and name HG2%)
   (( segid "AREF" and resid 91   and name HB1 ))
      1.900     0.500     0.500 peak  1455 spectrum    2 weight  0.10000E+01 volume  0.38636E-02 ppm1      0.307 ppm2      1.632 CV     1
 OR { 1455}
   (  segid "AREF" and resid 134  and name HG2%)
   (( segid "AREF" and resid 134  and name HB  ))
 OR { 1455}
   (  segid "AREF" and resid 134  and name HG2%)
   (( segid "AREF" and resid 91   and name HB2 ))
 ASSI { 1467}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 91   and name HB2 ))
      3.200     1.300     1.300 peak  1467 spectrum    2 weight  0.10000E+01 volume  0.45617E-02 ppm1      1.225 ppm2      1.688 CV     1
 OR { 1467}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 91   and name HB1 ))
 OR { 1467}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 163  and name HB2 ))
 ASSI { 1469}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 137  and name HA  ))
      3.000     3.000     3.000 peak  1469 spectrum    2 weight  0.10000E+01 volume  0.33279E-02 ppm1      1.210 ppm2      4.096 CV     1
 OR { 1469}
   (  segid "AREF" and resid 89   and name HB% )
   (( segid "AREF" and resid 164  and name HA  ))
 ASSI { 1473}
   (  segid "AREF" and resid 93   and name HG1%)
   (( segid "AREF" and resid 93   and name HA  ))
      2.400     0.700     0.700 peak  1473 spectrum    2 weight  0.10000E+01 volume  0.41397E-02 ppm1      1.056 ppm2      4.964 CV     1
 OR { 1473}
   (  segid "AREF" and resid 93   and name HG1%)
   (( segid "AREF" and resid 92   and name HA  ))
 ASSI { 1483}
   (  segid "AREF" and resid 93   and name HG1%)
   (  segid "AREF" and resid 93   and name HG2%)
      2.400     0.700     0.700 peak  1483 spectrum    2 weight  0.10000E+01 volume  0.30195E-02 ppm1      1.057 ppm2      0.775 CV     1
 OR { 1483}
   (  segid "AREF" and resid 93   and name HG1%)
   (  segid "AREF" and resid 91   and name HD1%)
 ASSI { 1485}
   (  segid "AREF" and resid 93   and name HG1%)
   (( segid "AREF" and resid 92   and name HB2 ))
      3.400     1.400     1.400 peak  1485 spectrum    2 weight  0.10000E+01 volume  0.50975E-02 ppm1      1.052 ppm2      1.636 CV     1
 OR { 1485}
   (  segid "AREF" and resid 93   and name HG1%)
   (( segid "AREF" and resid 91   and name HB1 ))
 OR { 1485}
   (  segid "AREF" and resid 93   and name HG1%)
   (( segid "AREF" and resid 91   and name HB2 ))
 ASSI { 1500}
   (  segid "AREF" and resid 93   and name HG2%)
   (( segid "AREF" and resid 93   and name HA  ))
      2.900     1.000     1.000 peak  1500 spectrum    2 weight  0.10000E+01 volume  0.38474E-02 ppm1      0.746 ppm2      4.973 CV     1
 OR { 1500}
   (  segid "AREF" and resid 93   and name HG2%)
   (( segid "AREF" and resid 92   and name HA  ))
 ASSI { 1570}
   (  segid "AREF" and resid 85   and name HG2%)
   (( segid "AREF" and resid 117  and name HD1 ))
      2.100     2.100     3.900 peak  1570 spectrum    2 weight  0.10000E+01 volume  0.37500E-02 ppm1      0.887 ppm2      1.654 CV     1
 OR { 1570}
   (  segid "AREF" and resid 85   and name HG2%)
   (( segid "AREF" and resid 117  and name HD2 ))
 OR { 1570}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 117  and name HD1 ))
 OR { 1570}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 117  and name HD2 ))
 OR { 1570}
   (  segid "AREF" and resid 85   and name HG2%)
   (( segid "AREF" and resid 116  and name HB1 ))
 OR { 1570}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 116  and name HB1 ))
 OR { 1570}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 117  and name HB2 ))
 OR { 1570}
   (  segid "AREF" and resid 85   and name HG1%)
   (( segid "AREF" and resid 117  and name HB1 ))
 ASSI { 1584}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 108  and name HN  ))
      2.000     2.000     4.000 peak  1584 spectrum    2 weight  0.10000E+01 volume  0.69317E-02 ppm1      1.252 ppm2      7.598 CV     1
 OR { 1584}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 149  and name HN  ))
 ASSI { 1587}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 134  and name HB  ))
      2.100     0.600     0.600 peak  1587 spectrum    2 weight  0.10000E+01 volume  0.45130E-02 ppm1      1.254 ppm2      1.616 CV     1
 OR { 1587}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 115  and name HG  ))
 ASSI { 1595}
   (  segid "AREF" and resid 118  and name HB% )
   (  segid "AREF" and resid 93   and name HG1%)
      3.400     1.500     1.500 peak  1595 spectrum    2 weight  0.10000E+01 volume  0.71915E-02 ppm1      1.246 ppm2      1.042 CV     1
 OR { 1595}
   (  segid "AREF" and resid 118  and name HB% )
   (( segid "AREF" and resid 91   and name HG  ))
 ASSI { 1600}
   (  segid "AREF" and resid 145  and name HB% )
   (  segid "AREF" and resid 136  and name HE% )
      2.500     2.500     3.500 peak  1600 spectrum    2 weight  0.10000E+01 volume  0.38961E-02 ppm1      1.161 ppm2      7.277 CV     1
 OR { 1600}
   (  segid "AREF" and resid 145  and name HB% )
   (  segid "AREF" and resid 112  and name HE% )
 ASSI { 1608}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 145  and name HN  ))
      2.400     0.700     0.700 peak  1608 spectrum    2 weight  0.10000E+01 volume  0.34253E-02 ppm1      1.161 ppm2      7.537 CV     1
 OR { 1608}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 149  and name HN  ))
 ASSI { 1611}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 144  and name HA  ))
      3.200     3.200     2.800 peak  1611 spectrum    2 weight  0.10000E+01 volume  0.58117E-02 ppm1      1.157 ppm2      3.862 CV     1
 OR { 1611}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 150  and name HA  ))
 ASSI { 1617}
   (  segid "AREF" and resid 48   and name HB% )
   (( segid "AREF" and resid 48   and name HN  ))
      3.100     1.200     1.200 peak  1617 spectrum    2 weight  0.10000E+01 volume  0.34253E-02 ppm1      1.378 ppm2      8.352 CV     1
 OR { 1617}
   (  segid "AREF" and resid 165  and name HB% )
   (( segid "AREF" and resid 166  and name HN  ))
 ASSI { 1620}
   (  segid "AREF" and resid 165  and name HB% )
   (( segid "AREF" and resid 164  and name HA  ))
      3.500     1.500     1.500 peak  1620 spectrum    2 weight  0.10000E+01 volume  0.33604E-02 ppm1      1.375 ppm2      4.120 CV     1
 OR { 1620}
   (  segid "AREF" and resid 48   and name HB% )
   (( segid "AREF" and resid 49   and name HA  ))
 ASSI { 1621}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 91   and name HB2 ))
      3.200     1.300     1.300 peak  1621 spectrum    2 weight  0.10000E+01 volume  0.36688E-02 ppm1      1.155 ppm2      1.653 CV     1
 OR { 1621}
   (  segid "AREF" and resid 145  and name HB% )
   (( segid "AREF" and resid 163  and name HB2 ))
 ASSI { 1632}
   (  segid "AREF" and resid 142  and name HB% )
   (  segid "AREF" and resid 91   and name HD2%)
      3.700     1.700     1.700 peak  1632 spectrum    2 weight  0.10000E+01 volume  0.31981E-02 ppm1      1.148 ppm2      0.802 CV     1
 OR { 1632}
   (  segid "AREF" and resid 142  and name HB% )
   (  segid "AREF" and resid 143  and name HD1%)
 OR { 1632}
   (  segid "AREF" and resid 142  and name HB% )
   (  segid "AREF" and resid 143  and name HD2%)
 ASSI { 1673}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 113  and name HN  ))
      3.300     1.300     1.300 peak  1673 spectrum    2 weight  0.10000E+01 volume  0.49187E-02 ppm1      1.572 ppm2      7.494 CV     1
 OR { 1673}
   (  segid "AREF" and resid 110  and name HB% )
   (  segid "AREF" and resid 112  and name HD% )
 ASSI { 1676}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 111  and name HA  ))
      3.200     1.300     1.300 peak  1676 spectrum    2 weight  0.10000E+01 volume  0.39773E-02 ppm1      1.573 ppm2      4.005 CV     1
 OR { 1676}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 108  and name HA  ))
 ASSI { 1677}
   (  segid "AREF" and resid 110  and name HB% )
   (( segid "AREF" and resid 108  and name HB2 ))
      2.100     2.100     3.900 peak  1677 spectrum    2 weight  0.10000E+01 volume  0.38636E-02 ppm1      1.573 ppm2      1.383 CV     1
 OR { 1677}
   (  segid "AREF" and resid 110  and name HB% )
   (  segid "AREF" and resid 103  and name HB% )
 ASSI { 1688}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 26   and name HN  ))
      3.600     1.600     1.600 peak  1688 spectrum    2 weight  0.10000E+01 volume  0.36526E-02 ppm1      0.910 ppm2      7.936 CV     1
 OR { 1688}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 29   and name HN  ))
 ASSI { 1690}
   (  segid "AREF" and resid 27   and name HG2%)
   (( segid "AREF" and resid 27   and name HA  ))
      2.500     0.800     0.800 peak  1690 spectrum    2 weight  0.10000E+01 volume  0.32955E-02 ppm1      0.910 ppm2      3.924 CV     1
 OR { 1690}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 26   and name HA  ))
 ASSI { 1691}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 26   and name HG12))
      2.700     0.900     0.900 peak  1691 spectrum    2 weight  0.10000E+01 volume  0.35552E-02 ppm1      0.908 ppm2      1.230 CV     1
 OR { 1691}
   (  segid "AREF" and resid 27   and name HG2%)
   (( segid "AREF" and resid 27   and name HG11))
 ASSI { 1708}
   (  segid "AREF" and resid 15   and name HE% )
   (( segid "AREF" and resid 18   and name HG2 ))
      3.500     1.600     1.600 peak  1708 spectrum    2 weight  0.10000E+01 volume  0.32630E-02 ppm1      2.069 ppm2      1.439 CV     1
 OR { 1708}
   (  segid "AREF" and resid 15   and name HE% )
   (( segid "AREF" and resid 18   and name HG1 ))
 OR { 1708}
   (  segid "AREF" and resid 15   and name HE% )
   (  segid "AREF" and resid 16   and name HB% )
 ASSI { 1716}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 27   and name HN  ))
      3.300     1.300     1.300 peak  1716 spectrum    2 weight  0.10000E+01 volume  0.35390E-02 ppm1      0.909 ppm2      8.050 CV     1
 OR { 1716}
   (  segid "AREF" and resid 27   and name HG2%)
   (( segid "AREF" and resid 27   and name HN  ))
 ASSI { 1717}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 30   and name HB1 ))
      2.900     1.000     1.000 peak  1717 spectrum    2 weight  0.10000E+01 volume  0.55683E-02 ppm1      0.909 ppm2      2.866 CV     1
 OR { 1717}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 30   and name HB2 ))
 OR { 1717}
   (  segid "AREF" and resid 27   and name HG2%)
   (( segid "AREF" and resid 30   and name HB2 ))
 ASSI { 1718}
   (  segid "AREF" and resid 27   and name HG2%)
   (( segid "AREF" and resid 27   and name HB  ))
      2.400     0.700     0.700 peak  1718 spectrum    2 weight  0.10000E+01 volume  0.28734E-02 ppm1      0.909 ppm2      1.959 CV     1
 OR { 1718}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 26   and name HB  ))
 ASSI { 1719}
   (  segid "AREF" and resid 27   and name HG2%)
   (( segid "AREF" and resid 27   and name HG12))
      2.500     0.800     0.800 peak  1719 spectrum    2 weight  0.10000E+01 volume  0.31331E-02 ppm1      0.909 ppm2      1.595 CV     1
 OR { 1719}
   (  segid "AREF" and resid 26   and name HG2%)
   (( segid "AREF" and resid 26   and name HG11))
 ASSI { 1729}
   (  segid "AREF" and resid 10   and name HE% )
   (( segid "AREF" and resid 10   and name HG2 ))
      2.700     0.900     0.900 peak  1729 spectrum    2 weight  0.10000E+01 volume  0.37176E-02 ppm1      2.080 ppm2      2.606 CV     1
 OR { 1729}
   (  segid "AREF" and resid 15   and name HE% )
   (( segid "AREF" and resid 15   and name HG2 ))
 ASSI { 1776}
   (  segid "AREF" and resid 27   and name HD1%)
   (( segid "AREF" and resid 27   and name HB  ))
      2.500     0.800     0.800 peak  1776 spectrum    2 weight  0.10000E+01 volume  0.30357E-02 ppm1      0.857 ppm2      1.969 CV     1
 OR { 1776}
   (  segid "AREF" and resid 26   and name HD1%)
   (( segid "AREF" and resid 26   and name HB  ))
 ASSI { 1777}
   (  segid "AREF" and resid 27   and name HD1%)
   (( segid "AREF" and resid 27   and name HG12))
      2.400     0.700     0.700 peak  1777 spectrum    2 weight  0.10000E+01 volume  0.28572E-02 ppm1      0.857 ppm2      1.593 CV     1
 OR { 1777}
   (  segid "AREF" and resid 26   and name HD1%)
   (( segid "AREF" and resid 26   and name HG11))
 ASSI { 1778}
   (  segid "AREF" and resid 27   and name HD1%)
   (( segid "AREF" and resid 27   and name HG11))
      2.500     0.800     0.800 peak  1778 spectrum    2 weight  0.10000E+01 volume  0.29546E-02 ppm1      0.853 ppm2      1.198 CV     1
 OR { 1778}
   (  segid "AREF" and resid 26   and name HD1%)
   (( segid "AREF" and resid 26   and name HG12))
 OR { 1778}
   (  segid "AREF" and resid 49   and name HD1%)
   (( segid "AREF" and resid 49   and name HG12))
 ASSI { 1779}
   (  segid "AREF" and resid 49   and name HD1%)
   (( segid "AREF" and resid 49   and name HA  ))
      3.500     1.600     1.600 peak  1779 spectrum    2 weight  0.10000E+01 volume  0.45617E-02 ppm1      0.830 ppm2      4.132 CV     1
 OR { 1779}
   (  segid "AREF" and resid 168  and name HD1%)
   (( segid "AREF" and resid 168  and name HA  ))
 ASSI { 1785}
   (  segid "AREF" and resid 27   and name HD1%)
   (( segid "AREF" and resid 27   and name HN  ))
      3.000     1.200     1.200 peak  1785 spectrum    2 weight  0.10000E+01 volume  0.37500E-02 ppm1      0.855 ppm2      8.071 CV     1
 OR { 1785}
   (  segid "AREF" and resid 168  and name HD1%)
   (( segid "AREF" and resid 168  and name HN  ))
 ASSI { 1787}
   (  segid "AREF" and resid 26   and name HD1%)
   (( segid "AREF" and resid 26   and name HA  ))
      3.700     1.700     1.700 peak  1787 spectrum    2 weight  0.10000E+01 volume  0.35227E-02 ppm1      0.855 ppm2      3.931 CV     1
 OR { 1787}
   (  segid "AREF" and resid 27   and name HD1%)
   (( segid "AREF" and resid 27   and name HA  ))
 ASSI {   46}
   (( segid "AREF" and resid 118  and name HN  ))
   (  segid "AREF" and resid 118  and name HB% )
      2.900     1.100     1.100 peak    46 spectrum    3 weight  0.10000E+01 volume  0.24507E-02 ppm1      8.663 ppm2      1.255 CV     1
 OR {   46}
   (( segid "AREF" and resid 118  and name HN  ))
   (( segid "AREF" and resid 117  and name HG2 ))
 OR {   46}
   (( segid "AREF" and resid 118  and name HN  ))
   (( segid "AREF" and resid 117  and name HG1 ))
 ASSI {   88}
   (( segid "AREF" and resid 164  and name HN  ))
   (( segid "AREF" and resid 163  and name HB1 ))
      3.100     1.200     1.200 peak    88 spectrum    3 weight  0.10000E+01 volume  0.28340E-02 ppm1      8.622 ppm2      1.404 CV     1
 OR {   88}
   (( segid "AREF" and resid 164  and name HN  ))
   (  segid "AREF" and resid 165  and name HB% )
 ASSI {  109}
   (( segid "AREF" and resid 101  and name HN  ))
   (( segid "AREF" and resid 104  and name HN  ))
      2.800     1.000     1.000 peak   109 spectrum    3 weight  0.10000E+01 volume  0.65857E-02 ppm1      9.420 ppm2      7.529 CV     1
 OR {  109}
   (( segid "AREF" and resid 101  and name HN  ))
   (( segid "AREF" and resid 105  and name HN  ))
 ASSI {  113}
   (( segid "AREF" and resid 101  and name HN  ))
   (( segid "AREF" and resid 100  and name HA  ))
      2.500     0.800     0.800 peak   113 spectrum    3 weight  0.10000E+01 volume  0.24391E-02 ppm1      9.413 ppm2      3.982 CV     1
 OR {  113}
   (( segid "AREF" and resid 101  and name HN  ))
   (( segid "AREF" and resid 101  and name HB1 ))
 ASSI {  202}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 163  and name HA  ))
      2.600     0.900     0.900 peak   202 spectrum    3 weight  0.10000E+01 volume  0.65972E-02 ppm1      9.010 ppm2      4.734 CV     1
 OR {  202}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 162  and name HA  ))
 ASSI {  205}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 92   and name HA  ))
      2.600     0.800     0.800 peak   205 spectrum    3 weight  0.10000E+01 volume  0.32521E-02 ppm1      9.006 ppm2      4.967 CV     1
 OR {  205}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 161  and name HA  ))
 ASSI {  206}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 92   and name HG  ))
      2.500     0.800     0.800 peak   206 spectrum    3 weight  0.10000E+01 volume  0.29037E-02 ppm1      9.007 ppm2      1.628 CV     1
 OR {  206}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 92   and name HB2 ))
 OR {  206}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 91   and name HB2 ))
 ASSI {  207}
   (( segid "AREF" and resid 92   and name HN  ))
   (( segid "AREF" and resid 91   and name HG  ))
      3.000     3.000     3.000 peak   207 spectrum    3 weight  0.10000E+01 volume  0.58305E-02 ppm1      9.007 ppm2      1.060 CV     1
 OR {  207}
   (( segid "AREF" and resid 92   and name HN  ))
   (  segid "AREF" and resid 93   and name HG1%)
 ASSI {  228}
   (( segid "AREF" and resid 162  and name HN  ))
   (  segid "AREF" and resid 91   and name HD2%)
      3.000     1.100     1.100 peak   228 spectrum    3 weight  0.10000E+01 volume  0.26830E-02 ppm1      8.507 ppm2      0.857 CV     1
 OR {  228}
   (( segid "AREF" and resid 162  and name HN  ))
   (  segid "AREF" and resid 161  and name HG2%)
 ASSI {  256}
   (( segid "AREF" and resid 98   and name HN  ))
   (( segid "AREF" and resid 98   and name HA  ))
      3.100     1.200     1.200 peak   256 spectrum    3 weight  0.10000E+01 volume  0.23113E-02 ppm1      8.154 ppm2      4.391 CV     1
 OR {  256}
   (( segid "AREF" and resid 62   and name HN  ))
   (( segid "AREF" and resid 61   and name HA  ))
 ASSI {  266}
   (( segid "AREF" and resid 119  and name HN  ))
   (( segid "AREF" and resid 120  and name HN  ))
      3.500     1.500     1.500 peak   266 spectrum    3 weight  0.10000E+01 volume  0.43555E-02 ppm1      8.148 ppm2      9.212 CV     1
 OR {  266}
   (( segid "AREF" and resid 119  and name HN  ))
   (( segid "AREF" and resid 135  and name HN  ))
 ASSI {  323}
   (( segid "AREF" and resid 23   and name HN  ))
   (  segid "AREF" and resid 23   and name HD2%)
      3.600     1.600     1.600 peak   323 spectrum    3 weight  0.10000E+01 volume  0.40187E-02 ppm1      8.376 ppm2      0.872 CV     1
 OR {  323}
   (( segid "AREF" and resid 23   and name HN  ))
   (  segid "AREF" and resid 26   and name HD1%)
 ASSI {  336}
   (( segid "AREF" and resid 134  and name HN  ))
   (( segid "AREF" and resid 92   and name HA  ))
      2.900     1.000     1.000 peak   336 spectrum    3 weight  0.10000E+01 volume  0.42510E-02 ppm1      8.217 ppm2      4.964 CV     1
 OR {  336}
   (( segid "AREF" and resid 134  and name HN  ))
   (( segid "AREF" and resid 90   and name HA  ))
 ASSI {  354}
   (( segid "AREF" and resid 170  and name HN  ))
   (( segid "AREF" and resid 169  and name HN  ))
      2.600     0.900     0.900 peak   354 spectrum    3 weight  0.10000E+01 volume  0.23462E-02 ppm1      8.137 ppm2      8.238 CV     1
 OR {  354}
   (( segid "AREF" and resid 170  and name HN  ))
   (( segid "AREF" and resid 171  and name HN  ))
 ASSI {  390}
   (( segid "AREF" and resid 150  and name HN  ))
   (( segid "AREF" and resid 147  and name HA  ))
      2.600     2.600     3.400 peak   390 spectrum    3 weight  0.10000E+01 volume  0.36354E-02 ppm1      8.274 ppm2      3.936 CV     1
 OR {  390}
   (( segid "AREF" and resid 150  and name HN  ))
   (( segid "AREF" and resid 148  and name HA  ))
 ASSI {  391}
   (( segid "AREF" and resid 127  and name HN  ))
   (( segid "AREF" and resid 127  and name HB1 ))
      3.200     1.300     1.300 peak   391 spectrum    3 weight  0.10000E+01 volume  0.21952E-02 ppm1      8.264 ppm2      1.813 CV     1
 OR {  391}
   (( segid "AREF" and resid 127  and name HN  ))
   (( segid "AREF" and resid 127  and name HB2 ))
 OR {  391}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 64   and name HB2 ))
 OR {  391}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 63   and name HB2 ))
 OR {  391}
   (( segid "AREF" and resid 150  and name HN  ))
   (( segid "AREF" and resid 150  and name HG1 ))
 ASSI {  416}
   (( segid "AREF" and resid 127  and name HN  ))
   (( segid "AREF" and resid 126  and name HA1 ))
      2.800     1.000     1.000 peak   416 spectrum    3 weight  0.10000E+01 volume  0.51688E-02 ppm1      8.261 ppm2      3.549 CV     1
 OR {  416}
   (( segid "AREF" and resid 64   and name HN  ))
   (( segid "AREF" and resid 65   and name HD1 ))
 ASSI {  425}
   (( segid "AREF" and resid 110  and name HN  ))
   (( segid "AREF" and resid 110  and name HA  ))
      2.900     1.100     1.100 peak   425 spectrum    3 weight  0.10000E+01 volume  0.25785E-02 ppm1      8.478 ppm2      4.412 CV     1
 OR {  425}
   (( segid "AREF" and resid 167  and name HN  ))
   (( segid "AREF" and resid 166  and name HA  ))
 ASSI {  427}
   (( segid "AREF" and resid 167  and name HN  ))
   (( segid "AREF" and resid 167  and name HB2 ))
      2.600     0.800     0.800 peak   427 spectrum    3 weight  0.10000E+01 volume  0.65505E-02 ppm1      8.461 ppm2      2.066 CV     1
 OR {  427}
   (( segid "AREF" and resid 37   and name HN  ))
   (( segid "AREF" and resid 36   and name HB  ))
 ASSI {  441}
   (( segid "AREF" and resid 145  and name HN  ))
   (( segid "AREF" and resid 144  and name HA  ))
      2.800     1.000     1.000 peak   441 spectrum    3 weight  0.10000E+01 volume  0.37515E-02 ppm1      7.532 ppm2      3.841 CV     1
 OR {  441}
   (( segid "AREF" and resid 145  and name HN  ))
   (( segid "AREF" and resid 146  and name HA  ))
 ASSI {  451}
   (( segid "AREF" and resid 97   and name HN  ))
   (( segid "AREF" and resid 97   and name HA  ))
      2.900     1.000     1.000 peak   451 spectrum    3 weight  0.10000E+01 volume  0.27991E-02 ppm1      9.320 ppm2      4.161 CV     1
 OR {  451}
   (( segid "AREF" and resid 97   and name HN  ))
   (( segid "AREF" and resid 96   and name HA  ))
 ASSI {  486}
   (( segid "AREF" and resid 35   and name HN  ))
   (( segid "AREF" and resid 34   and name HA  ))
      2.800     1.000     1.000 peak   486 spectrum    3 weight  0.10000E+01 volume  0.25552E-02 ppm1      8.199 ppm2      4.297 CV     1
 OR {  486}
   (( segid "AREF" and resid 35   and name HN  ))
   (( segid "AREF" and resid 35   and name HA  ))
 ASSI {  487}
   (( segid "AREF" and resid 35   and name HN  ))
   (( segid "AREF" and resid 34   and name HB2 ))
      3.200     1.200     1.200 peak   487 spectrum    3 weight  0.10000E+01 volume  0.25088E-02 ppm1      8.199 ppm2      1.793 CV     1
 OR {  487}
   (( segid "AREF" and resid 35   and name HN  ))
   (( segid "AREF" and resid 35   and name HB1 ))
 OR {  487}
   (( segid "AREF" and resid 35   and name HN  ))
   (( segid "AREF" and resid 34   and name HB1 ))
 ASSI {  489}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 26   and name HN  ))
      2.500     0.800     0.800 peak   489 spectrum    3 weight  0.10000E+01 volume  0.22997E-02 ppm1      8.053 ppm2      7.908 CV     1
 OR {  489}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 28   and name HN  ))
 ASSI {  491}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 27   and name HA  ))
      2.700     0.900     0.900 peak   491 spectrum    3 weight  0.10000E+01 volume  0.24507E-02 ppm1      8.053 ppm2      3.921 CV     1
 OR {  491}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 26   and name HA  ))
 ASSI {  495}
   (( segid "AREF" and resid 27   and name HN  ))
   (  segid "AREF" and resid 27   and name HD1%)
      3.400     1.500     1.500 peak   495 spectrum    3 weight  0.10000E+01 volume  0.24507E-02 ppm1      8.053 ppm2      0.885 CV     1
 OR {  495}
   (( segid "AREF" and resid 27   and name HN  ))
   (  segid "AREF" and resid 26   and name HG2%)
 OR {  495}
   (( segid "AREF" and resid 27   and name HN  ))
   (  segid "AREF" and resid 27   and name HG2%)
 ASSI {  500}
   (( segid "AREF" and resid 10   and name HN  ))
   (( segid "AREF" and resid 10   and name HB1 ))
      3.000     1.200     1.200 peak   500 spectrum    3 weight  0.10000E+01 volume  0.41000E-02 ppm1      8.384 ppm2      2.007 CV     1
 OR {  500}
   (( segid "AREF" and resid 10   and name HN  ))
   (( segid "AREF" and resid 9    and name HB1 ))
 ASSI {  517}
   (( segid "AREF" and resid 142  and name HN  ))
   (( segid "AREF" and resid 142  and name HA  ))
      2.800     1.000     1.000 peak   517 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      6.671 ppm2      2.824 CV     1
 OR {  517}
   (( segid "AREF" and resid 142  and name HN  ))
   (( segid "AREF" and resid 141  and name HB1 ))
 ASSI {  536}
   (( segid "AREF" and resid 9    and name HN  ))
   (( segid "AREF" and resid 9    and name HA  ))
      2.900     1.000     1.000 peak   536 spectrum    3 weight  0.10000E+01 volume  0.31708E-02 ppm1      8.464 ppm2      4.318 CV     1
 OR {  536}
   (( segid "AREF" and resid 9    and name HN  ))
   (( segid "AREF" and resid 8    and name HA  ))
 ASSI {  537}
   (( segid "AREF" and resid 9    and name HN  ))
   (( segid "AREF" and resid 8    and name HB1 ))
      2.600     0.800     0.800 peak   537 spectrum    3 weight  0.10000E+01 volume  0.40768E-02 ppm1      8.465 ppm2      1.986 CV     1
 OR {  537}
   (( segid "AREF" and resid 9    and name HN  ))
   (( segid "AREF" and resid 9    and name HB1 ))
 ASSI {  551}
   (( segid "AREF" and resid 94   and name HN  ))
   (  segid "AREF" and resid 93   and name HG1%)
      3.600     1.600     1.600 peak   551 spectrum    3 weight  0.10000E+01 volume  0.27643E-02 ppm1      9.507 ppm2      1.042 CV     1
 OR {  551}
   (( segid "AREF" and resid 94   and name HN  ))
   (  segid "AREF" and resid 131  and name HG2%)
 ASSI {  557}
   (( segid "AREF" and resid 123  and name HN  ))
   (( segid "AREF" and resid 122  and name HB2 ))
      2.600     0.800     0.800 peak   557 spectrum    3 weight  0.10000E+01 volume  0.31011E-02 ppm1      8.983 ppm2      2.758 CV     1
 OR {  557}
   (( segid "AREF" and resid 123  and name HN  ))
   (( segid "AREF" and resid 123  and name HB2 ))
 OR {  557}
   (( segid "AREF" and resid 123  and name HN  ))
   (( segid "AREF" and resid 122  and name HB1 ))
 ASSI {  564}
   (( segid "AREF" and resid 43   and name HN  ))
   (( segid "AREF" and resid 43   and name HB2 ))
      2.800     1.000     1.000 peak   564 spectrum    3 weight  0.10000E+01 volume  0.30314E-02 ppm1      8.414 ppm2      1.849 CV     1
 OR {  564}
   (( segid "AREF" and resid 43   and name HN  ))
   (( segid "AREF" and resid 42   and name HB2 ))
 ASSI {  572}
   (( segid "AREF" and resid 20   and name HN  ))
   (( segid "AREF" and resid 20   and name HB1 ))
      3.500     1.500     1.500 peak   572 spectrum    3 weight  0.10000E+01 volume  0.26249E-02 ppm1      8.285 ppm2      2.600 CV     1
 OR {  572}
   (( segid "AREF" and resid 20   and name HN  ))
   (( segid "AREF" and resid 19   and name HG2 ))
 ASSI {  581}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 105  and name HN  ))
      2.600     0.800     0.800 peak   581 spectrum    3 weight  0.10000E+01 volume  0.28340E-02 ppm1      8.620 ppm2      7.540 CV     1
 OR {  581}
   (( segid "AREF" and resid 106  and name HN  ))
   (( segid "AREF" and resid 108  and name HN  ))
 ASSI {  590}
   (( segid "AREF" and resid 137  and name HN  ))
   (( segid "AREF" and resid 116  and name HB2 ))
      2.900     1.100     1.100 peak   590 spectrum    3 weight  0.10000E+01 volume  0.34147E-02 ppm1      8.149 ppm2      1.663 CV     1
 OR {  590}
   (( segid "AREF" and resid 34   and name HN  ))
   (( segid "AREF" and resid 34   and name HG1 ))
 OR {  590}
   (( segid "AREF" and resid 34   and name HN  ))
   (( segid "AREF" and resid 34   and name HG2 ))
 ASSI {  595}
   (( segid "AREF" and resid 29   and name HN  ))
   (( segid "AREF" and resid 30   and name HN  ))
      2.500     0.800     0.800 peak   595 spectrum    3 weight  0.10000E+01 volume  0.28921E-02 ppm1      7.969 ppm2      8.244 CV     1
 OR {  595}
   (( segid "AREF" and resid 29   and name HN  ))
   (( segid "AREF" and resid 31   and name HN  ))
 ASSI {  600}
   (( segid "AREF" and resid 29   and name HN  ))
   (( segid "AREF" and resid 28   and name HB2 ))
      2.800     1.000     1.000 peak   600 spectrum    3 weight  0.10000E+01 volume  0.21371E-02 ppm1      7.966 ppm2      1.832 CV     1
 OR {  600}
   (( segid "AREF" and resid 71   and name HN  ))
   (( segid "AREF" and resid 71   and name HB1 ))
 OR {  600}
   (( segid "AREF" and resid 29   and name HN  ))
   (( segid "AREF" and resid 28   and name HB1 ))
 ASSI {  610}
   (( segid "AREF" and resid 106  and name HN  ))
   (  segid "AREF" and resid 105  and name HD1%)
      3.600     1.600     1.600 peak   610 spectrum    3 weight  0.10000E+01 volume  0.34612E-02 ppm1      8.623 ppm2      0.725 CV     1
 OR {  610}
   (( segid "AREF" and resid 106  and name HN  ))
   (  segid "AREF" and resid 120  and name HG1%)
 ASSI {  618}
   (( segid "AREF" and resid 27   and name HN  ))
   (( segid "AREF" and resid 26   and name HB  ))
      2.100     0.600     0.600 peak   618 spectrum    3 weight  0.10000E+01 volume  0.38445E-02 ppm1      8.052 ppm2      1.988 CV     1
 OR {  618}
   (( segid "AREF" and resid 168  and name HN  ))
   (( segid "AREF" and resid 167  and name HB1 ))
 ASSI {  620}
   (( segid "AREF" and resid 168  and name HN  ))
   (  segid "AREF" and resid 168  and name HG2%)
      3.200     1.300     1.300 peak   620 spectrum    3 weight  0.10000E+01 volume  0.28804E-02 ppm1      8.051 ppm2      0.831 CV     1
 OR {  620}
   (( segid "AREF" and resid 27   and name HN  ))
   (  segid "AREF" and resid 27   and name HD1%)
 OR {  620}
   (( segid "AREF" and resid 168  and name HN  ))
   (  segid "AREF" and resid 168  and name HD1%)
 ASSI {  621}
   (( segid "AREF" and resid 168  and name HN  ))
   (( segid "AREF" and resid 167  and name HN  ))
      2.600     0.900     0.900 peak   621 spectrum    3 weight  0.10000E+01 volume  0.65625E-02 ppm1      8.050 ppm2      8.471 CV     1
 OR {  621}
   (( segid "AREF" and resid 36   and name HN  ))
   (( segid "AREF" and resid 37   and name HN  ))
 ASSI {  630}
   (( segid "AREF" and resid 51   and name HN  ))
   (( segid "AREF" and resid 51   and name HA  ))
      3.000     1.100     1.100 peak   630 spectrum    3 weight  0.10000E+01 volume  0.24391E-02 ppm1      8.293 ppm2      4.342 CV     1
 OR {  630}
   (( segid "AREF" and resid 51   and name HN  ))
   (( segid "AREF" and resid 50   and name HA  ))
 ASSI {  636}
   (( segid "AREF" and resid 21   and name HN  ))
   (( segid "AREF" and resid 20   and name HB2 ))
      2.700     0.900     0.900 peak   636 spectrum    3 weight  0.10000E+01 volume  0.36122E-02 ppm1      8.143 ppm2      2.726 CV     1
 OR {  636}
   (( segid "AREF" and resid 137  and name HN  ))
   (( segid "AREF" and resid 136  and name HB2 ))
 OR {  636}
   (( segid "AREF" and resid 137  and name HN  ))
   (( segid "AREF" and resid 136  and name HB1 ))
 ASSI {  637}
   (( segid "AREF" and resid 21   and name HN  ))
   (( segid "AREF" and resid 20   and name HB1 ))
      3.400     1.500     1.500 peak   637 spectrum    3 weight  0.10000E+01 volume  0.29037E-02 ppm1      8.145 ppm2      2.593 CV     1
 OR {  637}
   (( segid "AREF" and resid 21   and name HN  ))
   (( segid "AREF" and resid 21   and name HG1 ))
 OR {  637}
   (( segid "AREF" and resid 21   and name HN  ))
   (( segid "AREF" and resid 21   and name HG2 ))
 ASSI {  638}
   (( segid "AREF" and resid 34   and name HN  ))
   (( segid "AREF" and resid 33   and name HB1 ))
      2.900     1.100     1.100 peak   638 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      8.146 ppm2      2.119 CV     1
 OR {  638}
   (( segid "AREF" and resid 21   and name HN  ))
   (( segid "AREF" and resid 21   and name HB2 ))
 ASSI {  639}
   (( segid "AREF" and resid 34   and name HN  ))
   (( segid "AREF" and resid 33   and name HB2 ))
      3.400     1.400     1.400 peak   639 spectrum    3 weight  0.10000E+01 volume  0.24507E-02 ppm1      8.145 ppm2      1.995 CV     1
 OR {  639}
   (( segid "AREF" and resid 21   and name HN  ))
   (( segid "AREF" and resid 21   and name HB1 ))
 ASSI {  683}
   (( segid "AREF" and resid 19   and name HN  ))
   (( segid "AREF" and resid 17   and name HA  ))
      3.000     1.100     1.100 peak   683 spectrum    3 weight  0.10000E+01 volume  0.58772E-02 ppm1      8.251 ppm2      4.590 CV     1
 OR {  683}
   (( segid "AREF" and resid 19   and name HN  ))
   (( segid "AREF" and resid 20   and name HA  ))
 ASSI {  686}
   (( segid "AREF" and resid 19   and name HN  ))
   (( segid "AREF" and resid 17   and name HB1 ))
      2.900     1.000     1.000 peak   686 spectrum    3 weight  0.10000E+01 volume  0.36006E-02 ppm1      8.248 ppm2      2.597 CV     1
 OR {  686}
   (( segid "AREF" and resid 19   and name HN  ))
   (( segid "AREF" and resid 19   and name HG2 ))
 ASSI {  688}
   (( segid "AREF" and resid 19   and name HN  ))
   (( segid "AREF" and resid 21   and name HB1 ))
      3.700     1.700     1.700 peak   688 spectrum    3 weight  0.10000E+01 volume  0.26830E-02 ppm1      8.249 ppm2      2.022 CV     1
 OR {  688}
   (( segid "AREF" and resid 54   and name HN  ))
   (( segid "AREF" and resid 57   and name HG1 ))
 ASSI {  693}
   (( segid "AREF" and resid 36   and name HN  ))
   (( segid "AREF" and resid 36   and name HA  ))
      3.000     1.100     1.100 peak   693 spectrum    3 weight  0.10000E+01 volume  0.21371E-02 ppm1      8.065 ppm2      4.337 CV     1
 OR {  693}
   (( segid "AREF" and resid 12   and name HN  ))
   (( segid "AREF" and resid 12   and name HA  ))
 OR {  693}
   (( segid "AREF" and resid 168  and name HN  ))
   (( segid "AREF" and resid 167  and name HA  ))
 ASSI {  725}
   (( segid "AREF" and resid 31   and name HN  ))
   (( segid "AREF" and resid 30   and name HB1 ))
      2.900     1.000     1.000 peak   725 spectrum    3 weight  0.10000E+01 volume  0.33683E-02 ppm1      8.198 ppm2      2.842 CV     1
 OR {  725}
   (( segid "AREF" and resid 31   and name HN  ))
   (( segid "AREF" and resid 30   and name HB2 ))
 OR {  725}
   (( segid "AREF" and resid 31   and name HN  ))
   (( segid "AREF" and resid 32   and name HB2 ))
 ASSI {  728}
   (( segid "AREF" and resid 31   and name HN  ))
   (( segid "AREF" and resid 31   and name HA  ))
      2.800     1.000     1.000 peak   728 spectrum    3 weight  0.10000E+01 volume  0.31360E-02 ppm1      8.197 ppm2      4.198 CV     1
 OR {  728}
   (( segid "AREF" and resid 103  and name HN  ))
   (( segid "AREF" and resid 102  and name HA  ))
 ASSI {  730}
   (( segid "AREF" and resid 12   and name HN  ))
   (( segid "AREF" and resid 11   and name HN  ))
      3.000     1.100     1.100 peak   730 spectrum    3 weight  0.10000E+01 volume  0.36819E-02 ppm1      8.067 ppm2      8.454 CV     1
 OR {  730}
   (( segid "AREF" and resid 36   and name HN  ))
   (( segid "AREF" and resid 37   and name HN  ))
 OR {  730}
   (( segid "AREF" and resid 12   and name HN  ))
   (( segid "AREF" and resid 13   and name HN  ))
 ASSI {  733}
   (( segid "AREF" and resid 12   and name HN  ))
   (( segid "AREF" and resid 12   and name HB2 ))
      3.200     1.300     1.300 peak   733 spectrum    3 weight  0.10000E+01 volume  0.25785E-02 ppm1      8.067 ppm2      1.820 CV     1
 OR {  733}
   (( segid "AREF" and resid 36   and name HN  ))
   (( segid "AREF" and resid 35   and name HB2 ))
 ASSI {  759}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 69   and name HB2 ))
      2.800     1.000     1.000 peak   759 spectrum    3 weight  0.10000E+01 volume  0.24042E-02 ppm1      8.087 ppm2      1.636 CV     1
 OR {  759}
   (( segid "AREF" and resid 12   and name HN  ))
   (( segid "AREF" and resid 12   and name HG1 ))
 OR {  759}
   (( segid "AREF" and resid 69   and name HN  ))
   (( segid "AREF" and resid 69   and name HB1 ))
 ASSI {  771}
   (( segid "AREF" and resid 8    and name HN  ))
   (( segid "AREF" and resid 8    and name HA  ))
      3.100     1.200     1.200 peak   771 spectrum    3 weight  0.10000E+01 volume  0.22300E-02 ppm1      8.272 ppm2      4.353 CV     1
 OR {  771}
   (( segid "AREF" and resid 68   and name HN  ))
   (( segid "AREF" and resid 67   and name HA  ))
 ASSI {  780}
   (( segid "AREF" and resid 68   and name HN  ))
   (( segid "AREF" and resid 67   and name HG1 ))
      2.500     0.800     0.800 peak   780 spectrum    3 weight  0.10000E+01 volume  0.36586E-02 ppm1      8.273 ppm2      1.977 CV     1
 OR {  780}
   (( segid "AREF" and resid 8    and name HN  ))
   (( segid "AREF" and resid 8    and name HB1 ))
 OR {  780}
   (( segid "AREF" and resid 68   and name HN  ))
   (( segid "AREF" and resid 67   and name HG2 ))
 ASSI {  790}
   (( segid "AREF" and resid 144  and name HN  ))
   (( segid "AREF" and resid 143  and name HB2 ))
      3.600     1.600     1.600 peak   790 spectrum    3 weight  0.10000E+01 volume  0.25785E-02 ppm1      7.289 ppm2      1.662 CV     1
 OR {  790}
   (( segid "AREF" and resid 144  and name HN  ))
   (( segid "AREF" and resid 143  and name HG  ))
 OR {  790}
   (( segid "AREF" and resid 144  and name HN  ))
   (( segid "AREF" and resid 144  and name HG1 ))
 ASSI {  794}
   (( segid "AREF" and resid 144  and name HN  ))
   (  segid "AREF" and resid 145  and name HB% )
      3.500     1.500     1.500 peak   794 spectrum    3 weight  0.10000E+01 volume  0.39142E-02 ppm1      7.288 ppm2      1.138 CV     1
 OR {  794}
   (( segid "AREF" and resid 144  and name HN  ))
   (  segid "AREF" and resid 142  and name HB% )
 ASSI {  805}
   (( segid "AREF" and resid 103  and name HN  ))
   (( segid "AREF" and resid 102  and name HA  ))
      3.200     1.300     1.300 peak   805 spectrum    3 weight  0.10000E+01 volume  0.23229E-02 ppm1      8.194 ppm2      4.188 CV     1
 OR {  805}
   (( segid "AREF" and resid 171  and name HN  ))
   (( segid "AREF" and resid 170  and name HA  ))
 ASSI {  806}
   (( segid "AREF" and resid 171  and name HN  ))
   (( segid "AREF" and resid 171  and name HA  ))
      2.700     0.900     0.900 peak   806 spectrum    3 weight  0.10000E+01 volume  0.24275E-02 ppm1      8.194 ppm2      4.122 CV     1
 OR {  806}
   (( segid "AREF" and resid 103  and name HN  ))
   (( segid "AREF" and resid 102  and name HA  ))
 ASSI {  831}
   (( segid "AREF" and resid 132  and name HN  ))
   (( segid "AREF" and resid 132  and name HA  ))
      2.600     0.900     0.900 peak   831 spectrum    3 weight  0.10000E+01 volume  0.28921E-02 ppm1      9.148 ppm2      4.302 CV     1
 OR {  831}
   (( segid "AREF" and resid 132  and name HN  ))
   (( segid "AREF" and resid 131  and name HB  ))
 ASSI {  856}
   (( segid "AREF" and resid 45   and name HN  ))
   (( segid "AREF" and resid 44   and name HA  ))
      2.500     0.800     0.800 peak   856 spectrum    3 weight  0.10000E+01 volume  0.46343E-02 ppm1      8.459 ppm2      4.321 CV     1
 OR {  856}
   (( segid "AREF" and resid 55   and name HN  ))
   (( segid "AREF" and resid 54   and name HA  ))
 ASSI {  868}
   (( segid "AREF" and resid 60   and name HN  ))
   (( segid "AREF" and resid 59   and name HA  ))
      3.300     1.400     1.400 peak   868 spectrum    3 weight  0.10000E+01 volume  0.24391E-02 ppm1      8.011 ppm2      4.354 CV     1
 OR {  868}
   (( segid "AREF" and resid 60   and name HN  ))
   (( segid "AREF" and resid 61   and name HA  ))
 ASSI {  920}
   (( segid "AREF" and resid 30   and name HN  ))
   (( segid "AREF" and resid 29   and name HA  ))
      3.000     1.100     1.100 peak   920 spectrum    3 weight  0.10000E+01 volume  0.29153E-02 ppm1      8.251 ppm2      4.223 CV     1
 OR {  920}
   (( segid "AREF" and resid 30   and name HN  ))
   (( segid "AREF" and resid 31   and name HA  ))
 ASSI {  925}
   (( segid "AREF" and resid 79   and name HN  ))
   (( segid "AREF" and resid 79   and name HA  ))
      2.900     1.100     1.100 peak   925 spectrum    3 weight  0.10000E+01 volume  0.25552E-02 ppm1      8.141 ppm2      4.547 CV     1
 OR {  925}
   (( segid "AREF" and resid 17   and name HN  ))
   (( segid "AREF" and resid 17   and name HA  ))
 ASSI {  926}
   (( segid "AREF" and resid 17   and name HN  ))
   (( segid "AREF" and resid 16   and name HA  ))
      2.800     1.000     1.000 peak   926 spectrum    3 weight  0.10000E+01 volume  0.24159E-02 ppm1      8.139 ppm2      4.230 CV     1
 OR {  926}
   (( segid "AREF" and resid 24   and name HN  ))
   (( segid "AREF" and resid 23   and name HA  ))
 ASSI {  934}
   (( segid "AREF" and resid 24   and name HN  ))
   (  segid "AREF" and resid 27   and name HD1%)
      3.300     1.400     1.400 peak   934 spectrum    3 weight  0.10000E+01 volume  0.36586E-02 ppm1      8.132 ppm2      0.858 CV     1
 OR {  934}
   (( segid "AREF" and resid 24   and name HN  ))
   (  segid "AREF" and resid 23   and name HD2%)
 ASSI {  945}
   (( segid "AREF" and resid 32   and name HN  ))
   (( segid "AREF" and resid 31   and name HA  ))
      3.100     1.200     1.200 peak   945 spectrum    3 weight  0.10000E+01 volume  0.32173E-02 ppm1      8.292 ppm2      4.206 CV     1
 OR {  945}
   (( segid "AREF" and resid 32   and name HN  ))
   (( segid "AREF" and resid 33   and name HA  ))
 ASSI {  969}
   (( segid "AREF" and resid 22   and name HN  ))
   (( segid "AREF" and resid 22   and name HA  ))
      3.000     1.100     1.100 peak   969 spectrum    3 weight  0.10000E+01 volume  0.22997E-02 ppm1      8.674 ppm2      4.511 CV     1
 OR {  969}
   (( segid "AREF" and resid 22   and name HN  ))
   (( segid "AREF" and resid 21   and name HA  ))
 ASSI {  986}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 106  and name HB1 ))
      3.300     1.400     1.400 peak   986 spectrum    3 weight  0.10000E+01 volume  0.41000E-02 ppm1      7.530 ppm2      2.157 CV     1
 OR {  986}
   (( segid "AREF" and resid 105  and name HN  ))
   (( segid "AREF" and resid 106  and name HB1 ))
 OR {  986}
   (( segid "AREF" and resid 105  and name HN  ))
   (( segid "AREF" and resid 106  and name HB2 ))
 OR {  986}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 106  and name HB2 ))
 ASSI {  992}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 103  and name HA  ))
      3.300     1.300     1.300 peak   992 spectrum    3 weight  0.10000E+01 volume  0.26481E-02 ppm1      7.526 ppm2      4.038 CV     1
 OR {  992}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 101  and name HB1 ))
 ASSI { 1007}
   (( segid "AREF" and resid 105  and name HN  ))
   (  segid "AREF" and resid 93   and name HG1%)
      3.700     3.700     2.300 peak  1007 spectrum    3 weight  0.10000E+01 volume  0.52150E-02 ppm1      7.550 ppm2      1.081 CV     1
 OR { 1007}
   (( segid "AREF" and resid 108  and name HN  ))
   (  segid "AREF" and resid 93   and name HG1%)
 ASSI { 1012}
   (( segid "AREF" and resid 105  and name HN  ))
   (( segid "AREF" and resid 108  and name HB1 ))
      3.800     1.800     1.800 peak  1012 spectrum    3 weight  0.10000E+01 volume  0.25901E-02 ppm1      7.533 ppm2      1.523 CV     1
 OR { 1012}
   (( segid "AREF" and resid 104  and name HN  ))
   (( segid "AREF" and resid 108  and name HB1 ))
 ASSI { 1013}
   (( segid "AREF" and resid 105  and name HN  ))
   (  segid "AREF" and resid 118  and name HB% )
      3.600     3.600     2.400 peak  1013 spectrum    3 weight  0.10000E+01 volume  0.37515E-02 ppm1      7.533 ppm2      1.272 CV     1
 OR { 1013}
   (( segid "AREF" and resid 104  and name HN  ))
   (  segid "AREF" and resid 118  and name HB% )
 ASSI { 1019}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 148  and name HN  ))
      2.300     0.600     0.600 peak  1019 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      7.771 ppm2      7.548 CV     1
 OR { 1019}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 145  and name HN  ))
 ASSI { 1023}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 144  and name HA  ))
      2.700     0.900     0.900 peak  1023 spectrum    3 weight  0.10000E+01 volume  0.29153E-02 ppm1      7.768 ppm2      3.829 CV     1
 OR { 1023}
   (( segid "AREF" and resid 147  and name HN  ))
   (( segid "AREF" and resid 146  and name HA  ))
 ASSI { 1029}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 117  and name HA  ))
      2.700     0.900     0.900 peak  1029 spectrum    3 weight  0.10000E+01 volume  0.31127E-02 ppm1      7.406 ppm2      4.254 CV     1
 OR { 1029}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 116  and name HA  ))
 ASSI { 1032}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 116  and name HB1 ))
      2.400     0.700     0.700 peak  1032 spectrum    3 weight  0.10000E+01 volume  0.33683E-02 ppm1      7.401 ppm2      1.662 CV     1
 OR { 1032}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 116  and name HB2 ))
 OR { 1032}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 117  and name HB2 ))
 ASSI { 1033}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 117  and name HG2 ))
      2.800     1.000     1.000 peak  1033 spectrum    3 weight  0.10000E+01 volume  0.26830E-02 ppm1      7.400 ppm2      1.250 CV     1
 OR { 1033}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 117  and name HG1 ))
 OR { 1033}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 116  and name HG2 ))
 OR { 1033}
   (( segid "AREF" and resid 117  and name HN  ))
   (( segid "AREF" and resid 116  and name HG1 ))
 ASSI { 1073}
   (( segid "AREF" and resid 107  and name HN  ))
   (( segid "AREF" and resid 105  and name HN  ))
      3.100     1.200     1.200 peak  1073 spectrum    3 weight  0.10000E+01 volume  0.27759E-02 ppm1      7.877 ppm2      7.529 CV     1
 OR { 1073}
   (( segid "AREF" and resid 107  and name HN  ))
   (( segid "AREF" and resid 104  and name HN  ))
 ASSI { 1074}
   (( segid "AREF" and resid 107  and name HN  ))
   (( segid "AREF" and resid 107  and name HA  ))
      2.400     0.700     0.700 peak  1074 spectrum    3 weight  0.10000E+01 volume  0.65505E-02 ppm1      7.875 ppm2      4.310 CV     1
 OR { 1074}
   (( segid "AREF" and resid 107  and name HN  ))
   (( segid "AREF" and resid 104  and name HA  ))
 ASSI { 1077}
   (( segid "AREF" and resid 107  and name HN  ))
   (( segid "AREF" and resid 106  and name HB1 ))
      2.900     1.000     1.000 peak  1077 spectrum    3 weight  0.10000E+01 volume  0.20790E-02 ppm1      7.876 ppm2      2.145 CV     1
 OR { 1077}
   (( segid "AREF" and resid 107  and name HN  ))
   (( segid "AREF" and resid 106  and name HB2 ))
 OR { 1077}
   (( segid "AREF" and resid 107  and name HN  ))
   (( segid "AREF" and resid 107  and name HG2 ))
 OR { 1077}
   (( segid "AREF" and resid 107  and name HN  ))
   (( segid "AREF" and resid 107  and name HG1 ))
 ASSI { 1082}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 148  and name HA  ))
      2.800     1.000     1.000 peak  1082 spectrum    3 weight  0.10000E+01 volume  0.25785E-02 ppm1      7.546 ppm2      3.947 CV     1
 OR { 1082}
   (( segid "AREF" and resid 148  and name HN  ))
   (( segid "AREF" and resid 147  and name HA  ))
 ASSI { 1089}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 145  and name HN  ))
      2.500     0.800     0.800 peak  1089 spectrum    3 weight  0.10000E+01 volume  0.28224E-02 ppm1      8.095 ppm2      7.535 CV     1
 OR { 1089}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 148  and name HN  ))
 ASSI { 1093}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 146  and name HA  ))
      2.600     0.900     0.900 peak  1093 spectrum    3 weight  0.10000E+01 volume  0.27759E-02 ppm1      8.093 ppm2      3.816 CV     1
 OR { 1093}
   (( segid "AREF" and resid 146  and name HN  ))
   (( segid "AREF" and resid 143  and name HA  ))
 ASSI { 1103}
   (( segid "AREF" and resid 95   and name HN  ))
   (( segid "AREF" and resid 95   and name HB2 ))
      3.000     1.200     1.200 peak  1103 spectrum    3 weight  0.10000E+01 volume  0.31011E-02 ppm1      8.714 ppm2      3.744 CV     1
 OR { 1103}
   (( segid "AREF" and resid 95   and name HN  ))
   (( segid "AREF" and resid 94   and name HB1 ))
 ASSI { 1119}
   (( segid "AREF" and resid 166  and name HN  ))
   (( segid "AREF" and resid 165  and name HA  ))
      2.900     1.000     1.000 peak  1119 spectrum    3 weight  0.10000E+01 volume  0.24042E-02 ppm1      8.322 ppm2      4.412 CV     1
 OR { 1119}
   (( segid "AREF" and resid 166  and name HN  ))
   (( segid "AREF" and resid 166  and name HA  ))
 ASSI { 1133}
   (( segid "AREF" and resid 125  and name HN  ))
   (( segid "AREF" and resid 124  and name HA  ))
      3.300     1.400     1.400 peak  1133 spectrum    3 weight  0.10000E+01 volume  0.32057E-02 ppm1      8.391 ppm2      4.152 CV     1
 OR { 1133}
   (( segid "AREF" and resid 125  and name HN  ))
   (( segid "AREF" and resid 126  and name HA2 ))
 ASSI { 1146}
   (( segid "AREF" and resid 112  and name HN  ))
   (( segid "AREF" and resid 113  and name HN  ))
      3.000     1.100     1.100 peak  1146 spectrum    3 weight  0.10000E+01 volume  0.24042E-02 ppm1      7.723 ppm2      7.498 CV     1
 OR { 1146}
   (( segid "AREF" and resid 112  and name HN  ))
   (  segid "AREF" and resid 112  and name HD% )
 ASSI { 1174}
   (( segid "AREF" and resid 111  and name HN  ))
   (  segid "AREF" and resid 110  and name HB% )
      2.900     1.000     1.000 peak  1174 spectrum    3 weight  0.10000E+01 volume  0.26133E-02 ppm1      7.299 ppm2      1.585 CV     1
 OR { 1174}
   (( segid "AREF" and resid 111  and name HN  ))
   (( segid "AREF" and resid 111  and name HB1 ))
 ASSI { 1200}
   (( segid "AREF" and resid 55   and name HD22))
   (( segid "AREF" and resid 55   and name HD21))
      2.500     2.500     3.500 peak  1200 spectrum    3 weight  0.10000E+01 volume  0.14983E-02 ppm1      6.890 ppm2      7.564 CV     1
 OR { 1200}
   (( segid "AREF" and resid 45   and name HD22))
   (( segid "AREF" and resid 45   and name HD21))
 ASSI { 1217}
   (( segid "AREF" and resid 55   and name HD21))
   (( segid "AREF" and resid 55   and name HB2 ))
      2.900     1.000     1.000 peak  1217 spectrum    3 weight  0.10000E+01 volume  0.27527E-02 ppm1      7.560 ppm2      2.733 CV     1
 OR { 1217}
   (( segid "AREF" and resid 45   and name HD21))
   (( segid "AREF" and resid 45   and name HB2 ))
 OR { 1217}
   (( segid "AREF" and resid 45   and name HD21))
   (( segid "AREF" and resid 45   and name HB1 ))
 OR { 1217}
   (( segid "AREF" and resid 55   and name HD21))
   (( segid "AREF" and resid 55   and name HB1 ))
 ASSI { 1221}
   (( segid "AREF" and resid 55   and name HD22))
   (( segid "AREF" and resid 55   and name HB2 ))
      3.800     1.800     1.800 peak  1221 spectrum    3 weight  0.10000E+01 volume  0.30082E-02 ppm1      6.889 ppm2      2.739 CV     1
 OR { 1221}
   (( segid "AREF" and resid 45   and name HD22))
   (( segid "AREF" and resid 45   and name HB2 ))
 OR { 1221}
   (( segid "AREF" and resid 45   and name HD22))
   (( segid "AREF" and resid 45   and name HB1 ))
 OR { 1221}
   (( segid "AREF" and resid 55   and name HD22))
   (( segid "AREF" and resid 55   and name HB1 ))
 ASSI { 1232}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 146  and name HB1 ))
      3.800     1.800     1.800 peak  1232 spectrum    3 weight  0.10000E+01 volume  0.27875E-02 ppm1      7.582 ppm2      1.847 CV     1
 OR { 1232}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 150  and name HG1 ))
 OR { 1232}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 150  and name HG2 ))
 OR { 1232}
   (( segid "AREF" and resid 30   and name HD21))
   (( segid "AREF" and resid 31   and name HB1 ))
 ASSI { 1235}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 144  and name HG2 ))
      3.200     1.300     1.300 peak  1235 spectrum    3 weight  0.10000E+01 volume  0.32986E-02 ppm1      7.580 ppm2      1.510 CV     1
 OR { 1235}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 161  and name HB  ))
 ASSI { 1236}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 148  and name HB1 ))
      2.300     0.700     0.700 peak  1236 spectrum    3 weight  0.10000E+01 volume  0.49013E-02 ppm1      7.572 ppm2      1.959 CV     1
 OR { 1236}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 148  and name HB2 ))
 OR { 1236}
   (( segid "AREF" and resid 167  and name HE21))
   (( segid "AREF" and resid 167  and name HB1 ))
 ASSI { 1248}
   (( segid "AREF" and resid 149  and name HN  ))
   (( segid "AREF" and resid 150  and name HN  ))
      2.500     0.800     0.800 peak  1248 spectrum    3 weight  0.10000E+01 volume  0.27062E-02 ppm1      7.582 ppm2      8.274 CV     1
 OR { 1248}
   (( segid "AREF" and resid 30   and name HD21))
   (( segid "AREF" and resid 30   and name HN  ))
 ASSI { 1271}
   (( segid "AREF" and resid 30   and name HD22))
   (( segid "AREF" and resid 30   and name HB1 ))
      3.700     1.700     1.700 peak  1271 spectrum    3 weight  0.10000E+01 volume  0.27295E-02 ppm1      6.909 ppm2      2.836 CV     1
 OR { 1271}
   (( segid "AREF" and resid 30   and name HD22))
   (( segid "AREF" and resid 30   and name HB2 ))
 OR { 1271}
   (( segid "AREF" and resid 37   and name HD22))
   (( segid "AREF" and resid 37   and name HB2 ))
 ASSI { 1280}
   (( segid "AREF" and resid 9    and name HE21))
   (( segid "AREF" and resid 9    and name HE22))
      2.500     2.500     3.500 peak  1280 spectrum    3 weight  0.10000E+01 volume  0.14170E-02 ppm1      7.493 ppm2      6.830 CV     1
 OR { 1280}
   (( segid "AREF" and resid 8    and name HE21))
   (( segid "AREF" and resid 8    and name HE22))
 ASSI { 1285}
   (( segid "AREF" and resid 9    and name HE21))
   (( segid "AREF" and resid 9    and name HE22))
      2.500     2.500     3.500 peak  1285 spectrum    3 weight  0.10000E+01 volume  0.14983E-02 ppm1      7.477 ppm2      6.828 CV     1
 OR { 1285}
   (( segid "AREF" and resid 8    and name HE21))
   (( segid "AREF" and resid 8    and name HE22))
 OR { 1285}
   (( segid "AREF" and resid 33   and name HE21))
   (( segid "AREF" and resid 33   and name HE22))
 ASSI { 1298}
   (( segid "AREF" and resid 33   and name HE22))
   (( segid "AREF" and resid 33   and name HG1 ))
      3.500     1.600     1.600 peak  1298 spectrum    3 weight  0.10000E+01 volume  0.36702E-02 ppm1      6.834 ppm2      2.383 CV     1
 OR { 1298}
   (( segid "AREF" and resid 8    and name HE22))
   (( segid "AREF" and resid 8    and name HG1 ))
 OR { 1298}
   (( segid "AREF" and resid 8    and name HE22))
   (( segid "AREF" and resid 8    and name HG2 ))
 OR { 1298}
   (( segid "AREF" and resid 9    and name HE22))
   (( segid "AREF" and resid 9    and name HG1 ))
 ASSI { 1378}
   (( segid "AREF" and resid 11   and name HN  ))
   (( segid "AREF" and resid 11   and name HA2 ))
      3.000     1.100     1.100 peak  1378 spectrum    3 weight  0.10000E+01 volume  0.24275E-02 ppm1      8.408 ppm2      3.968 CV     1
 OR { 1378}
   (( segid "AREF" and resid 52   and name HN  ))
   (( segid "AREF" and resid 52   and name HA2 ))
 OR { 1378}
   (( segid "AREF" and resid 39   and name HN  ))
   (( segid "AREF" and resid 39   and name HA2 ))
 OR { 1378}
   (( segid "AREF" and resid 11   and name HN  ))
   (( segid "AREF" and resid 11   and name HA1 ))
 ASSI { 1387}
   (( segid "AREF" and resid 39   and name HN  ))
   (( segid "AREF" and resid 38   and name HA  ))
      2.800     1.000     1.000 peak  1387 spectrum    3 weight  0.10000E+01 volume  0.28804E-02 ppm1      8.408 ppm2      4.329 CV     1
 OR { 1387}
   (( segid "AREF" and resid 52   and name HN  ))
   (( segid "AREF" and resid 51   and name HA  ))
 ASSI { 1404}
   (( segid "AREF" and resid 40   and name HN  ))
   (( segid "AREF" and resid 39   and name HN  ))
      3.000     1.100     1.100 peak  1404 spectrum    3 weight  0.10000E+01 volume  0.43091E-02 ppm1      8.301 ppm2      8.420 CV     1
 OR { 1404}
   (( segid "AREF" and resid 7    and name HN  ))
   (( segid "AREF" and resid 6    and name HN  ))
 ASSI { 1410}
   (( segid "AREF" and resid 81   and name HN  ))
   (( segid "AREF" and resid 81   and name HA2 ))
      3.100     1.200     1.200 peak  1410 spectrum    3 weight  0.10000E+01 volume  0.21255E-02 ppm1      8.300 ppm2      3.972 CV     1
 OR { 1410}
   (( segid "AREF" and resid 7    and name HN  ))
   (( segid "AREF" and resid 7    and name HA2 ))
 OR { 1410}
   (( segid "AREF" and resid 81   and name HN  ))
   (( segid "AREF" and resid 80   and name HA1 ))
 OR { 1410}
   (( segid "AREF" and resid 40   and name HN  ))
   (( segid "AREF" and resid 40   and name HA1 ))
 OR { 1410}
   (( segid "AREF" and resid 7    and name HN  ))
   (( segid "AREF" and resid 7    and name HA1 ))
 OR { 1410}
   (( segid "AREF" and resid 40   and name HN  ))
   (( segid "AREF" and resid 40   and name HA2 ))
 OR { 1410}
   (( segid "AREF" and resid 81   and name HN  ))
   (( segid "AREF" and resid 81   and name HA1 ))
 ASSI { 1417}
   (( segid "AREF" and resid 53   and name HN  ))
   (( segid "AREF" and resid 53   and name HA1 ))
      3.100     1.200     1.200 peak  1417 spectrum    3 weight  0.10000E+01 volume  0.22416E-02 ppm1      8.262 ppm2      3.974 CV     1
 OR { 1417}
   (( segid "AREF" and resid 82   and name HN  ))
   (( segid "AREF" and resid 82   and name HA2 ))
 OR { 1417}
   (( segid "AREF" and resid 82   and name HN  ))
   (( segid "AREF" and resid 82   and name HA1 ))
 OR { 1417}
   (( segid "AREF" and resid 53   and name HN  ))
   (( segid "AREF" and resid 53   and name HA2 ))
 OR { 1417}
   (( segid "AREF" and resid 53   and name HN  ))
   (( segid "AREF" and resid 52   and name HA1 ))

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           H        MET   1  -8.328  17.073 -72.136
    2    HA   MET   1           HA       MET   1  -6.465  17.151 -69.874
    3   1HB   MET   1          2HB       MET   1  -9.365  17.941 -69.748
    4   2HB   MET   1          1HB       MET   1  -8.034  18.491 -68.741
    5   1HG   MET   1          2HG       MET   1  -7.278  19.985 -70.315
    6   2HG   MET   1          1HG       MET   1  -8.021  19.113 -71.654
    7   1HE   MET   1          1HE       MET   1 -10.707  18.748 -71.628
    8   2HE   MET   1          2HE       MET   1 -11.836  19.953 -71.011
    9   3HE   MET   1          3HE       MET   1 -11.062  18.820 -69.901
   10    H    ALA   2           H        ALA   2  -8.592  15.098 -71.349
   11    HA   ALA   2           HA       ALA   2  -9.548  13.114 -70.858
   12   1HB   ALA   2          1HB       ALA   2  -8.747  12.104 -68.544
   13   2HB   ALA   2          2HB       ALA   2  -7.501  13.340 -68.721
   14   3HB   ALA   2          3HB       ALA   2  -7.707  12.112 -69.970
   15    H    ASP   3           H        ASP   3 -10.906  15.439 -70.303
   16    HA   ASP   3           HA       ASP   3 -12.431  14.739 -67.878
   17   1HB   ASP   3          2HB       ASP   3 -11.575  16.887 -67.488
   18   2HB   ASP   3          1HB       ASP   3 -11.786  17.379 -69.160
   19    H    LYS   4           H        LYS   4 -13.096  16.717 -70.752
   20    HA   LYS   4           HA       LYS   4 -14.894  16.861 -72.129
   21   1HB   LYS   4          2HB       LYS   4 -13.865  14.402 -72.466
   22   2HB   LYS   4          1HB       LYS   4 -15.476  13.956 -71.925
   23   1HG   LYS   4          2HG       LYS   4 -15.498  14.006 -74.297
   24   2HG   LYS   4          1HG       LYS   4 -16.405  15.409 -73.728
   25   1HD   LYS   4          2HD       LYS   4 -15.121  16.590 -75.132
   26   2HD   LYS   4          1HD       LYS   4 -13.851  16.389 -73.922
   27   1HE   LYS   4          2HE       LYS   4 -13.259  14.227 -75.109
   28   2HE   LYS   4          1HE       LYS   4 -14.326  14.760 -76.408
   29   1HZ   LYS   4          1HZ       LYS   4 -12.977  16.712 -76.712
   30   2HZ   LYS   4          2HZ       LYS   4 -11.987  15.336 -76.804
   31   3HZ   LYS   4          3HZ       LYS   4 -11.989  16.291 -75.398
   32    H    MET   5           H        MET   5 -15.401  17.150 -69.284
   33    HA   MET   5           HA       MET   5 -18.259  16.517 -69.278
   34   1HB   MET   5          2HB       MET   5 -16.927  14.724 -68.054
   35   2HB   MET   5          1HB       MET   5 -16.549  15.958 -66.861
   36   1HG   MET   5          2HG       MET   5 -19.378  15.868 -67.401
   37   2HG   MET   5          1HG       MET   5 -18.766  14.288 -66.914
   38   1HE   MET   5          1HE       MET   5 -18.139  14.477 -63.297
   39   2HE   MET   5          2HE       MET   5 -17.641  13.725 -64.814
   40   3HE   MET   5          3HE       MET   5 -19.349  13.785 -64.377
   41    H    ASP   6           H        ASP   6 -15.728  17.942 -67.187
   42    HA   ASP   6           HA       ASP   6 -17.566  19.955 -66.228
   43   1HB   ASP   6          2HB       ASP   6 -14.737  19.203 -65.684
   44   2HB   ASP   6          1HB       ASP   6 -15.201  20.868 -65.347
   45    H    MET   7           H        MET   7 -15.041  19.666 -68.584
   46    HA   MET   7           HA       MET   7 -14.431  20.911 -70.360
   47   1HB   MET   7          2HB       MET   7 -17.069  22.170 -69.730
   48   2HB   MET   7          1HB       MET   7 -16.018  22.917 -70.927
   49   1HG   MET   7          2HG       MET   7 -16.231  20.084 -71.381
   50   2HG   MET   7          1HG       MET   7 -17.824  20.834 -71.315
   51   1HE   MET   7          1HE       MET   7 -14.737  20.104 -72.902
   52   2HE   MET   7          2HE       MET   7 -14.197  21.669 -73.509
   53   3HE   MET   7          3HE       MET   7 -14.990  20.528 -74.595
   54    H    SER   8           H        SER   8 -15.850  23.669 -68.681
   55    HA   SER   8           HA       SER   8 -13.273  24.985 -68.755
   56   1HB   SER   8          2HB       SER   8 -15.537  26.354 -67.453
   57   2HB   SER   8          1HB       SER   8 -14.463  26.915 -68.737
   58    HG   SER   8           HG       SER   8 -16.945  26.044 -68.972
   59    H    LEU   9           H        LEU   9 -12.038  23.928 -67.198
   60    HA   LEU   9           HA       LEU   9 -12.977  23.558 -64.515
   61   1HB   LEU   9          2HB       LEU   9 -10.943  22.481 -65.990
   62   2HB   LEU   9          1HB       LEU   9 -10.070  23.580 -64.939
   63    HG   LEU   9           HG       LEU   9 -11.953  22.090 -63.376
   64   1HD1  LEU   9          1HD1      LEU   9 -11.420  19.877 -63.774
   65   2HD1  LEU   9          2HD1      LEU   9  -9.968  20.283 -64.688
   66   3HD1  LEU   9          3HD1      LEU   9 -11.559  20.531 -65.406
   67   1HD2  LEU   9          1HD2      LEU   9 -10.112  21.727 -62.004
   68   2HD2  LEU   9          2HD2      LEU   9  -9.726  23.251 -62.802
   69   3HD2  LEU   9          3HD2      LEU   9  -8.977  21.752 -63.352
   70    H    ASP  10           H        ASP  10 -11.173  25.999 -66.236
   71    HA   ASP  10           HA       ASP  10 -10.182  27.520 -64.130
   72   1HB   ASP  10          2HB       ASP  10  -9.459  28.321 -66.165
   73   2HB   ASP  10          1HB       ASP  10 -11.027  28.098 -66.931
   74    H    ASP  11           H        ASP  11 -13.392  27.498 -65.600
   75    HA   ASP  11           HA       ASP  11 -14.581  29.532 -64.093
   76   1HB   ASP  11          2HB       ASP  11 -15.900  28.801 -65.863
   77   2HB   ASP  11          1HB       ASP  11 -15.614  27.100 -65.509
   78    H    ILE  12           H        ILE  12 -14.305  26.053 -63.461
   79    HA   ILE  12           HA       ILE  12 -15.681  25.926 -61.044
   80    HB   ILE  12           HB       ILE  12 -13.197  24.374 -61.768
   81   1HG1  ILE  12          2HG1      ILE  12 -16.083  23.550 -62.146
   82   2HG1  ILE  12          1HG1      ILE  12 -15.094  24.240 -63.430
   83   1HG2  ILE  12          1HG2      ILE  12 -14.560  22.677 -60.242
   84   2HG2  ILE  12          2HG2      ILE  12 -15.176  24.184 -59.556
   85   3HG2  ILE  12          3HG2      ILE  12 -13.441  23.859 -59.557
   86   1HD1  ILE  12          1HD1      ILE  12 -13.804  22.003 -62.115
   87   2HD1  ILE  12          2HD1      ILE  12 -14.095  22.300 -63.829
   88   3HD1  ILE  12          3HD1      ILE  12 -15.356  21.573 -62.832
   89    H    ILE  13           H        ILE  13 -12.228  26.477 -61.640
   90    HA   ILE  13           HA       ILE  13 -11.307  26.743 -59.069
   91    HB   ILE  13           HB       ILE  13 -10.484  28.492 -61.392
   92   1HG1  ILE  13          2HG1      ILE  13  -9.175  25.945 -60.442
   93   2HG1  ILE  13          1HG1      ILE  13 -10.382  25.970 -61.723
   94   1HG2  ILE  13          1HG2      ILE  13  -8.650  27.714 -59.182
   95   2HG2  ILE  13          2HG2      ILE  13  -9.814  29.008 -58.900
   96   3HG2  ILE  13          3HG2      ILE  13  -8.639  29.148 -60.208
   97   1HD1  ILE  13          1HD1      ILE  13  -8.139  27.845 -62.043
   98   2HD1  ILE  13          2HD1      ILE  13  -8.950  26.823 -63.230
   99   3HD1  ILE  13          3HD1      ILE  13  -7.740  26.130 -62.150
  100    H    LYS  14           H        LYS  14 -12.713  29.329 -61.067
  101    HA   LYS  14           HA       LYS  14 -12.520  31.301 -59.030
  102   1HB   LYS  14          2HB       LYS  14 -14.437  31.339 -61.354
  103   2HB   LYS  14          1HB       LYS  14 -13.759  32.715 -60.493
  104   1HG   LYS  14          2HG       LYS  14 -12.047  30.788 -62.025
  105   2HG   LYS  14          1HG       LYS  14 -12.800  32.193 -62.783
  106   1HD   LYS  14          2HD       LYS  14 -11.448  33.671 -61.691
  107   2HD   LYS  14          1HD       LYS  14 -11.269  32.626 -60.278
  108   1HE   LYS  14          2HE       LYS  14  -9.157  32.638 -61.311
  109   2HE   LYS  14          1HE       LYS  14  -9.890  31.100 -61.767
  110   1HZ   LYS  14          1HZ       LYS  14  -8.797  32.900 -63.476
  111   2HZ   LYS  14          2HZ       LYS  14 -10.456  33.222 -63.621
  112   3HZ   LYS  14          3HZ       LYS  14  -9.871  31.657 -63.912
  113    H    LEU  15           H        LEU  15 -15.220  29.306 -60.207
  114    HA   LEU  15           HA       LEU  15 -17.166  30.478 -58.529
  115   1HB   LEU  15          2HB       LEU  15 -17.441  29.001 -60.640
  116   2HB   LEU  15          1HB       LEU  15 -17.346  27.657 -59.520
  117    HG   LEU  15           HG       LEU  15 -19.278  29.727 -58.742
  118   1HD1  LEU  15          1HD1      LEU  15 -20.931  29.187 -60.388
  119   2HD1  LEU  15          2HD1      LEU  15 -19.847  28.032 -61.165
  120   3HD1  LEU  15          3HD1      LEU  15 -19.481  29.756 -61.215
  121   1HD2  LEU  15          1HD2      LEU  15 -20.687  27.657 -58.482
  122   2HD2  LEU  15          2HD2      LEU  15 -19.216  27.702 -57.511
  123   3HD2  LEU  15          3HD2      LEU  15 -19.275  26.726 -58.980
  124    H    ASN  16           H        ASN  16 -15.201  27.543 -58.173
  125    HA   ASN  16           HA       ASN  16 -16.501  26.741 -55.772
  126   1HB   ASN  16          2HB       ASN  16 -15.320  24.824 -55.938
  127   2HB   ASN  16          1HB       ASN  16 -15.019  25.406 -57.567
  128   1HD2  ASN  16          1HD2      ASN  16 -12.998  25.915 -58.171
  129   2HD2  ASN  16          2HD2      ASN  16 -11.605  25.699 -57.169
  130    H    ARG  17           H        ARG  17 -13.643  28.675 -56.460
  131    HA   ARG  17           HA       ARG  17 -12.735  28.637 -53.741
  132   1HB   ARG  17          2HB       ARG  17 -10.990  30.016 -54.401
  133   2HB   ARG  17          1HB       ARG  17 -11.343  29.117 -55.868
  134   1HG   ARG  17          2HG       ARG  17 -12.725  31.080 -56.614
  135   2HG   ARG  17          1HG       ARG  17 -12.071  31.964 -55.232
  136   1HD   ARG  17          2HD       ARG  17 -10.449  30.693 -57.439
  137   2HD   ARG  17          1HD       ARG  17 -10.805  32.414 -57.293
  138    HE   ARG  17           HE       ARG  17  -9.326  30.978 -55.179
  139   1HH1  ARG  17          1HH1      ARG  17  -9.544  33.603 -57.497
  140   2HH1  ARG  17          2HH1      ARG  17  -8.087  34.365 -56.945
  141   1HH2  ARG  17          1HH2      ARG  17  -7.405  31.965 -54.482
  142   2HH2  ARG  17          2HH2      ARG  17  -6.854  33.431 -55.247
  143    H    ASN  18           H        ASN  18 -14.880  30.609 -55.633
  144    HA   ASN  18           HA       ASN  18 -15.302  32.374 -53.315
  145   1HB   ASN  18          2HB       ASN  18 -14.728  33.332 -55.641
  146   2HB   ASN  18          1HB       ASN  18 -16.360  32.859 -56.100
  147   1HD2  ASN  18          1HD2      ASN  18 -17.334  34.778 -56.325
  148   2HD2  ASN  18          2HD2      ASN  18 -17.466  35.967 -55.072
  149    H    GLN  19           H        GLN  19 -16.301  29.725 -53.359
  150    HA   GLN  19           HA       GLN  19 -19.088  29.831 -54.117
  151   1HB   GLN  19          2HB       GLN  19 -17.184  27.781 -53.594
  152   2HB   GLN  19          1HB       GLN  19 -18.520  27.567 -52.472
  153   1HG   GLN  19          2HG       GLN  19 -18.973  27.939 -55.410
  154   2HG   GLN  19          1HG       GLN  19 -18.636  26.358 -54.711
  155   1HE2  GLN  19          1HE2      GLN  19 -20.396  25.220 -54.371
  156   2HE2  GLN  19          2HE2      GLN  19 -21.948  25.840 -53.917
  157    H    ARG  20           H        ARG  20 -20.835  29.584 -52.687
  158    HA   ARG  20           HA       ARG  20 -20.263  30.357 -49.904
  159   1HB   ARG  20          2HB       ARG  20 -22.456  31.469 -49.856
  160   2HB   ARG  20          1HB       ARG  20 -21.416  32.160 -51.092
  161   1HG   ARG  20          2HG       ARG  20 -22.940  30.073 -52.276
  162   2HG   ARG  20          1HG       ARG  20 -24.029  31.113 -51.360
  163   1HD   ARG  20          2HD       ARG  20 -24.024  32.358 -53.231
  164   2HD   ARG  20          1HD       ARG  20 -22.498  32.963 -52.594
  165    HE   ARG  20           HE       ARG  20 -21.461  32.028 -54.382
  166   1HH1  ARG  20          1HH1      ARG  20 -24.442  30.243 -53.862
  167   2HH1  ARG  20          2HH1      ARG  20 -24.265  29.278 -55.295
  168   1HH2  ARG  20          1HH2      ARG  20 -21.218  30.732 -56.259
  169   2HH2  ARG  20          2HH2      ARG  20 -22.433  29.543 -56.643
  170    H    ARG  21           H        ARG  21 -20.796  28.879 -48.432
  171    HA   ARG  21           HA       ARG  21 -22.397  26.597 -49.354
  172   1HB   ARG  21          2HB       ARG  21 -20.023  26.834 -47.795
  173   2HB   ARG  21          1HB       ARG  21 -21.265  26.088 -46.799
  174   1HG   ARG  21          2HG       ARG  21 -19.857  24.474 -48.050
  175   2HG   ARG  21          1HG       ARG  21 -21.583  24.332 -48.381
  176   1HD   ARG  21          2HD       ARG  21 -19.978  26.093 -50.153
  177   2HD   ARG  21          1HD       ARG  21 -19.757  24.354 -50.318
  178    HE   ARG  21           HE       ARG  21 -22.007  25.894 -51.176
  179   1HH1  ARG  21          1HH1      ARG  21 -21.015  22.726 -50.068
  180   2HH1  ARG  21          2HH1      ARG  21 -22.374  21.910 -50.780
  181   1HH2  ARG  21          1HH2      ARG  21 -23.776  24.823 -52.150
  182   2HH2  ARG  21          2HH2      ARG  21 -23.946  23.100 -51.958
  183    H    VAL  22           H        VAL  22 -22.767  29.368 -47.596
  184    HA   VAL  22           HA       VAL  22 -25.281  28.368 -46.554
  185    HB   VAL  22           HB       VAL  22 -24.006  28.092 -44.587
  186   1HG1  VAL  22          1HG1      VAL  22 -22.438  29.615 -43.679
  187   2HG1  VAL  22          2HG1      VAL  22 -22.901  30.877 -44.821
  188   3HG1  VAL  22          3HG1      VAL  22 -22.054  29.438 -45.391
  189   1HG2  VAL  22          1HG2      VAL  22 -25.473  30.718 -44.498
  190   2HG2  VAL  22          2HG2      VAL  22 -24.861  29.894 -43.062
  191   3HG2  VAL  22          3HG2      VAL  22 -26.083  29.118 -44.071
  192    H    ASN  23           H        ASN  23 -26.429  29.554 -47.961
  193    HA   ASN  23           HA       ASN  23 -26.018  32.458 -48.042
  194   1HB   ASN  23          2HB       ASN  23 -26.383  30.910 -50.126
  195   2HB   ASN  23          1HB       ASN  23 -28.081  30.995 -49.666
  196   1HD2  ASN  23          1HD2      ASN  23 -28.894  32.216 -51.253
  197   2HD2  ASN  23          2HD2      ASN  23 -28.391  33.839 -51.605
  198    H    ARG  24           H        ARG  24 -27.232  30.726 -45.874
  199    HA   ARG  24           HA       ARG  24 -29.782  32.175 -45.596
  200   1HB   ARG  24          2HB       ARG  24 -30.053  30.091 -43.870
  201   2HB   ARG  24          1HB       ARG  24 -30.647  30.079 -45.526
  202   1HG   ARG  24          2HG       ARG  24 -28.626  28.949 -46.264
  203   2HG   ARG  24          1HG       ARG  24 -27.984  29.003 -44.622
  204   1HD   ARG  24          2HD       ARG  24 -30.578  27.653 -45.334
  205   2HD   ARG  24          1HD       ARG  24 -29.027  26.816 -45.336
  206    HE   ARG  24           HE       ARG  24 -30.568  27.655 -43.041
  207   1HH1  ARG  24          1HH1      ARG  24 -27.419  26.643 -44.228
  208   2HH1  ARG  24          2HH1      ARG  24 -26.857  26.128 -42.663
  209   1HH2  ARG  24          1HH2      ARG  24 -29.824  26.983 -40.986
  210   2HH2  ARG  24          2HH2      ARG  24 -28.214  26.344 -40.813
  211    H    GLY  25           H        GLY  25 -27.371  33.308 -44.895
  212   1HA   GLY  25          2HA       GLY  25 -27.275  34.632 -42.762
  213   2HA   GLY  25          1HA       GLY  25 -27.288  33.065 -41.957
  214    H    GLY  26           H        GLY  26 -25.275  33.377 -40.977
  215   1HA   GLY  26          2HA       GLY  26 -23.033  32.809 -40.918
  216   2HA   GLY  26          1HA       GLY  26 -23.072  32.589 -42.660
  217    H    GLY  27           H        GLY  27 -21.235  33.701 -43.140
  218   1HA   GLY  27          2HA       GLY  27 -20.520  35.826 -44.019
  219   2HA   GLY  27          1HA       GLY  27 -21.381  36.611 -42.703
  220    HA   PRO  28           HA       PRO  28 -17.097  34.893 -41.182
  221   1HB   PRO  28          2HB       PRO  28 -15.385  35.517 -43.450
  222   2HB   PRO  28          1HB       PRO  28 -15.600  33.978 -42.613
  223   1HG   PRO  28          2HG       PRO  28 -16.461  34.422 -45.154
  224   2HG   PRO  28          1HG       PRO  28 -17.246  33.281 -44.047
  225   1HD   PRO  28          2HD       PRO  28 -18.053  36.070 -44.783
  226   2HD   PRO  28          1HD       PRO  28 -19.064  34.626 -44.555
  227    H    ARG  29           H        ARG  29 -18.255  37.270 -40.783
  228    HA   ARG  29           HA       ARG  29 -16.022  39.182 -40.937
  229   1HB   ARG  29          2HB       ARG  29 -18.952  39.855 -41.277
  230   2HB   ARG  29          1HB       ARG  29 -17.624  41.007 -41.268
  231   1HG   ARG  29          2HG       ARG  29 -17.585  38.798 -43.258
  232   2HG   ARG  29          1HG       ARG  29 -18.675  40.161 -43.513
  233   1HD   ARG  29          2HD       ARG  29 -16.995  41.427 -44.224
  234   2HD   ARG  29          1HD       ARG  29 -16.091  41.123 -42.742
  235    HE   ARG  29           HE       ARG  29 -14.962  39.363 -43.804
  236   1HH1  ARG  29          1HH1      ARG  29 -17.259  40.927 -45.948
  237   2HH1  ARG  29          2HH1      ARG  29 -16.557  40.244 -47.391
  238   1HH2  ARG  29          1HH2      ARG  29 -14.055  38.475 -45.670
  239   2HH2  ARG  29          2HH2      ARG  29 -14.729  38.843 -47.234
  240    H    ARG  30           H        ARG  30 -15.919  40.687 -39.208
  241    HA   ARG  30           HA       ARG  30 -17.127  39.617 -36.757
  242   1HB   ARG  30          2HB       ARG  30 -14.599  40.990 -37.412
  243   2HB   ARG  30          1HB       ARG  30 -15.349  41.498 -35.905
  244   1HG   ARG  30          2HG       ARG  30 -13.997  39.788 -35.193
  245   2HG   ARG  30          1HG       ARG  30 -15.523  38.940 -35.449
  246   1HD   ARG  30          2HD       ARG  30 -13.753  37.630 -36.401
  247   2HD   ARG  30          1HD       ARG  30 -14.721  38.300 -37.714
  248    HE   ARG  30           HE       ARG  30 -12.942  39.664 -38.324
  249   1HH1  ARG  30          1HH1      ARG  30 -12.184  37.797 -35.456
  250   2HH1  ARG  30          2HH1      ARG  30 -10.491  38.212 -35.479
  251   1HH2  ARG  30          1HH2      ARG  30 -10.721  40.208 -38.359
  252   2HH2  ARG  30          2HH2      ARG  30  -9.666  39.592 -37.120
  253    H    ASN  31           H        ASN  31 -19.086  40.710 -37.841
  254    HA   ASN  31           HA       ASN  31 -19.249  43.512 -36.935
  255   1HB   ASN  31          2HB       ASN  31 -19.564  43.225 -39.372
  256   2HB   ASN  31          1HB       ASN  31 -20.904  42.127 -39.059
  257   1HD2  ASN  31          1HD2      ASN  31 -19.836  45.403 -39.104
  258   2HD2  ASN  31          2HD2      ASN  31 -21.389  46.135 -38.869
  259    H    ARG  32           H        ARG  32 -21.035  40.479 -37.228
  260    HA   ARG  32           HA       ARG  32 -22.953  41.426 -35.227
  261   1HB   ARG  32          2HB       ARG  32 -23.269  38.836 -36.692
  262   2HB   ARG  32          1HB       ARG  32 -24.503  39.938 -36.100
  263   1HG   ARG  32          2HG       ARG  32 -23.101  41.387 -38.025
  264   2HG   ARG  32          1HG       ARG  32 -23.290  39.769 -38.703
  265   1HD   ARG  32          2HD       ARG  32 -25.152  41.303 -39.269
  266   2HD   ARG  32          1HD       ARG  32 -25.669  39.859 -38.402
  267    HE   ARG  32           HE       ARG  32 -25.219  42.360 -36.919
  268   1HH1  ARG  32          1HH1      ARG  32 -27.393  39.846 -38.060
  269   2HH1  ARG  32          2HH1      ARG  32 -28.720  40.373 -37.059
  270   1HH2  ARG  32          1HH2      ARG  32 -26.958  43.042 -35.608
  271   2HH2  ARG  32          2HH2      ARG  32 -28.468  42.170 -35.652
  272    HA   PRO  33           HA       PRO  33 -21.165  38.948 -32.012
  273   1HB   PRO  33          2HB       PRO  33 -23.987  38.394 -31.256
  274   2HB   PRO  33          1HB       PRO  33 -22.668  39.045 -30.278
  275   1HG   PRO  33          2HG       PRO  33 -24.619  40.631 -31.158
  276   2HG   PRO  33          1HG       PRO  33 -22.938  41.194 -31.107
  277   1HD   PRO  33          2HD       PRO  33 -24.568  40.296 -33.445
  278   2HD   PRO  33          1HD       PRO  33 -23.371  41.603 -33.339
  279    H    ALA  34           H        ALA  34 -20.342  37.029 -32.477
  280    HA   ALA  34           HA       ALA  34 -21.879  35.048 -33.926
  281   1HB   ALA  34          1HB       ALA  34 -19.891  34.611 -34.812
  282   2HB   ALA  34          2HB       ALA  34 -19.335  34.031 -33.242
  283   3HB   ALA  34          3HB       ALA  34 -19.116  35.724 -33.684
  284    H    ILE  35           H        ILE  35 -23.370  34.522 -32.307
  285    HA   ILE  35           HA       ILE  35 -22.564  33.391 -29.806
  286    HB   ILE  35           HB       ILE  35 -24.802  34.482 -30.274
  287   1HG1  ILE  35          2HG1      ILE  35 -25.703  31.958 -29.192
  288   2HG1  ILE  35          1HG1      ILE  35 -24.114  32.373 -28.557
  289   1HG2  ILE  35          1HG2      ILE  35 -24.981  32.236 -32.106
  290   2HG2  ILE  35          2HG2      ILE  35 -25.927  33.724 -32.040
  291   3HG2  ILE  35          3HG2      ILE  35 -26.374  32.348 -31.029
  292   1HD1  ILE  35          1HD1      ILE  35 -25.847  33.207 -27.103
  293   2HD1  ILE  35          2HD1      ILE  35 -26.584  34.086 -28.442
  294   3HD1  ILE  35          3HD1      ILE  35 -24.990  34.554 -27.852
  295    H    ALA  36           H        ALA  36 -22.611  32.297 -32.976
  296    HA   ALA  36           HA       ALA  36 -22.207  30.327 -34.001
  297   1HB   ALA  36          1HB       ALA  36 -20.379  29.701 -32.803
  298   2HB   ALA  36          2HB       ALA  36 -21.470  28.403 -32.317
  299   3HB   ALA  36          3HB       ALA  36 -21.222  29.789 -31.256
  300    H    ARG  37           H        ARG  37 -23.178  28.607 -31.128
  301    HA   ARG  37           HA       ARG  37 -25.888  28.262 -32.146
  302   1HB   ARG  37          2HB       ARG  37 -23.825  26.248 -32.340
  303   2HB   ARG  37          1HB       ARG  37 -25.125  25.692 -31.297
  304   1HG   ARG  37          2HG       ARG  37 -25.903  24.970 -33.309
  305   2HG   ARG  37          1HG       ARG  37 -26.631  26.578 -33.269
  306   1HD   ARG  37          2HD       ARG  37 -24.548  27.377 -34.490
  307   2HD   ARG  37          1HD       ARG  37 -24.181  25.674 -34.758
  308    HE   ARG  37           HE       ARG  37 -26.172  25.504 -36.086
  309   1HH1  ARG  37          1HH1      ARG  37 -25.299  28.767 -35.158
  310   2HH1  ARG  37          2HH1      ARG  37 -26.157  29.512 -36.475
  311   1HH2  ARG  37          1HH2      ARG  37 -27.329  26.479 -37.799
  312   2HH2  ARG  37          2HH2      ARG  37 -27.347  28.212 -37.956
  313    H    GLY  38           H        GLY  38 -23.559  27.312 -29.633
  314   1HA   GLY  38          2HA       GLY  38 -25.552  28.072 -27.615
  315   2HA   GLY  38          1HA       GLY  38 -24.851  26.460 -27.542
  316    H    GLY  39           H        GLY  39 -23.226  29.457 -28.449
  317   1HA   GLY  39          2HA       GLY  39 -21.367  29.012 -26.213
  318   2HA   GLY  39          1HA       GLY  39 -21.011  29.939 -27.666
  319    H    ARG  40           H        ARG  40 -20.690  30.751 -24.913
  320    HA   ARG  40           HA       ARG  40 -20.873  32.667 -23.709
  321   1HB   ARG  40          2HB       ARG  40 -22.698  33.627 -25.924
  322   2HB   ARG  40          1HB       ARG  40 -22.086  34.623 -24.612
  323   1HG   ARG  40          2HG       ARG  40 -20.245  33.193 -26.496
  324   2HG   ARG  40          1HG       ARG  40 -20.917  34.782 -26.868
  325   1HD   ARG  40          2HD       ARG  40 -19.691  35.830 -25.252
  326   2HD   ARG  40          1HD       ARG  40 -19.642  34.405 -24.213
  327    HE   ARG  40           HE       ARG  40 -17.896  34.951 -26.514
  328   1HH1  ARG  40          1HH1      ARG  40 -18.698  33.024 -23.696
  329   2HH1  ARG  40          2HH1      ARG  40 -17.202  32.144 -23.719
  330   1HH2  ARG  40          1HH2      ARG  40 -15.932  33.774 -26.557
  331   2HH2  ARG  40          2HH2      ARG  40 -15.636  32.557 -25.342
  332    H    ASN  41           H        ASN  41 -24.100  32.173 -25.149
  333    HA   ASN  41           HA       ASN  41 -25.329  32.522 -22.555
  334   1HB   ASN  41          2HB       ASN  41 -26.451  33.454 -24.527
  335   2HB   ASN  41          1HB       ASN  41 -26.561  31.845 -25.235
  336   1HD2  ASN  41          1HD2      ASN  41 -28.811  32.037 -25.357
  337   2HD2  ASN  41          2HD2      ASN  41 -29.813  31.876 -23.950
  338    H    ARG  42           H        ARG  42 -24.454  30.820 -21.438
  339    HA   ARG  42           HA       ARG  42 -26.044  28.497 -21.399
  340   1HB   ARG  42          2HB       ARG  42 -24.799  27.714 -23.267
  341   2HB   ARG  42          1HB       ARG  42 -23.279  28.255 -22.567
  342   1HG   ARG  42          2HG       ARG  42 -23.458  26.533 -20.842
  343   2HG   ARG  42          1HG       ARG  42 -24.993  26.002 -21.530
  344   1HD   ARG  42          2HD       ARG  42 -22.426  26.065 -23.095
  345   2HD   ARG  42          1HD       ARG  42 -22.955  24.657 -22.177
  346    HE   ARG  42           HE       ARG  42 -25.079  25.356 -23.798
  347   1HH1  ARG  42          1HH1      ARG  42 -21.746  24.363 -24.239
  348   2HH1  ARG  42          2HH1      ARG  42 -22.044  23.594 -25.767
  349   1HH2  ARG  42          1HH2      ARG  42 -25.469  24.355 -25.815
  350   2HH2  ARG  42          2HH2      ARG  42 -24.159  23.580 -26.661
  351    HA   PRO  43           HA       PRO  43 -22.943  28.300 -17.827
  352   1HB   PRO  43          2HB       PRO  43 -20.570  29.534 -17.878
  353   2HB   PRO  43          1HB       PRO  43 -20.818  27.991 -18.704
  354   1HG   PRO  43          2HG       PRO  43 -20.713  30.753 -19.832
  355   2HG   PRO  43          1HG       PRO  43 -20.060  29.245 -20.495
  356   1HD   PRO  43          2HD       PRO  43 -22.448  30.423 -21.267
  357   2HD   PRO  43          1HD       PRO  43 -22.027  28.716 -21.507
  358    H    ALA  44           H        ALA  44 -23.322  31.311 -19.436
  359    HA   ALA  44           HA       ALA  44 -22.694  33.164 -17.453
  360   1HB   ALA  44          1HB       ALA  44 -24.855  34.218 -18.898
  361   2HB   ALA  44          2HB       ALA  44 -23.980  33.170 -20.016
  362   3HB   ALA  44          3HB       ALA  44 -23.134  34.476 -19.186
  363    HA   PRO  45           HA       PRO  45 -25.922  32.298 -14.397
  364   1HB   PRO  45          2HB       PRO  45 -24.859  34.931 -13.486
  365   2HB   PRO  45          1HB       PRO  45 -25.146  33.455 -12.556
  366   1HG   PRO  45          2HG       PRO  45 -22.679  34.171 -13.216
  367   2HG   PRO  45          1HG       PRO  45 -23.171  32.467 -13.283
  368   1HD   PRO  45          2HD       PRO  45 -22.808  34.428 -15.510
  369   2HD   PRO  45          1HD       PRO  45 -22.416  32.697 -15.454
  370    H    TYR  46           H        TYR  46 -25.397  35.755 -14.931
  371    HA   TYR  46           HA       TYR  46 -27.678  36.105 -16.602
  372   1HB   TYR  46          2HB       TYR  46 -28.306  36.028 -13.918
  373   2HB   TYR  46          1HB       TYR  46 -28.082  37.751 -14.205
  374    HD1  TYR  46           1HD      TYR  46 -29.836  34.788 -15.647
  375    HD2  TYR  46           2HD      TYR  46 -29.859  38.995 -15.019
  376    HE1  TYR  46           1HE      TYR  46 -32.089  34.914 -16.623
  377    HE2  TYR  46           2HE      TYR  46 -32.113  39.132 -15.992
  378    HH   TYR  46           HH       TYR  46 -34.154  36.861 -16.244
  379    H    SER  47           H        SER  47 -25.672  37.819 -14.206
  380    HA   SER  47           HA       SER  47 -25.411  40.180 -15.744
  381   1HB   SER  47          2HB       SER  47 -23.171  39.966 -14.052
  382   2HB   SER  47          1HB       SER  47 -24.677  40.827 -13.723
  383    HG   SER  47           HG       SER  47 -24.065  39.177 -12.147
  384    H    ARG  48           H        ARG  48 -22.888  37.771 -14.954
  385    HA   ARG  48           HA       ARG  48 -22.057  37.648 -17.715
  386   1HB   ARG  48          2HB       ARG  48 -19.948  38.614 -17.539
  387   2HB   ARG  48          1HB       ARG  48 -20.949  39.707 -16.596
  388   1HG   ARG  48          2HG       ARG  48 -20.101  38.896 -14.559
  389   2HG   ARG  48          1HG       ARG  48 -19.385  37.478 -15.332
  390   1HD   ARG  48          2HD       ARG  48 -18.145  39.426 -16.701
  391   2HD   ARG  48          1HD       ARG  48 -18.405  40.259 -15.170
  392    HE   ARG  48           HE       ARG  48 -16.876  37.762 -15.510
  393   1HH1  ARG  48          1HH1      ARG  48 -17.672  40.648 -13.701
  394   2HH1  ARG  48          2HH1      ARG  48 -16.352  40.464 -12.583
  395   1HH2  ARG  48          1HH2      ARG  48 -15.133  37.517 -14.055
  396   2HH2  ARG  48          2HH2      ARG  48 -14.906  38.678 -12.778
  397    HA   PRO  49           HA       PRO  49 -20.890  33.491 -16.639
  398   1HB   PRO  49          2HB       PRO  49 -18.538  34.033 -18.380
  399   2HB   PRO  49          1HB       PRO  49 -19.697  32.702 -18.435
  400   1HG   PRO  49          2HG       PRO  49 -19.800  34.691 -20.209
  401   2HG   PRO  49          1HG       PRO  49 -21.277  33.946 -19.571
  402   1HD   PRO  49          2HD       PRO  49 -20.056  36.583 -18.926
  403   2HD   PRO  49          1HD       PRO  49 -21.765  36.108 -18.983
  404    H    LYS  50           H        LYS  50 -19.608  32.515 -15.180
  405    HA   LYS  50           HA       LYS  50 -17.346  34.077 -14.108
  406   1HB   LYS  50          2HB       LYS  50 -18.046  32.475 -12.026
  407   2HB   LYS  50          1HB       LYS  50 -18.614  34.125 -12.235
  408   1HG   LYS  50          2HG       LYS  50 -20.714  33.473 -12.857
  409   2HG   LYS  50          1HG       LYS  50 -20.163  31.928 -13.505
  410   1HD   LYS  50          2HD       LYS  50 -19.991  32.486 -10.571
  411   2HD   LYS  50          1HD       LYS  50 -21.518  31.977 -11.293
  412   1HE   LYS  50          2HE       LYS  50 -20.515  29.947 -12.106
  413   2HE   LYS  50          1HE       LYS  50 -18.916  30.475 -11.578
  414   1HZ   LYS  50          1HZ       LYS  50 -19.306  29.591  -9.603
  415   2HZ   LYS  50          2HZ       LYS  50 -20.829  29.050 -10.122
  416   3HZ   LYS  50          3HZ       LYS  50 -20.672  30.571  -9.390
  417    HA   PRO  51           HA       PRO  51 -15.408  30.235 -15.548
  418   1HB   PRO  51          2HB       PRO  51 -13.001  31.796 -15.727
  419   2HB   PRO  51          1HB       PRO  51 -13.962  31.126 -17.048
  420   1HG   PRO  51          2HG       PRO  51 -13.738  33.795 -16.584
  421   2HG   PRO  51          1HG       PRO  51 -15.185  33.057 -17.297
  422   1HD   PRO  51          2HD       PRO  51 -14.682  33.859 -14.444
  423   2HD   PRO  51          1HD       PRO  51 -16.119  34.158 -15.458
  424    H    LEU  52           H        LEU  52 -15.618  31.242 -12.744
  425    HA   LEU  52           HA       LEU  52 -14.853  30.679 -10.697
  426   1HB   LEU  52          2HB       LEU  52 -13.258  28.803 -12.407
  427   2HB   LEU  52          1HB       LEU  52 -13.047  28.846 -10.665
  428    HG   LEU  52           HG       LEU  52 -15.617  28.486 -10.582
  429   1HD1  LEU  52          1HD1      LEU  52 -16.660  28.339 -12.532
  430   2HD1  LEU  52          2HD1      LEU  52 -15.784  26.835 -12.830
  431   3HD1  LEU  52          3HD1      LEU  52 -15.130  28.367 -13.410
  432   1HD2  LEU  52          1HD2      LEU  52 -14.969  26.495  -9.849
  433   2HD2  LEU  52          2HD2      LEU  52 -13.390  26.762 -10.592
  434   3HD2  LEU  52          3HD2      LEU  52 -14.668  25.954 -11.502
  435    HA   PRO  53           HA       PRO  53 -11.532  33.799 -11.317
  436   1HB   PRO  53          2HB       PRO  53 -12.321  35.382  -9.256
  437   2HB   PRO  53          1HB       PRO  53 -13.039  35.469 -10.869
  438   1HG   PRO  53          2HG       PRO  53 -14.038  34.054  -8.425
  439   2HG   PRO  53          1HG       PRO  53 -14.938  35.059  -9.579
  440   1HD   PRO  53          2HD       PRO  53 -15.005  32.371  -9.678
  441   2HD   PRO  53          1HD       PRO  53 -15.058  33.364 -11.149
  442    H    ASP  54           H        ASP  54 -12.430  31.819  -8.630
  443    HA   ASP  54           HA       ASP  54  -9.851  32.395  -7.338
  444   1HB   ASP  54          2HB       ASP  54 -10.751  31.634  -5.272
  445   2HB   ASP  54          1HB       ASP  54 -11.963  32.697  -5.977
  446    H    LYS  55           H        LYS  55 -10.364  30.671  -9.681
  447    HA   LYS  55           HA       LYS  55 -10.227  27.965  -9.198
  448   1HB   LYS  55          2HB       LYS  55 -10.039  29.460 -11.414
  449   2HB   LYS  55          1HB       LYS  55  -8.337  29.070 -11.215
  450   1HG   LYS  55          2HG       LYS  55  -8.687  27.119 -12.190
  451   2HG   LYS  55          1HG       LYS  55  -9.779  26.668 -10.880
  452   1HD   LYS  55          2HD       LYS  55 -10.945  26.440 -12.972
  453   2HD   LYS  55          1HD       LYS  55 -11.622  27.812 -12.093
  454   1HE   LYS  55          2HE       LYS  55 -10.596  29.370 -13.503
  455   2HE   LYS  55          1HE       LYS  55  -9.448  28.186 -14.126
  456   1HZ   LYS  55          1HZ       LYS  55 -11.316  28.829 -15.658
  457   2HZ   LYS  55          2HZ       LYS  55 -12.366  27.998 -14.623
  458   3HZ   LYS  55          3HZ       LYS  55 -11.117  27.161 -15.413
  459    H    TRP  56           H        TRP  56  -9.008  26.932  -7.786
  460    HA   TRP  56           HA       TRP  56  -6.704  28.042  -6.597
  461   1HB   TRP  56          2HB       TRP  56  -7.948  25.302  -6.523
  462   2HB   TRP  56          1HB       TRP  56  -6.453  25.656  -5.666
  463    HD1  TRP  56           HD       TRP  56 -10.149  26.774  -5.732
  464    HE1  TRP  56           1HE      TRP  56 -10.765  27.671  -3.400
  465    HE3  TRP  56           3HE      TRP  56  -5.539  26.520  -3.539
  466    HZ2  TRP  56           2HZ      TRP  56  -9.457  28.195  -0.950
  467    HZ3  TRP  56           3HZ      TRP  56  -5.307  27.238  -1.198
  468    HH2  TRP  56           HH       TRP  56  -7.226  28.058   0.068
  469    H    GLN  57           H        GLN  57  -7.154  25.641  -9.133
  470    HA   GLN  57           HA       GLN  57  -4.244  25.724  -9.599
  471   1HB   GLN  57          2HB       GLN  57  -5.037  23.530  -8.751
  472   2HB   GLN  57          1HB       GLN  57  -6.120  23.411 -10.129
  473   1HG   GLN  57          2HG       GLN  57  -3.737  23.829 -11.362
  474   2HG   GLN  57          1HG       GLN  57  -3.247  22.904  -9.941
  475   1HE2  GLN  57          1HE2      GLN  57  -3.301  20.789 -10.156
  476   2HE2  GLN  57          2HE2      GLN  57  -4.296  19.898 -11.259
  477    H    HIS  58           H        HIS  58  -6.696  24.192 -11.574
  478    HA   HIS  58           HA       HIS  58  -7.070  26.154 -13.529
  479   1HB   HIS  58          2HB       HIS  58  -4.514  25.618 -13.703
  480   2HB   HIS  58          1HB       HIS  58  -5.046  24.124 -14.461
  481    HD1  HIS  58           1HD      HIS  58  -6.167  27.741 -14.980
  482    HD2  HIS  58           2HD      HIS  58  -4.715  24.470 -17.108
  483    HE1  HIS  58           1HE      HIS  58  -6.129  28.455 -17.393
  484    HE2  HIS  58           2HE      HIS  58  -5.059  26.533 -18.627
  485    H    ASP  59           H        ASP  59  -7.687  24.906 -15.717
  486    HA   ASP  59           HA       ASP  59  -9.460  22.753 -14.901
  487   1HB   ASP  59          2HB       ASP  59  -9.449  23.316 -17.740
  488   2HB   ASP  59          1HB       ASP  59 -10.780  23.404 -16.595
  489    H    LEU  60           H        LEU  60  -7.040  21.818 -14.582
  490    HA   LEU  60           HA       LEU  60  -5.859  20.629 -16.888
  491   1HB   LEU  60          2HB       LEU  60  -5.452  20.626 -13.996
  492   2HB   LEU  60          1HB       LEU  60  -5.050  19.096 -14.751
  493    HG   LEU  60           HG       LEU  60  -3.479  20.222 -16.248
  494   1HD1  LEU  60          1HD1      LEU  60  -3.168  22.486 -16.369
  495   2HD1  LEU  60          2HD1      LEU  60  -3.754  22.765 -14.729
  496   3HD1  LEU  60          3HD1      LEU  60  -4.900  22.422 -16.028
  497   1HD2  LEU  60          1HD2      LEU  60  -2.342  19.471 -14.397
  498   2HD2  LEU  60          2HD2      LEU  60  -3.219  20.531 -13.294
  499   3HD2  LEU  60          3HD2      LEU  60  -1.969  21.194 -14.347
  500    H    PHE  61           H        PHE  61  -7.513  19.133 -14.118
  501    HA   PHE  61           HA       PHE  61  -8.283  16.814 -15.624
  502   1HB   PHE  61          2HB       PHE  61  -8.095  17.337 -12.963
  503   2HB   PHE  61          1HB       PHE  61  -9.826  17.546 -13.197
  504    HD1  PHE  61           1HD      PHE  61  -7.930  15.368 -11.756
  505    HD2  PHE  61           2HD      PHE  61 -10.359  15.474 -15.250
  506    HE1  PHE  61           1HE      PHE  61  -8.239  12.933 -11.611
  507    HE2  PHE  61           2HE      PHE  61 -10.671  13.039 -15.111
  508    HZ   PHE  61           HZ       PHE  61  -9.611  11.765 -13.290
  509    H    ASP  62           H        ASP  62  -9.920  19.671 -14.352
  510    HA   ASP  62           HA       ASP  62 -11.355  20.350 -16.606
  511   1HB   ASP  62          2HB       ASP  62 -12.491  18.045 -15.765
  512   2HB   ASP  62          1HB       ASP  62 -13.386  19.188 -14.767
  513    H    SER  63           H        SER  63 -13.529  21.631 -15.746
  514    HA   SER  63           HA       SER  63 -12.620  23.456 -13.717
  515   1HB   SER  63          2HB       SER  63 -15.314  23.966 -14.079
  516   2HB   SER  63          1HB       SER  63 -14.007  24.700 -15.011
  517    HG   SER  63           HG       SER  63 -15.712  22.567 -15.693
  518    H    GLY  64           H        GLY  64 -14.291  20.526 -13.864
  519   1HA   GLY  64          2HA       GLY  64 -14.345  20.042 -11.131
  520   2HA   GLY  64          1HA       GLY  64 -15.932  20.663 -11.575
  521    H    CYS  65           H        CYS  65 -14.179  17.901 -11.189
  522    HA   CYS  65           HA       CYS  65 -16.016  16.388 -12.907
  523   1HB   CYS  65          2HB       CYS  65 -13.723  14.873 -12.984
  524   2HB   CYS  65          1HB       CYS  65 -14.284  15.934 -14.273
  525    HG   CYS  65           HG       CYS  65 -11.898  16.942 -14.309
  526    H    GLY  66           H        GLY  66 -16.027  14.024 -12.300
  527   1HA   GLY  66          2HA       GLY  66 -15.087  13.320  -9.671
  528   2HA   GLY  66          1HA       GLY  66 -16.821  13.611  -9.725
  529    H    GLY  67           H        GLY  67 -14.360  11.898 -11.640
  530   1HA   GLY  67          2HA       GLY  67 -16.057   9.506 -11.524
  531   2HA   GLY  67          1HA       GLY  67 -15.514  10.093 -13.090
  532    H    GLY  68           H        GLY  68 -14.433   8.072 -13.411
  533   1HA   GLY  68          2HA       GLY  68 -11.730   8.065 -13.045
  534   2HA   GLY  68          1HA       GLY  68 -12.341   7.273 -11.602
  535    H    GLU  69           H        GLU  69 -11.792   5.222 -11.876
  536    HA   GLU  69           HA       GLU  69 -13.020   3.583 -13.856
  537   1HB   GLU  69          2HB       GLU  69 -10.997   4.828 -14.982
  538   2HB   GLU  69          1HB       GLU  69 -10.035   3.649 -14.108
  539   1HG   GLU  69          2HG       GLU  69 -12.115   2.245 -15.399
  540   2HG   GLU  69          1HG       GLU  69 -11.413   3.357 -16.572
  541    H    GLY  70           H        GLY  70 -12.387   3.883 -10.915
  542   1HA   GLY  70          2HA       GLY  70 -12.131   2.175  -9.278
  543   2HA   GLY  70          1HA       GLY  70 -11.235   1.216 -10.454
  544    H    VAL  71           H        VAL  71  -9.774   3.675 -11.247
  545    HA   VAL  71           HA       VAL  71  -8.036   4.056  -8.925
  546    HB   VAL  71           HB       VAL  71  -6.163   4.361 -10.613
  547   1HG1  VAL  71          1HG1      VAL  71  -5.985   2.418  -9.366
  548   2HG1  VAL  71          2HG1      VAL  71  -6.001   1.807 -11.021
  549   3HG1  VAL  71          3HG1      VAL  71  -7.463   1.730 -10.039
  550   1HG2  VAL  71          1HG2      VAL  71  -7.651   2.661 -12.525
  551   2HG2  VAL  71          2HG2      VAL  71  -6.415   3.885 -12.817
  552   3HG2  VAL  71          3HG2      VAL  71  -8.077   4.372 -12.475
  553    H    GLU  72           H        GLU  72 -10.014   5.746  -9.121
  554    HA   GLU  72           HA       GLU  72 -10.131   7.775 -10.953
  555   1HB   GLU  72          2HB       GLU  72 -11.011   9.187  -9.016
  556   2HB   GLU  72          1HB       GLU  72 -11.847   7.680  -9.357
  557   1HG   GLU  72          2HG       GLU  72  -9.665   7.512  -7.401
  558   2HG   GLU  72          1HG       GLU  72 -11.070   8.456  -6.905
  559    H    THR  73           H        THR  73  -7.956   7.503  -8.228
  560    HA   THR  73           HA       THR  73  -6.049   9.226  -9.436
  561    HB   THR  73           HB       THR  73  -7.403  11.017  -8.629
  562    HG1  THR  73           1HG      THR  73  -5.062  11.047  -8.108
  563   1HG2  THR  73          1HG2      THR  73  -7.357  10.196  -5.786
  564   2HG2  THR  73          2HG2      THR  73  -8.452   9.321  -6.857
  565   3HG2  THR  73          3HG2      THR  73  -8.588  11.072  -6.696
  566    H    GLY  74           H        GLY  74  -5.694   6.723  -8.901
  567   1HA   GLY  74          2HA       GLY  74  -4.932   6.040  -6.247
  568   2HA   GLY  74          1HA       GLY  74  -4.563   5.121  -7.701
  569    H    ALA  75           H        ALA  75  -2.908   5.823  -5.324
  570    HA   ALA  75           HA       ALA  75  -0.771   7.330  -6.676
  571   1HB   ALA  75          1HB       ALA  75  -0.058   8.111  -4.562
  572   2HB   ALA  75          2HB       ALA  75  -1.052   6.929  -3.705
  573   3HB   ALA  75          3HB       ALA  75  -1.815   8.276  -4.555
  574    H    LYS  76           H        LYS  76   0.925   6.105  -7.314
  575    HA   LYS  76           HA       LYS  76   1.442   3.612  -5.850
  576   1HB   LYS  76          2HB       LYS  76   1.189   3.306  -8.235
  577   2HB   LYS  76          1HB       LYS  76   2.353   4.580  -8.568
  578   1HG   LYS  76          2HG       LYS  76   4.066   3.141  -7.391
  579   2HG   LYS  76          1HG       LYS  76   2.868   1.846  -7.441
  580   1HD   LYS  76          2HD       LYS  76   3.169   3.134 -10.019
  581   2HD   LYS  76          1HD       LYS  76   4.703   2.500  -9.424
  582   1HE   LYS  76          2HE       LYS  76   2.179   0.867  -9.451
  583   2HE   LYS  76          1HE       LYS  76   3.274   0.934 -10.829
  584   1HZ   LYS  76          1HZ       LYS  76   3.807  -0.963  -9.505
  585   2HZ   LYS  76          2HZ       LYS  76   3.903  -0.030  -8.092
  586   3HZ   LYS  76          3HZ       LYS  76   5.060   0.166  -9.323
  587    H    LEU  77           H        LEU  77   2.968   3.677  -4.334
  588    HA   LEU  77           HA       LEU  77   5.057   5.714  -4.445
  589   1HB   LEU  77          2HB       LEU  77   3.635   5.603  -2.458
  590   2HB   LEU  77          1HB       LEU  77   3.976   3.902  -2.273
  591    HG   LEU  77           HG       LEU  77   5.081   5.402  -0.619
  592   1HD1  LEU  77          1HD1      LEU  77   5.898   3.139  -1.103
  593   2HD1  LEU  77          2HD1      LEU  77   7.167   4.247  -0.579
  594   3HD1  LEU  77          3HD1      LEU  77   7.014   3.823  -2.284
  595   1HD2  LEU  77          1HD2      LEU  77   5.647   7.289  -1.966
  596   2HD2  LEU  77          2HD2      LEU  77   6.641   6.297  -3.033
  597   3HD2  LEU  77          3HD2      LEU  77   7.144   6.576  -1.365
  598    H    LEU  78           H        LEU  78   7.145   5.150  -4.735
  599    HA   LEU  78           HA       LEU  78   7.804   2.282  -4.853
  600   1HB   LEU  78          2HB       LEU  78   8.630   4.634  -6.368
  601   2HB   LEU  78          1HB       LEU  78  10.002   3.738  -5.750
  602    HG   LEU  78           HG       LEU  78   8.863   3.230  -8.127
  603   1HD1  LEU  78          1HD1      LEU  78  10.062   1.181  -8.139
  604   2HD1  LEU  78          2HD1      LEU  78   9.962   1.039  -6.383
  605   3HD1  LEU  78          3HD1      LEU  78  10.957   2.301  -7.111
  606   1HD2  LEU  78          1HD2      LEU  78   7.737   0.922  -6.689
  607   2HD2  LEU  78          2HD2      LEU  78   7.163   1.752  -8.135
  608   3HD2  LEU  78          3HD2      LEU  78   6.831   2.428  -6.539
  609    H    VAL  79           H        VAL  79   9.244   1.449  -3.384
  610    HA   VAL  79           HA       VAL  79  10.613   3.373  -1.641
  611    HB   VAL  79           HB       VAL  79   8.726   2.776  -0.306
  612   1HG1  VAL  79          1HG1      VAL  79   8.996  -0.036  -0.008
  613   2HG1  VAL  79          2HG1      VAL  79   8.865   0.356  -1.723
  614   3HG1  VAL  79          3HG1      VAL  79   7.618   0.894  -0.599
  615   1HG2  VAL  79          1HG2      VAL  79  11.365   1.734   0.413
  616   2HG2  VAL  79          2HG2      VAL  79  10.034   1.017   1.321
  617   3HG2  VAL  79          3HG2      VAL  79  10.262   2.766   1.326
  618    H    SER  80           H        SER  80  12.674   2.708  -1.005
  619    HA   SER  80           HA       SER  80  13.486  -0.034  -1.565
  620   1HB   SER  80          2HB       SER  80  14.976   2.273  -2.836
  621   2HB   SER  80          1HB       SER  80  15.281   0.551  -3.056
  622    HG   SER  80           HG       SER  80  12.770   0.911  -3.693
  623    H    ASN  81           H        ASN  81  14.145  -0.457   0.483
  624    HA   ASN  81           HA       ASN  81  16.735  -0.036   1.219
  625   1HB   ASN  81          2HB       ASN  81  15.783   2.394   1.574
  626   2HB   ASN  81          1HB       ASN  81  15.179   1.714   3.083
  627   1HD2  ASN  81          1HD2      ASN  81  16.549   3.065   4.270
  628   2HD2  ASN  81          2HD2      ASN  81  18.244   2.761   4.393
  629    H    LEU  82           H        LEU  82  16.323  -2.213   1.686
  630    HA   LEU  82           HA       LEU  82  15.568  -2.700   4.426
  631   1HB   LEU  82          2HB       LEU  82  13.620  -3.023   2.431
  632   2HB   LEU  82          1HB       LEU  82  14.187  -4.642   2.781
  633    HG   LEU  82           HG       LEU  82  12.458  -4.502   4.260
  634   1HD1  LEU  82          1HD1      LEU  82  13.271  -4.093   6.502
  635   2HD1  LEU  82          2HD1      LEU  82  14.648  -3.196   5.863
  636   3HD1  LEU  82          3HD1      LEU  82  14.501  -4.927   5.548
  637   1HD2  LEU  82          1HD2      LEU  82  12.233  -1.979   3.554
  638   2HD2  LEU  82          2HD2      LEU  82  12.949  -1.709   5.144
  639   3HD2  LEU  82          3HD2      LEU  82  11.435  -2.603   4.998
  640    H    ASP  83           H        ASP  83  15.244  -5.596   3.887
  641    HA   ASP  83           HA       ASP  83  18.062  -6.152   3.285
  642   1HB   ASP  83          2HB       ASP  83  17.579  -8.324   4.604
  643   2HB   ASP  83          1HB       ASP  83  17.769  -6.821   5.497
  644    H    PHE  84           H        PHE  84  15.705  -8.711   3.526
  645    HA   PHE  84           HA       PHE  84  15.779  -9.180   0.648
  646   1HB   PHE  84          2HB       PHE  84  16.542 -11.661   1.539
  647   2HB   PHE  84          1HB       PHE  84  17.626 -10.471   0.825
  648    HD1  PHE  84           1HD      PHE  84  16.218 -11.509   4.114
  649    HD2  PHE  84           2HD      PHE  84  19.480  -9.764   2.010
  650    HE1  PHE  84           1HE      PHE  84  17.515 -11.426   6.200
  651    HE2  PHE  84           2HE      PHE  84  20.785  -9.685   4.093
  652    HZ   PHE  84           HZ       PHE  84  19.804 -10.519   6.191
  653    H    GLY  85           H        GLY  85  14.772 -10.279   3.861
  654   1HA   GLY  85          2HA       GLY  85  12.830 -12.120   2.702
  655   2HA   GLY  85          1HA       GLY  85  13.208 -11.939   4.410
  656    H    VAL  86           H        VAL  86  12.636  -9.080   2.639
  657    HA   VAL  86           HA       VAL  86  10.400  -8.354   4.236
  658    HB   VAL  86           HB       VAL  86  11.007  -6.957   1.663
  659   1HG1  VAL  86          1HG1      VAL  86   9.811  -5.333   2.591
  660   2HG1  VAL  86          2HG1      VAL  86  10.844  -5.322   4.020
  661   3HG1  VAL  86          3HG1      VAL  86   9.465  -6.418   3.938
  662   1HG2  VAL  86          1HG2      VAL  86  12.719  -5.742   3.413
  663   2HG2  VAL  86          2HG2      VAL  86  13.190  -6.895   2.162
  664   3HG2  VAL  86          3HG2      VAL  86  12.925  -7.448   3.816
  665    H    SER  87           H        SER  87   8.388  -9.049   3.965
  666    HA   SER  87           HA       SER  87   7.511  -9.830   1.277
  667   1HB   SER  87          2HB       SER  87   5.660 -10.377   3.472
  668   2HB   SER  87          1HB       SER  87   6.316 -11.471   2.254
  669    HG   SER  87           HG       SER  87   7.702 -10.576   4.579
  670    H    ASP  88           H        ASP  88   5.164  -9.390   0.833
  671    HA   ASP  88           HA       ASP  88   4.481  -6.768   0.640
  672   1HB   ASP  88          2HB       ASP  88   2.002  -7.809   0.862
  673   2HB   ASP  88          1HB       ASP  88   3.001  -7.984  -0.576
  674    H    ALA  89           H        ALA  89   3.162  -8.912   3.182
  675    HA   ALA  89           HA       ALA  89   1.811  -6.954   4.619
  676   1HB   ALA  89          1HB       ALA  89   1.303  -9.163   5.163
  677   2HB   ALA  89          2HB       ALA  89   2.154  -8.560   6.584
  678   3HB   ALA  89          3HB       ALA  89   2.995  -9.587   5.423
  679    H    ASP  90           H        ASP  90   5.146  -7.965   4.802
  680    HA   ASP  90           HA       ASP  90   5.961  -6.613   7.101
  681   1HB   ASP  90          2HB       ASP  90   7.429  -7.410   4.603
  682   2HB   ASP  90          1HB       ASP  90   8.242  -6.509   5.878
  683    H    ILE  91           H        ILE  91   6.463  -5.492   3.740
  684    HA   ILE  91           HA       ILE  91   7.147  -2.870   4.515
  685    HB   ILE  91           HB       ILE  91   7.692  -3.980   2.309
  686   1HG1  ILE  91          2HG1      ILE  91   7.189  -1.717   1.035
  687   2HG1  ILE  91          1HG1      ILE  91   6.723  -1.177   2.645
  688   1HG2  ILE  91          1HG2      ILE  91   5.309  -4.662   1.867
  689   2HG2  ILE  91          2HG2      ILE  91   6.162  -3.926   0.512
  690   3HG2  ILE  91          3HG2      ILE  91   4.996  -2.981   1.438
  691   1HD1  ILE  91          1HD1      ILE  91   9.114  -2.348   3.152
  692   2HD1  ILE  91          2HD1      ILE  91   8.878  -0.630   2.829
  693   3HD1  ILE  91          3HD1      ILE  91   9.370  -1.712   1.527
  694    H    GLN  92           H        GLN  92   4.092  -4.410   4.055
  695    HA   GLN  92           HA       GLN  92   2.524  -2.050   3.764
  696   1HB   GLN  92          2HB       GLN  92   1.725  -4.387   3.250
  697   2HB   GLN  92          1HB       GLN  92   1.625  -4.666   4.984
  698   1HG   GLN  92          2HG       GLN  92  -0.323  -3.614   5.138
  699   2HG   GLN  92          1HG       GLN  92   0.260  -2.239   4.202
  700   1HE2  GLN  92          1HE2      GLN  92  -2.276  -2.885   3.864
  701   2HE2  GLN  92          2HE2      GLN  92  -2.535  -3.679   2.347
  702    H    GLU  93           H        GLU  93   3.420  -4.062   6.549
  703    HA   GLU  93           HA       GLU  93   2.272  -2.509   8.574
  704   1HB   GLU  93          2HB       GLU  93   4.290  -4.603   8.367
  705   2HB   GLU  93          1HB       GLU  93   4.652  -3.458   9.652
  706   1HG   GLU  93          2HG       GLU  93   3.128  -4.365  10.966
  707   2HG   GLU  93          1HG       GLU  93   1.881  -4.174   9.736
  708    H    LEU  94           H        LEU  94   5.215  -2.144   6.775
  709    HA   LEU  94           HA       LEU  94   6.460  -0.186   8.402
  710   1HB   LEU  94          2HB       LEU  94   7.583  -1.567   6.628
  711   2HB   LEU  94          1HB       LEU  94   6.816  -0.542   5.428
  712    HG   LEU  94           HG       LEU  94   8.097   1.237   7.158
  713   1HD1  LEU  94          1HD1      LEU  94   9.677  -1.272   6.758
  714   2HD1  LEU  94          2HD1      LEU  94   9.494  -0.283   8.208
  715   3HD1  LEU  94          3HD1      LEU  94  10.484   0.293   6.868
  716   1HD2  LEU  94          1HD2      LEU  94   8.127   0.446   4.397
  717   2HD2  LEU  94          2HD2      LEU  94   9.760   0.828   4.944
  718   3HD2  LEU  94          3HD2      LEU  94   8.471   2.020   5.116
  719    H    PHE  95           H        PHE  95   4.954   0.302   5.187
  720    HA   PHE  95           HA       PHE  95   4.702   3.066   5.578
  721   1HB   PHE  95          2HB       PHE  95   4.028   1.192   3.499
  722   2HB   PHE  95          1HB       PHE  95   2.755   2.399   3.689
  723    HD1  PHE  95           1HD      PHE  95   3.007   4.518   2.741
  724    HD2  PHE  95           2HD      PHE  95   6.434   2.058   3.329
  725    HE1  PHE  95           1HE      PHE  95   4.383   6.153   1.542
  726    HE2  PHE  95           2HE      PHE  95   7.812   3.696   2.122
  727    HZ   PHE  95           HZ       PHE  95   6.782   5.741   1.226
  728    H    ALA  96           H        ALA  96   2.654   0.526   6.751
  729    HA   ALA  96           HA       ALA  96   0.394   2.148   7.324
  730   1HB   ALA  96          1HB       ALA  96  -0.340   0.425   8.728
  731   2HB   ALA  96          2HB       ALA  96   1.304  -0.106   9.085
  732   3HB   ALA  96          3HB       ALA  96   0.607  -0.406   7.493
  733    H    GLU  97           H        GLU  97   3.114   1.182   9.289
  734    HA   GLU  97           HA       GLU  97   3.032   2.960  11.389
  735   1HB   GLU  97          2HB       GLU  97   5.073   1.449  10.178
  736   2HB   GLU  97          1HB       GLU  97   5.697   3.089  10.300
  737   1HG   GLU  97          2HG       GLU  97   6.273   2.556  12.373
  738   2HG   GLU  97          1HG       GLU  97   4.555   2.683  12.759
  739    H    PHE  98           H        PHE  98   3.847   3.643   8.059
  740    HA   PHE  98           HA       PHE  98   4.342   6.451   8.509
  741   1HB   PHE  98          2HB       PHE  98   4.227   4.730   6.040
  742   2HB   PHE  98          1HB       PHE  98   4.447   6.474   5.961
  743    HD1  PHE  98           1HD      PHE  98   6.158   6.672   8.495
  744    HD2  PHE  98           2HD      PHE  98   6.318   4.120   5.095
  745    HE1  PHE  98           1HE      PHE  98   8.577   6.399   8.820
  746    HE2  PHE  98           2HE      PHE  98   8.740   3.837   5.418
  747    HZ   PHE  98           HZ       PHE  98   9.874   4.976   7.283
  748    H    GLY  99           H        GLY  99   1.561   4.773   8.502
  749   1HA   GLY  99          2HA       GLY  99  -0.391   6.434   8.624
  750   2HA   GLY  99          1HA       GLY  99   0.041   6.794   6.963
  751    H    THR 100           H        THR 100  -2.470   6.113   7.455
  752    HA   THR 100           HA       THR 100  -3.193   3.423   7.382
  753    HB   THR 100           HB       THR 100  -4.877   5.138   5.695
  754    HG1  THR 100           1HG      THR 100  -5.510   6.180   7.897
  755   1HG2  THR 100          1HG2      THR 100  -6.551   3.984   6.693
  756   2HG2  THR 100          2HG2      THR 100  -5.808   4.079   8.290
  757   3HG2  THR 100          3HG2      THR 100  -5.246   2.880   7.125
  758    H    LEU 101           H        LEU 101  -2.594   1.905   5.991
  759    HA   LEU 101           HA       LEU 101  -1.824   2.683   3.266
  760   1HB   LEU 101          2HB       LEU 101  -0.255   1.443   4.915
  761   2HB   LEU 101          1HB       LEU 101  -1.228   0.034   4.543
  762    HG   LEU 101           HG       LEU 101  -0.538   0.024   2.271
  763   1HD1  LEU 101          1HD1      LEU 101  -0.351   1.978   1.229
  764   2HD1  LEU 101          2HD1      LEU 101   1.266   2.099   1.932
  765   3HD1  LEU 101          3HD1      LEU 101  -0.112   2.845   2.748
  766   1HD2  LEU 101          1HD2      LEU 101   1.862   0.800   3.907
  767   2HD2  LEU 101          2HD2      LEU 101   1.855  -0.155   2.425
  768   3HD2  LEU 101          3HD2      LEU 101   1.117  -0.798   3.892
  769    H    LYS 102           H        LYS 102  -2.565   1.559   1.481
  770    HA   LYS 102           HA       LYS 102  -5.035   0.041   1.914
  771   1HB   LYS 102          2HB       LYS 102  -3.926   1.562  -0.433
  772   2HB   LYS 102          1HB       LYS 102  -5.186   0.358  -0.660
  773   1HG   LYS 102          2HG       LYS 102  -6.360   2.344  -0.480
  774   2HG   LYS 102          1HG       LYS 102  -6.469   1.664   1.144
  775   1HD   LYS 102          2HD       LYS 102  -4.097   3.271   0.887
  776   2HD   LYS 102          1HD       LYS 102  -5.522   4.198   0.410
  777   1HE   LYS 102          2HE       LYS 102  -6.575   3.287   2.572
  778   2HE   LYS 102          1HE       LYS 102  -4.924   2.876   3.035
  779   1HZ   LYS 102          1HZ       LYS 102  -4.368   5.035   3.319
  780   2HZ   LYS 102          2HZ       LYS 102  -6.036   5.201   3.594
  781   3HZ   LYS 102          3HZ       LYS 102  -5.384   5.594   2.074
  782    H    LYS 103           H        LYS 103  -2.268  -0.030  -0.361
  783    HA   LYS 103           HA       LYS 103  -1.905  -2.840   0.319
  784   1HB   LYS 103          2HB       LYS 103  -1.527  -3.229  -2.236
  785   2HB   LYS 103          1HB       LYS 103  -3.147  -3.305  -1.561
  786   1HG   LYS 103          2HG       LYS 103  -2.474  -0.620  -2.387
  787   2HG   LYS 103          1HG       LYS 103  -2.296  -1.776  -3.709
  788   1HD   LYS 103          2HD       LYS 103  -4.748  -1.237  -2.044
  789   2HD   LYS 103          1HD       LYS 103  -4.539  -0.976  -3.775
  790   1HE   LYS 103          2HE       LYS 103  -3.956  -3.690  -3.283
  791   2HE   LYS 103          1HE       LYS 103  -5.431  -3.320  -2.391
  792   1HZ   LYS 103          1HZ       LYS 103  -4.950  -2.915  -5.293
  793   2HZ   LYS 103          2HZ       LYS 103  -6.336  -2.374  -4.472
  794   3HZ   LYS 103          3HZ       LYS 103  -6.007  -4.035  -4.580
  795    H    ALA 104           H        ALA 104   0.159  -3.597   0.063
  796    HA   ALA 104           HA       ALA 104   2.153  -2.059  -1.311
  797   1HB   ALA 104          1HB       ALA 104   1.720  -1.456   1.406
  798   2HB   ALA 104          2HB       ALA 104   3.058  -0.929   0.376
  799   3HB   ALA 104          3HB       ALA 104   3.210  -2.405   1.333
  800    H    ALA 105           H        ALA 105   3.404  -3.490  -2.247
  801    HA   ALA 105           HA       ALA 105   3.982  -6.050  -0.912
  802   1HB   ALA 105          1HB       ALA 105   3.433  -7.338  -2.840
  803   2HB   ALA 105          2HB       ALA 105   3.174  -5.889  -3.812
  804   3HB   ALA 105          3HB       ALA 105   2.047  -6.295  -2.515
  805    H    VAL 106           H        VAL 106   5.969  -7.107  -1.836
  806    HA   VAL 106           HA       VAL 106   7.786  -4.954  -2.515
  807    HB   VAL 106           HB       VAL 106   9.541  -6.763  -2.072
  808   1HG1  VAL 106          1HG1      VAL 106   7.630  -5.827   0.064
  809   2HG1  VAL 106          2HG1      VAL 106   9.138  -5.066  -0.444
  810   3HG1  VAL 106          3HG1      VAL 106   9.173  -6.609   0.410
  811   1HG2  VAL 106          1HG2      VAL 106   8.904  -8.747  -0.965
  812   2HG2  VAL 106          2HG2      VAL 106   7.853  -8.624  -2.377
  813   3HG2  VAL 106          3HG2      VAL 106   7.237  -8.201  -0.779
  814    H    ASP 107           H        ASP 107   9.619  -5.376  -3.862
  815    HA   ASP 107           HA       ASP 107   9.011  -6.956  -6.262
  816   1HB   ASP 107          2HB       ASP 107   8.759  -4.155  -6.064
  817   2HB   ASP 107          1HB       ASP 107  10.271  -4.435  -6.920
  818    H    TYR 108           H        TYR 108  10.978  -7.114  -7.676
  819    HA   TYR 108           HA       TYR 108  13.404  -7.165  -6.006
  820   1HB   TYR 108          2HB       TYR 108  12.462  -9.005  -8.205
  821   2HB   TYR 108          1HB       TYR 108  14.155  -8.941  -7.720
  822    HD1  TYR 108           1HD      TYR 108  11.081  -8.754  -5.602
  823    HD2  TYR 108           2HD      TYR 108  14.552 -10.985  -6.648
  824    HE1  TYR 108           1HE      TYR 108  10.612 -10.322  -3.774
  825    HE2  TYR 108           2HE      TYR 108  14.084 -12.565  -4.828
  826    HH   TYR 108           HH       TYR 108  12.090 -11.957  -2.319
  827    H    ASP 109           H        ASP 109  15.368  -6.282  -6.945
  828    HA   ASP 109           HA       ASP 109  14.538  -4.367  -9.032
  829   1HB   ASP 109          2HB       ASP 109  14.425  -3.676  -6.450
  830   2HB   ASP 109          1HB       ASP 109  16.098  -3.242  -6.791
  831    H    ARG 110           H        ARG 110  16.813  -2.662  -8.672
  832    HA   ARG 110           HA       ARG 110  18.318  -3.853 -10.767
  833   1HB   ARG 110          2HB       ARG 110  18.963  -1.324  -9.262
  834   2HB   ARG 110          1HB       ARG 110  19.461  -1.759 -10.889
  835   1HG   ARG 110          2HG       ARG 110  17.640  -0.844 -11.750
  836   2HG   ARG 110          1HG       ARG 110  16.600  -1.804 -10.694
  837   1HD   ARG 110          2HD       ARG 110  16.538  -0.170  -9.055
  838   2HD   ARG 110          1HD       ARG 110  18.028   0.589  -9.613
  839    HE   ARG 110           HE       ARG 110  16.774   1.498 -11.478
  840   1HH1  ARG 110          1HH1      ARG 110  14.897   0.178  -8.820
  841   2HH1  ARG 110          2HH1      ARG 110  13.482   1.111  -9.209
  842   1HH2  ARG 110          1HH2      ARG 110  14.904   2.702 -11.991
  843   2HH2  ARG 110          2HH2      ARG 110  13.483   2.546 -10.992
  844    H    SER 111           H        SER 111  18.548  -4.714  -7.674
  845    HA   SER 111           HA       SER 111  21.438  -4.243  -7.428
  846   1HB   SER 111          2HB       SER 111  19.516  -4.883  -5.178
  847   2HB   SER 111          1HB       SER 111  21.207  -4.406  -5.030
  848    HG   SER 111           HG       SER 111  20.438  -2.424  -6.223
  849    H    GLY 112           H        GLY 112  19.448  -6.387  -8.579
  850   1HA   GLY 112          2HA       GLY 112  20.562  -8.494  -9.216
  851   2HA   GLY 112          1HA       GLY 112  20.973  -8.677  -7.520
  852    H    ARG 113           H        ARG 113  18.369  -7.892  -6.475
  853    HA   ARG 113           HA       ARG 113  16.458  -9.782  -7.295
  854   1HB   ARG 113          2HB       ARG 113  18.608 -10.777  -5.479
  855   2HB   ARG 113          1HB       ARG 113  16.957 -11.252  -5.107
  856   1HG   ARG 113          2HG       ARG 113  18.477 -11.803  -7.641
  857   2HG   ARG 113          1HG       ARG 113  17.969 -12.967  -6.414
  858   1HD   ARG 113          2HD       ARG 113  15.722 -11.443  -7.376
  859   2HD   ARG 113          1HD       ARG 113  16.578 -12.205  -8.715
  860    HE   ARG 113           HE       ARG 113  16.071 -13.971  -6.498
  861   1HH1  ARG 113          1HH1      ARG 113  14.756 -12.616  -9.453
  862   2HH1  ARG 113          2HH1      ARG 113  13.684 -13.958  -9.739
  863   1HH2  ARG 113          1HH2      ARG 113  14.675 -15.730  -6.860
  864   2HH2  ARG 113          2HH2      ARG 113  13.652 -15.743  -8.277
  865    H    SER 114           H        SER 114  17.119  -9.916  -3.887
  866    HA   SER 114           HA       SER 114  14.768  -8.264  -3.487
  867   1HB   SER 114          2HB       SER 114  15.865  -9.532  -1.115
  868   2HB   SER 114          1HB       SER 114  14.269  -9.711  -1.841
  869    HG   SER 114           HG       SER 114  15.364 -11.689  -1.875
  870    H    LEU 115           H        LEU 115  14.750  -6.778  -1.718
  871    HA   LEU 115           HA       LEU 115  17.062  -5.696  -0.530
  872   1HB   LEU 115          2HB       LEU 115  16.555  -3.435  -1.991
  873   2HB   LEU 115          1HB       LEU 115  17.921  -4.504  -2.216
  874    HG   LEU 115           HG       LEU 115  16.757  -5.656  -4.028
  875   1HD1  LEU 115          1HD1      LEU 115  14.452  -4.369  -2.918
  876   2HD1  LEU 115          2HD1      LEU 115  14.543  -5.618  -4.161
  877   3HD1  LEU 115          3HD1      LEU 115  14.629  -3.915  -4.614
  878   1HD2  LEU 115          1HD2      LEU 115  17.495  -4.135  -5.470
  879   2HD2  LEU 115          2HD2      LEU 115  17.826  -3.121  -4.064
  880   3HD2  LEU 115          3HD2      LEU 115  16.308  -2.942  -4.944
  881    H    GLY 116           H        GLY 116  13.781  -5.716  -1.302
  882   1HA   GLY 116          2HA       GLY 116  12.275  -5.390   0.574
  883   2HA   GLY 116          1HA       GLY 116  13.288  -4.037   1.063
  884    H    THR 117           H        THR 117  13.559  -2.898  -1.621
  885    HA   THR 117           HA       THR 117  11.734  -1.264  -2.319
  886    HB   THR 117           HB       THR 117  12.651  -3.330  -4.321
  887    HG1  THR 117           1HG      THR 117  14.297  -1.605  -4.646
  888   1HG2  THR 117          1HG2      THR 117  11.849  -0.449  -4.746
  889   2HG2  THR 117          2HG2      THR 117  10.835  -1.839  -5.131
  890   3HG2  THR 117          3HG2      THR 117  12.358  -1.595  -5.985
  891    H    ALA 118           H        ALA 118   9.639  -1.021  -2.924
  892    HA   ALA 118           HA       ALA 118   7.966  -3.330  -3.334
  893   1HB   ALA 118          1HB       ALA 118   8.381  -2.273  -0.708
  894   2HB   ALA 118          2HB       ALA 118   7.370  -3.626  -1.215
  895   3HB   ALA 118          3HB       ALA 118   6.709  -1.990  -1.199
  896    H    ASP 119           H        ASP 119   5.750  -2.753  -3.680
  897    HA   ASP 119           HA       ASP 119   5.377  -0.036  -4.739
  898   1HB   ASP 119          2HB       ASP 119   4.925  -1.637  -6.447
  899   2HB   ASP 119          1HB       ASP 119   4.036  -2.678  -5.338
  900    H    VAL 120           H        VAL 120   4.498   1.223  -3.227
  901    HA   VAL 120           HA       VAL 120   2.446   0.179  -1.451
  902    HB   VAL 120           HB       VAL 120   4.070   2.719  -1.493
  903   1HG1  VAL 120          1HG1      VAL 120   1.672   2.002  -0.047
  904   2HG1  VAL 120          2HG1      VAL 120   2.434   3.571  -0.291
  905   3HG1  VAL 120          3HG1      VAL 120   3.000   2.508   0.998
  906   1HG2  VAL 120          1HG2      VAL 120   5.415   1.790   0.115
  907   2HG2  VAL 120          2HG2      VAL 120   5.047   0.395  -0.909
  908   3HG2  VAL 120          3HG2      VAL 120   4.185   0.627   0.621
  909    H    HIS 121           H        HIS 121   0.303   0.730  -1.775
  910    HA   HIS 121           HA       HIS 121  -0.187   2.919  -3.688
  911   1HB   HIS 121          2HB       HIS 121  -1.044   0.123  -3.682
  912   2HB   HIS 121          1HB       HIS 121  -2.383   1.254  -3.869
  913    HD1  HIS 121           1HD      HIS 121   0.431  -0.271  -5.720
  914    HD2  HIS 121           2HD      HIS 121  -2.124   2.997  -6.162
  915    HE1  HIS 121           1HE      HIS 121   0.589   0.402  -8.136
  916    HE2  HIS 121           2HE      HIS 121  -0.804   2.495  -8.326
  917    H    PHE 122           H        PHE 122  -1.329   4.548  -2.908
  918    HA   PHE 122           HA       PHE 122  -3.393   3.979  -0.884
  919   1HB   PHE 122          2HB       PHE 122  -2.610   6.756  -0.810
  920   2HB   PHE 122          1HB       PHE 122  -2.674   5.589   0.498
  921    HD1  PHE 122           1HD      PHE 122  -0.791   5.552   1.739
  922    HD2  PHE 122           2HD      PHE 122  -0.419   6.149  -2.457
  923    HE1  PHE 122           1HE      PHE 122   1.652   5.682   1.978
  924    HE2  PHE 122           2HE      PHE 122   2.023   6.273  -2.225
  925    HZ   PHE 122           HZ       PHE 122   3.063   6.044  -0.006
  926    H    GLU 123           H        GLU 123  -5.184   5.611  -0.918
  927    HA   GLU 123           HA       GLU 123  -6.004   6.076  -3.650
  928   1HB   GLU 123          2HB       GLU 123  -7.854   7.278  -1.878
  929   2HB   GLU 123          1HB       GLU 123  -8.033   5.782  -2.780
  930   1HG   GLU 123          2HG       GLU 123  -8.463   5.179  -0.584
  931   2HG   GLU 123          1HG       GLU 123  -6.793   4.676  -0.844
  932    H    ARG 124           H        ARG 124  -4.330   7.852  -1.304
  933    HA   ARG 124           HA       ARG 124  -5.273  10.428  -2.371
  934   1HB   ARG 124          2HB       ARG 124  -3.799   9.839   0.198
  935   2HB   ARG 124          1HB       ARG 124  -4.357  11.422  -0.323
  936   1HG   ARG 124          2HG       ARG 124  -6.424  11.056   0.418
  937   2HG   ARG 124          1HG       ARG 124  -6.476   9.429  -0.263
  938   1HD   ARG 124          2HD       ARG 124  -5.082   8.653   1.643
  939   2HD   ARG 124          1HD       ARG 124  -5.213  10.268   2.343
  940    HE   ARG 124           HE       ARG 124  -7.376   8.305   2.047
  941   1HH1  ARG 124          1HH1      ARG 124  -6.206  11.372   3.279
  942   2HH1  ARG 124          2HH1      ARG 124  -7.594  11.638   4.300
  943   1HH2  ARG 124          1HH2      ARG 124  -9.187   8.637   3.410
  944   2HH2  ARG 124          2HH2      ARG 124  -9.281  10.079   4.378
  945    H    ARG 125           H        ARG 125  -3.841  11.848  -3.301
  946    HA   ARG 125           HA       ARG 125  -1.266  10.753  -3.996
  947   1HB   ARG 125          2HB       ARG 125  -1.088  12.835  -5.405
  948   2HB   ARG 125          1HB       ARG 125  -2.428  11.769  -5.797
  949   1HG   ARG 125          2HG       ARG 125  -3.157  13.806  -3.860
  950   2HG   ARG 125          1HG       ARG 125  -2.565  14.484  -5.378
  951   1HD   ARG 125          2HD       ARG 125  -4.503  14.022  -6.362
  952   2HD   ARG 125          1HD       ARG 125  -4.320  12.314  -5.963
  953    HE   ARG 125           HE       ARG 125  -5.681  14.331  -4.299
  954   1HH1  ARG 125          1HH1      ARG 125  -5.183  11.017  -5.295
  955   2HH1  ARG 125          2HH1      ARG 125  -6.333  10.360  -4.171
  956   1HH2  ARG 125          1HH2      ARG 125  -7.211  13.483  -2.815
  957   2HH2  ARG 125          2HH2      ARG 125  -7.516  11.763  -2.778
  958    H    ALA 126           H        ALA 126  -2.498  13.552  -2.144
  959    HA   ALA 126           HA       ALA 126  -0.008  14.700  -1.574
  960   1HB   ALA 126          1HB       ALA 126  -2.701  14.831  -0.338
  961   2HB   ALA 126          2HB       ALA 126  -1.691  16.117  -0.998
  962   3HB   ALA 126          3HB       ALA 126  -1.331  15.440   0.590
  963    H    ASP 127           H        ASP 127  -1.862  12.298   0.238
  964    HA   ASP 127           HA       ASP 127  -0.130  11.896   2.371
  965   1HB   ASP 127          2HB       ASP 127  -2.388  10.554   1.323
  966   2HB   ASP 127          1HB       ASP 127  -1.129   9.336   1.523
  967    H    ALA 128           H        ALA 128   0.082  10.782  -0.918
  968    HA   ALA 128           HA       ALA 128   2.320   9.029  -0.453
  969   1HB   ALA 128          1HB       ALA 128   0.964  10.054  -2.940
  970   2HB   ALA 128          2HB       ALA 128   0.943   8.420  -2.278
  971   3HB   ALA 128          3HB       ALA 128   2.424   9.059  -3.003
  972    H    LEU 129           H        LEU 129   1.741  12.258  -1.696
  973    HA   LEU 129           HA       LEU 129   4.367  12.915  -2.447
  974   1HB   LEU 129          2HB       LEU 129   2.361  14.250  -3.034
  975   2HB   LEU 129          1HB       LEU 129   2.252  14.781  -1.367
  976    HG   LEU 129           HG       LEU 129   4.878  15.301  -2.506
  977   1HD1  LEU 129          1HD1      LEU 129   2.926  17.161  -3.658
  978   2HD1  LEU 129          2HD1      LEU 129   2.946  15.556  -4.390
  979   3HD1  LEU 129          3HD1      LEU 129   4.423  16.517  -4.333
  980   1HD2  LEU 129          1HD2      LEU 129   4.585  17.406  -1.470
  981   2HD2  LEU 129          2HD2      LEU 129   3.846  16.216  -0.396
  982   3HD2  LEU 129          3HD2      LEU 129   2.830  17.222  -1.429
  983    H    LYS 130           H        LYS 130   2.644  13.432   0.615
  984    HA   LYS 130           HA       LYS 130   4.768  14.538   2.062
  985   1HB   LYS 130          2HB       LYS 130   2.865  14.702   3.310
  986   2HB   LYS 130          1HB       LYS 130   2.210  13.193   2.696
  987   1HG   LYS 130          2HG       LYS 130   4.303  12.326   4.226
  988   2HG   LYS 130          1HG       LYS 130   3.727  13.731   5.130
  989   1HD   LYS 130          2HD       LYS 130   2.182  12.366   5.997
  990   2HD   LYS 130          1HD       LYS 130   1.395  12.437   4.419
  991   1HE   LYS 130          2HE       LYS 130   2.522  10.440   3.705
  992   2HE   LYS 130          1HE       LYS 130   3.500  10.414   5.173
  993   1HZ   LYS 130          1HZ       LYS 130   0.568   9.974   4.962
  994   2HZ   LYS 130          2HZ       LYS 130   1.395  10.146   6.438
  995   3HZ   LYS 130          3HZ       LYS 130   1.749   8.844   5.419
  996    H    ALA 131           H        ALA 131   3.849  11.229   1.421
  997    HA   ALA 131           HA       ALA 131   5.653   9.965   3.127
  998   1HB   ALA 131          1HB       ALA 131   4.064   8.489   2.415
  999   2HB   ALA 131          2HB       ALA 131   5.385   8.060   1.328
 1000   3HB   ALA 131          3HB       ALA 131   4.083   9.107   0.762
 1001    H    MET 132           H        MET 132   5.916  10.950  -0.246
 1002    HA   MET 132           HA       MET 132   8.513   9.747  -0.528
 1003   1HB   MET 132          2HB       MET 132   8.305  10.113  -2.789
 1004   2HB   MET 132          1HB       MET 132   6.616  10.017  -2.316
 1005   1HG   MET 132          2HG       MET 132   6.213  12.164  -2.826
 1006   2HG   MET 132          1HG       MET 132   7.785  12.710  -2.245
 1007   1HE   MET 132          1HE       MET 132   9.893  12.502  -3.374
 1008   2HE   MET 132          2HE       MET 132  10.133  12.491  -5.121
 1009   3HE   MET 132          3HE       MET 132   9.947  10.971  -4.247
 1010    H    LYS 133           H        LYS 133   7.325  12.812   0.542
 1011    HA   LYS 133           HA       LYS 133   9.911  14.047   0.049
 1012   1HB   LYS 133          2HB       LYS 133   7.219  14.947   0.817
 1013   2HB   LYS 133          1HB       LYS 133   8.519  15.776   1.663
 1014   1HG   LYS 133          2HG       LYS 133   8.017  17.062  -0.253
 1015   2HG   LYS 133          1HG       LYS 133   9.543  16.241  -0.586
 1016   1HD   LYS 133          2HD       LYS 133   8.100  14.440  -1.708
 1017   2HD   LYS 133          1HD       LYS 133   6.808  15.639  -1.668
 1018   1HE   LYS 133          2HE       LYS 133   8.160  15.526  -3.799
 1019   2HE   LYS 133          1HE       LYS 133   8.002  17.119  -3.059
 1020   1HZ   LYS 133          1HZ       LYS 133  10.190  17.130  -2.399
 1021   2HZ   LYS 133          2HZ       LYS 133  10.305  16.301  -3.875
 1022   3HZ   LYS 133          3HZ       LYS 133  10.336  15.438  -2.415
 1023    H    GLN 134           H        GLN 134   7.848  13.177   2.780
 1024    HA   GLN 134           HA       GLN 134   9.580  14.070   4.791
 1025   1HB   GLN 134          2HB       GLN 134   7.060  12.755   4.640
 1026   2HB   GLN 134          1HB       GLN 134   8.058  11.889   5.801
 1027   1HG   GLN 134          2HG       GLN 134   6.542  14.065   6.364
 1028   2HG   GLN 134          1HG       GLN 134   7.925  13.525   7.311
 1029   1HE2  GLN 134          1HE2      GLN 134   7.027  15.623   4.609
 1030   2HE2  GLN 134          2HE2      GLN 134   8.251  16.813   4.905
 1031    H    TYR 135           H        TYR 135   9.070  10.710   3.645
 1032    HA   TYR 135           HA       TYR 135  11.144   9.849   5.485
 1033   1HB   TYR 135          2HB       TYR 135   9.741   8.052   3.528
 1034   2HB   TYR 135          1HB       TYR 135  10.407   7.657   5.110
 1035    HD1  TYR 135           1HD      TYR 135   9.290   9.385   6.998
 1036    HD2  TYR 135           2HD      TYR 135   7.447   7.895   3.467
 1037    HE1  TYR 135           1HE      TYR 135   7.079   9.757   8.003
 1038    HE2  TYR 135           2HE      TYR 135   5.232   8.265   4.461
 1039    HH   TYR 135           HH       TYR 135   4.739   8.831   7.718
 1040    H    LYS 136           H        LYS 136  10.991  10.815   2.239
 1041    HA   LYS 136           HA       LYS 136  13.087   9.206   1.189
 1042   1HB   LYS 136          2HB       LYS 136  11.298  10.847   0.051
 1043   2HB   LYS 136          1HB       LYS 136  12.671  11.941   0.115
 1044   1HG   LYS 136          2HG       LYS 136  13.742   9.597  -0.879
 1045   2HG   LYS 136          1HG       LYS 136  12.153   9.711  -1.658
 1046   1HD   LYS 136          2HD       LYS 136  12.667  11.700  -2.712
 1047   2HD   LYS 136          1HD       LYS 136  13.915  12.123  -1.539
 1048   1HE   LYS 136          2HE       LYS 136  14.330   9.700  -3.203
 1049   2HE   LYS 136          1HE       LYS 136  14.506  11.272  -3.979
 1050   1HZ   LYS 136          1HZ       LYS 136  16.616  10.925  -3.226
 1051   2HZ   LYS 136          2HZ       LYS 136  16.123  10.048  -1.861
 1052   3HZ   LYS 136          3HZ       LYS 136  15.975  11.738  -1.881
 1053    H    GLY 137           H        GLY 137  15.230   9.351   1.503
 1054   1HA   GLY 137          2HA       GLY 137  17.272  10.461   1.800
 1055   2HA   GLY 137          1HA       GLY 137  16.395  11.913   2.267
 1056    H    VAL 138           H        VAL 138  14.831   9.729   3.980
 1057    HA   VAL 138           HA       VAL 138  16.222  10.368   6.410
 1058    HB   VAL 138           HB       VAL 138  13.807   8.659   5.818
 1059   1HG1  VAL 138          1HG1      VAL 138  15.519   8.438   8.091
 1060   2HG1  VAL 138          2HG1      VAL 138  14.013   7.587   7.751
 1061   3HG1  VAL 138          3HG1      VAL 138  13.979   9.134   8.597
 1062   1HG2  VAL 138          1HG2      VAL 138  13.286  10.690   7.693
 1063   2HG2  VAL 138          2HG2      VAL 138  12.750  10.598   6.015
 1064   3HG2  VAL 138          3HG2      VAL 138  14.259  11.420   6.415
 1065    HA   PRO 139           HA       PRO 139  19.124   6.992   6.174
 1066   1HB   PRO 139          2HB       PRO 139  19.382   7.536   9.076
 1067   2HB   PRO 139          1HB       PRO 139  20.625   7.509   7.820
 1068   1HG   PRO 139          2HG       PRO 139  19.786   9.814   8.864
 1069   2HG   PRO 139          1HG       PRO 139  20.169   9.676   7.137
 1070   1HD   PRO 139          2HD       PRO 139  17.500   9.710   8.492
 1071   2HD   PRO 139          1HD       PRO 139  18.005  10.485   6.976
 1072    H    LEU 140           H        LEU 140  19.000   4.857   6.508
 1073    HA   LEU 140           HA       LEU 140  17.544   3.737   8.740
 1074   1HB   LEU 140          2HB       LEU 140  15.958   4.249   6.660
 1075   2HB   LEU 140          1HB       LEU 140  16.648   2.747   6.073
 1076    HG   LEU 140           HG       LEU 140  15.924   1.971   8.551
 1077   1HD1  LEU 140          1HD1      LEU 140  13.839   3.984   7.723
 1078   2HD1  LEU 140          2HD1      LEU 140  14.970   4.185   9.062
 1079   3HD1  LEU 140          3HD1      LEU 140  13.765   2.897   9.111
 1080   1HD2  LEU 140          1HD2      LEU 140  14.058   0.882   7.520
 1081   2HD2  LEU 140          2HD2      LEU 140  15.377   0.937   6.351
 1082   3HD2  LEU 140          3HD2      LEU 140  14.028   2.064   6.212
 1083    H    ASP 141           H        ASP 141  19.384   2.769   9.330
 1084    HA   ASP 141           HA       ASP 141  21.015   1.163   9.403
 1085   1HB   ASP 141          2HB       ASP 141  19.559  -0.183   7.707
 1086   2HB   ASP 141          1HB       ASP 141  20.648   0.474   6.491
 1087    H    GLY 142           H        GLY 142  22.918   0.732   7.213
 1088   1HA   GLY 142          2HA       GLY 142  24.473   3.022   7.719
 1089   2HA   GLY 142          1HA       GLY 142  24.843   1.775   6.543
 1090    H    ARG 143           H        ARG 143  21.884   2.871   5.571
 1091    HA   ARG 143           HA       ARG 143  22.920   5.222   4.176
 1092   1HB   ARG 143          2HB       ARG 143  22.397   2.598   3.013
 1093   2HB   ARG 143          1HB       ARG 143  21.480   3.874   2.227
 1094   1HG   ARG 143          2HG       ARG 143  23.626   5.127   1.953
 1095   2HG   ARG 143          1HG       ARG 143  24.462   3.686   2.533
 1096   1HD   ARG 143          2HD       ARG 143  23.360   2.402   0.700
 1097   2HD   ARG 143          1HD       ARG 143  22.730   3.927   0.079
 1098    HE   ARG 143           HE       ARG 143  25.137   4.609  -0.119
 1099   1HH1  ARG 143          1HH1      ARG 143  24.169   1.238  -0.230
 1100   2HH1  ARG 143          2HH1      ARG 143  25.559   0.747  -1.161
 1101   1HH2  ARG 143          1HH2      ARG 143  26.925   3.973  -1.381
 1102   2HH2  ARG 143          2HH2      ARG 143  27.114   2.301  -1.828
 1103    HA   PRO 144           HA       PRO 144  18.757   6.755   4.715
 1104   1HB   PRO 144          2HB       PRO 144  19.008   8.048   2.081
 1105   2HB   PRO 144          1HB       PRO 144  18.786   8.780   3.673
 1106   1HG   PRO 144          2HG       PRO 144  21.117   8.960   2.359
 1107   2HG   PRO 144          1HG       PRO 144  21.051   8.805   4.125
 1108   1HD   PRO 144          2HD       PRO 144  21.635   6.714   2.059
 1109   2HD   PRO 144          1HD       PRO 144  22.427   7.003   3.625
 1110    H    MET 145           H        MET 145  16.656   6.555   3.848
 1111    HA   MET 145           HA       MET 145  16.450   4.262   2.045
 1112   1HB   MET 145          2HB       MET 145  14.223   3.939   2.823
 1113   2HB   MET 145          1HB       MET 145  15.260   4.175   4.224
 1114   1HG   MET 145          2HG       MET 145  14.423   6.705   3.793
 1115   2HG   MET 145          1HG       MET 145  13.026   5.794   3.211
 1116   1HE   MET 145          1HE       MET 145  12.339   3.370   5.765
 1117   2HE   MET 145          2HE       MET 145  11.879   4.166   4.260
 1118   3HE   MET 145          3HE       MET 145  11.143   4.666   5.782
 1119    H    ASP 146           H        ASP 146  15.038   4.183   0.323
 1120    HA   ASP 146           HA       ASP 146  14.542   6.810  -0.907
 1121   1HB   ASP 146          2HB       ASP 146  15.986   4.876  -1.994
 1122   2HB   ASP 146          1HB       ASP 146  14.400   4.291  -2.499
 1123    H    ILE 147           H        ILE 147  12.591   7.358  -1.741
 1124    HA   ILE 147           HA       ILE 147  10.376   5.573  -1.900
 1125    HB   ILE 147           HB       ILE 147   9.107   7.369  -0.294
 1126   1HG1  ILE 147          2HG1      ILE 147  11.805   7.711   0.371
 1127   2HG1  ILE 147          1HG1      ILE 147  10.409   8.292   1.271
 1128   1HG2  ILE 147          1HG2      ILE 147  10.154   5.021   1.138
 1129   2HG2  ILE 147          2HG2      ILE 147   9.374   4.695  -0.413
 1130   3HG2  ILE 147          3HG2      ILE 147   8.489   5.542   0.858
 1131   1HD1  ILE 147          1HD1      ILE 147  10.408   6.271   2.610
 1132   2HD1  ILE 147          2HD1      ILE 147  11.977   7.075   2.684
 1133   3HD1  ILE 147          3HD1      ILE 147  11.767   5.639   1.679
 1134    H    GLN 148           H        GLN 148   9.683   6.273  -3.824
 1135    HA   GLN 148           HA       GLN 148   9.414   9.188  -4.192
 1136   1HB   GLN 148          2HB       GLN 148   9.817   7.677  -6.665
 1137   2HB   GLN 148          1HB       GLN 148  10.567   9.173  -6.129
 1138   1HG   GLN 148          2HG       GLN 148  12.429   8.130  -5.533
 1139   2HG   GLN 148          1HG       GLN 148  11.542   6.897  -4.637
 1140   1HE2  GLN 148          1HE2      GLN 148  13.470   5.708  -5.591
 1141   2HE2  GLN 148          2HE2      GLN 148  13.214   4.947  -7.129
 1142    H    LEU 149           H        LEU 149   7.803   9.728  -5.942
 1143    HA   LEU 149           HA       LEU 149   5.516   7.911  -5.652
 1144   1HB   LEU 149          2HB       LEU 149   5.854  10.736  -5.506
 1145   2HB   LEU 149          1HB       LEU 149   4.796  10.370  -6.857
 1146    HG   LEU 149           HG       LEU 149   3.241   9.249  -5.459
 1147   1HD1  LEU 149          1HD1      LEU 149   3.640   8.450  -3.353
 1148   2HD1  LEU 149          2HD1      LEU 149   4.814   9.712  -2.977
 1149   3HD1  LEU 149          3HD1      LEU 149   5.275   8.362  -4.013
 1150   1HD2  LEU 149          1HD2      LEU 149   4.234  11.912  -4.613
 1151   2HD2  LEU 149          2HD2      LEU 149   3.039  11.119  -3.586
 1152   3HD2  LEU 149          3HD2      LEU 149   2.670  11.442  -5.280
 1153    H    VAL 150           H        VAL 150   4.406   7.177  -7.450
 1154    HA   VAL 150           HA       VAL 150   5.123   8.201 -10.068
 1155    HB   VAL 150           HB       VAL 150   6.615   6.468 -10.254
 1156   1HG1  VAL 150          1HG1      VAL 150   6.869   5.069  -8.562
 1157   2HG1  VAL 150          2HG1      VAL 150   5.496   4.136  -9.154
 1158   3HG1  VAL 150          3HG1      VAL 150   5.244   5.427  -7.979
 1159   1HG2  VAL 150          1HG2      VAL 150   5.800   5.037 -11.816
 1160   2HG2  VAL 150          2HG2      VAL 150   4.427   6.142 -11.735
 1161   3HG2  VAL 150          3HG2      VAL 150   4.384   4.614 -10.854
 1162    H    ALA 151           H        ALA 151   3.427   8.280 -11.372
 1163    HA   ALA 151           HA       ALA 151   1.258   8.210 -12.110
 1164   1HB   ALA 151          1HB       ALA 151   2.053   5.527 -11.622
 1165   2HB   ALA 151          2HB       ALA 151   0.861   6.127 -12.775
 1166   3HB   ALA 151          3HB       ALA 151   0.366   5.691 -11.140
 1167    H    SER 152           H        SER 152   0.915   9.855 -10.419
 1168    HA   SER 152           HA       SER 152  -1.329   9.305  -8.768
 1169   1HB   SER 152          2HB       SER 152   0.121  10.098  -6.660
 1170   2HB   SER 152          1HB       SER 152  -0.060   8.393  -7.077
 1171    HG   SER 152           HG       SER 152   1.955   8.342  -7.859
 1172    H    GLN 153           H        GLN 153   1.205  11.477  -7.729
 1173    HA   GLN 153           HA       GLN 153  -0.449  13.794  -8.191
 1174   1HB   GLN 153          2HB       GLN 153   1.183  13.433  -6.244
 1175   2HB   GLN 153          1HB       GLN 153   2.462  13.802  -7.392
 1176   1HG   GLN 153          2HG       GLN 153   2.082  15.830  -6.354
 1177   2HG   GLN 153          1HG       GLN 153   1.147  15.964  -7.841
 1178   1HE2  GLN 153          1HE2      GLN 153   1.094  16.261  -4.522
 1179   2HE2  GLN 153          2HE2      GLN 153  -0.616  16.378  -4.290
 1180    H    ILE 154           H        ILE 154   1.315  11.941 -10.157
 1181    HA   ILE 154           HA       ILE 154   2.761  13.868 -11.693
 1182    HB   ILE 154           HB       ILE 154   3.249  12.066 -13.208
 1183   1HG1  ILE 154          2HG1      ILE 154   1.673   9.993 -11.850
 1184   2HG1  ILE 154          1HG1      ILE 154   0.687  11.199 -12.669
 1185   1HG2  ILE 154          1HG2      ILE 154   4.685  11.227 -11.732
 1186   2HG2  ILE 154          2HG2      ILE 154   3.397  10.312 -10.945
 1187   3HG2  ILE 154          3HG2      ILE 154   3.740  11.967 -10.437
 1188   1HD1  ILE 154          1HD1      ILE 154   1.786  10.741 -14.759
 1189   2HD1  ILE 154          2HD1      ILE 154   1.182   9.236 -14.063
 1190   3HD1  ILE 154          3HD1      ILE 154   2.900   9.626 -13.963
 1191    H    ASP 155           H        ASP 155  -0.383  13.659 -11.302
 1192    HA   ASP 155           HA       ASP 155  -1.435  13.548 -13.948
 1193   1HB   ASP 155          2HB       ASP 155  -2.585  13.312 -11.562
 1194   2HB   ASP 155          1HB       ASP 155  -2.857  15.038 -11.788
 1195    H    LEU 156           H        LEU 156   0.198  15.924 -12.158
 1196    HA   LEU 156           HA       LEU 156  -0.857  18.243 -13.452
 1197   1HB   LEU 156          2HB       LEU 156   1.873  18.045 -12.209
 1198   2HB   LEU 156          1HB       LEU 156   0.833  19.450 -12.329
 1199    HG   LEU 156           HG       LEU 156   0.486  17.078 -10.499
 1200   1HD1  LEU 156          1HD1      LEU 156   0.917  20.006  -9.946
 1201   2HD1  LEU 156          2HD1      LEU 156   2.121  18.730  -9.770
 1202   3HD1  LEU 156          3HD1      LEU 156   0.691  18.741  -8.738
 1203   1HD2  LEU 156          1HD2      LEU 156  -1.665  17.884 -11.492
 1204   2HD2  LEU 156          2HD2      LEU 156  -1.350  19.450 -10.742
 1205   3HD2  LEU 156          3HD2      LEU 156  -1.560  18.017  -9.736
 1206    H    GLU 157           H        GLU 157   1.771  16.022 -14.007
 1207    HA   GLU 157           HA       GLU 157   3.112  17.310 -16.084
 1208   1HB   GLU 157          2HB       GLU 157   2.794  14.548 -15.091
 1209   2HB   GLU 157          1HB       GLU 157   3.331  14.701 -16.758
 1210   1HG   GLU 157          2HG       GLU 157   4.931  16.488 -15.434
 1211   2HG   GLU 157          1HG       GLU 157   4.753  15.170 -14.276
 1212    H    HIS 158           H        HIS 158   2.545  17.761 -18.106
 1213    HA   HIS 158           HA       HIS 158   0.349  16.252 -19.350
 1214   1HB   HIS 158          2HB       HIS 158  -0.231  18.627 -18.447
 1215   2HB   HIS 158          1HB       HIS 158   0.706  19.201 -19.821
 1216    HD1  HIS 158           1HD      HIS 158  -0.235  17.369 -22.041
 1217    HD2  HIS 158           2HD      HIS 158  -2.789  19.017 -19.201
 1218    HE1  HIS 158           1HE      HIS 158  -2.522  17.367 -23.097
 1219    HE2  HIS 158           2HE      HIS 158  -4.014  18.526 -21.425
  Start of MODEL    2
    1    H    MET   1           H        MET   1 -71.007 106.987 -15.887
    2    HA   MET   1           HA       MET   1 -69.474 104.605 -15.477
    3   1HB   MET   1          2HB       MET   1 -70.539 105.933 -17.674
    4   2HB   MET   1          1HB       MET   1 -68.804 106.147 -17.863
    5   1HG   MET   1          2HG       MET   1 -69.665 103.424 -17.189
    6   2HG   MET   1          1HG       MET   1 -70.191 104.019 -18.763
    7   1HE   MET   1          1HE       MET   1 -68.048 102.228 -16.879
    8   2HE   MET   1          2HE       MET   1 -66.525 103.112 -16.786
    9   3HE   MET   1          3HE       MET   1 -66.718 101.808 -17.957
   10    H    ALA   2           H        ALA   2 -68.659 107.961 -16.292
   11    HA   ALA   2           HA       ALA   2 -66.857 109.273 -15.892
   12   1HB   ALA   2          1HB       ALA   2 -67.521 108.576 -13.531
   13   2HB   ALA   2          2HB       ALA   2 -65.901 109.233 -13.761
   14   3HB   ALA   2          3HB       ALA   2 -66.131 107.492 -13.592
   15    H    ASP   3           H        ASP   3 -66.558 106.903 -17.588
   16    HA   ASP   3           HA       ASP   3 -63.639 106.845 -17.640
   17   1HB   ASP   3          2HB       ASP   3 -64.689 104.781 -16.449
   18   2HB   ASP   3          1HB       ASP   3 -65.160 104.291 -18.072
   19    H    LYS   4           H        LYS   4 -66.239 105.114 -19.307
   20    HA   LYS   4           HA       LYS   4 -66.958 105.080 -21.446
   21   1HB   LYS   4          2HB       LYS   4 -66.271 107.831 -20.943
   22   2HB   LYS   4          1HB       LYS   4 -65.948 107.423 -22.624
   23   1HG   LYS   4          2HG       LYS   4 -68.133 108.141 -22.697
   24   2HG   LYS   4          1HG       LYS   4 -68.318 106.390 -22.575
   25   1HD   LYS   4          2HD       LYS   4 -69.222 106.498 -20.506
   26   2HD   LYS   4          1HD       LYS   4 -68.183 107.838 -20.012
   27   1HE   LYS   4          2HE       LYS   4 -69.547 109.412 -21.227
   28   2HE   LYS   4          1HE       LYS   4 -70.523 108.106 -21.896
   29   1HZ   LYS   4          1HZ       LYS   4 -71.372 107.616 -19.730
   30   2HZ   LYS   4          2HZ       LYS   4 -71.582 109.273 -20.024
   31   3HZ   LYS   4          3HZ       LYS   4 -70.337 108.746 -18.999
   32    H    MET   5           H        MET   5 -64.229 104.167 -20.673
   33    HA   MET   5           HA       MET   5 -63.153 104.027 -23.412
   34   1HB   MET   5          2HB       MET   5 -61.827 104.981 -21.190
   35   2HB   MET   5          1HB       MET   5 -61.298 103.306 -21.264
   36   1HG   MET   5          2HG       MET   5 -60.180 103.594 -23.226
   37   2HG   MET   5          1HG       MET   5 -61.231 104.906 -23.762
   38   1HE   MET   5          1HE       MET   5 -58.898 106.101 -24.620
   39   2HE   MET   5          2HE       MET   5 -58.646 107.529 -23.616
   40   3HE   MET   5          3HE       MET   5 -60.277 107.079 -24.118
   41    H    ASP   6           H        ASP   6 -61.896 101.963 -23.750
   42    HA   ASP   6           HA       ASP   6 -61.702  99.710 -23.809
   43   1HB   ASP   6          2HB       ASP   6 -62.395 100.157 -21.068
   44   2HB   ASP   6          1HB       ASP   6 -63.248  98.728 -21.645
   45    H    MET   7           H        MET   7 -64.857 101.035 -23.078
   46    HA   MET   7           HA       MET   7 -66.806 100.918 -24.221
   47   1HB   MET   7          2HB       MET   7 -65.430 100.890 -26.261
   48   2HB   MET   7          1HB       MET   7 -65.320  99.139 -26.158
   49   1HG   MET   7          2HG       MET   7 -67.788  99.027 -26.375
   50   2HG   MET   7          1HG       MET   7 -67.801 100.772 -26.630
   51   1HE   MET   7          1HE       MET   7 -66.432  97.323 -28.955
   52   2HE   MET   7          2HE       MET   7 -65.734  97.846 -27.421
   53   3HE   MET   7          3HE       MET   7 -64.966  98.303 -28.943
   54    H    SER   8           H        SER   8 -65.600  97.645 -24.920
   55    HA   SER   8           HA       SER   8 -68.073  96.507 -23.994
   56   1HB   SER   8          2HB       SER   8 -66.058  94.524 -24.465
   57   2HB   SER   8          1HB       SER   8 -67.479  94.901 -25.440
   58    HG   SER   8           HG       SER   8 -65.922  95.392 -26.821
   59    H    LEU   9           H        LEU   9 -67.011  97.808 -21.883
   60    HA   LEU   9           HA       LEU   9 -65.149  96.583 -20.255
   61   1HB   LEU   9          2HB       LEU   9 -66.793  98.766 -20.068
   62   2HB   LEU   9          1HB       LEU   9 -67.434  97.723 -18.813
   63    HG   LEU   9           HG       LEU   9 -64.589  97.763 -18.580
   64   1HD1  LEU   9          1HD1      LEU   9 -65.070  99.983 -19.846
   65   2HD1  LEU   9          2HD1      LEU   9 -64.015  99.989 -18.433
   66   3HD1  LEU   9          3HD1      LEU   9 -65.690 100.523 -18.285
   67   1HD2  LEU   9          1HD2      LEU   9 -65.070  98.463 -16.349
   68   2HD2  LEU   9          2HD2      LEU   9 -66.320  97.315 -16.833
   69   3HD2  LEU   9          3HD2      LEU   9 -66.669  99.044 -16.816
   70    H    ASP  10           H        ASP  10 -68.676  96.066 -20.285
   71    HA   ASP  10           HA       ASP  10 -68.692  94.189 -18.168
   72   1HB   ASP  10          2HB       ASP  10 -70.636  95.490 -19.525
   73   2HB   ASP  10          1HB       ASP  10 -70.763  93.894 -20.261
   74    H    ASP  11           H        ASP  11 -68.392  93.849 -21.653
   75    HA   ASP  11           HA       ASP  11 -68.519  91.022 -21.748
   76   1HB   ASP  11          2HB       ASP  11 -68.820  92.459 -23.739
   77   2HB   ASP  11          1HB       ASP  11 -67.124  92.923 -23.649
   78    H    ILE  12           H        ILE  12 -65.823  93.314 -21.532
   79    HA   ILE  12           HA       ILE  12 -63.708  91.484 -21.520
   80    HB   ILE  12           HB       ILE  12 -63.915  94.064 -19.970
   81   1HG1  ILE  12          2HG1      ILE  12 -62.396  93.717 -22.537
   82   2HG1  ILE  12          1HG1      ILE  12 -64.135  93.999 -22.584
   83   1HG2  ILE  12          1HG2      ILE  12 -61.798  92.050 -20.214
   84   2HG2  ILE  12          2HG2      ILE  12 -62.027  93.322 -19.010
   85   3HG2  ILE  12          3HG2      ILE  12 -61.266  93.699 -20.556
   86   1HD1  ILE  12          1HD1      ILE  12 -63.911  96.155 -22.075
   87   2HD1  ILE  12          2HD1      ILE  12 -62.225  95.932 -22.543
   88   3HD1  ILE  12          3HD1      ILE  12 -62.689  95.837 -20.843
   89    H    ILE  13           H        ILE  13 -65.546  92.861 -18.816
   90    HA   ILE  13           HA       ILE  13 -64.323  91.642 -16.686
   91    HB   ILE  13           HB       ILE  13 -67.265  92.178 -17.093
   92   1HG1  ILE  13          2HG1      ILE  13 -65.277  93.623 -15.337
   93   2HG1  ILE  13          1HG1      ILE  13 -65.576  94.082 -17.011
   94   1HG2  ILE  13          1HG2      ILE  13 -65.986  90.657 -15.007
   95   2HG2  ILE  13          2HG2      ILE  13 -67.701  90.957 -15.286
   96   3HG2  ILE  13          3HG2      ILE  13 -66.745  92.107 -14.351
   97   1HD1  ILE  13          1HD1      ILE  13 -67.892  93.854 -15.163
   98   2HD1  ILE  13          2HD1      ILE  13 -67.651  94.912 -16.554
   99   3HD1  ILE  13          3HD1      ILE  13 -66.826  95.255 -15.033
  100    H    LYS  14           H        LYS  14 -67.029  90.264 -18.562
  101    HA   LYS  14           HA       LYS  14 -67.019  87.787 -17.193
  102   1HB   LYS  14          2HB       LYS  14 -67.978  88.169 -20.019
  103   2HB   LYS  14          1HB       LYS  14 -68.558  87.022 -18.821
  104   1HG   LYS  14          2HG       LYS  14 -68.875  90.006 -18.622
  105   2HG   LYS  14          1HG       LYS  14 -70.107  88.900 -19.233
  106   1HD   LYS  14          2HD       LYS  14 -70.156  87.756 -17.077
  107   2HD   LYS  14          1HD       LYS  14 -68.901  88.839 -16.467
  108   1HE   LYS  14          2HE       LYS  14 -70.693  89.980 -15.680
  109   2HE   LYS  14          1HE       LYS  14 -70.682  90.656 -17.309
  110   1HZ   LYS  14          1HZ       LYS  14 -72.883  89.816 -16.457
  111   2HZ   LYS  14          2HZ       LYS  14 -72.253  88.247 -16.601
  112   3HZ   LYS  14          3HZ       LYS  14 -72.405  89.229 -17.976
  113    H    LEU  15           H        LEU  15 -65.404  88.894 -20.133
  114    HA   LEU  15           HA       LEU  15 -64.558  86.288 -20.930
  115   1HB   LEU  15          2HB       LEU  15 -64.670  88.796 -22.113
  116   2HB   LEU  15          1HB       LEU  15 -62.953  88.461 -21.991
  117    HG   LEU  15           HG       LEU  15 -64.850  86.465 -23.194
  118   1HD1  LEU  15          1HD1      LEU  15 -63.680  87.586 -25.348
  119   2HD1  LEU  15          2HD1      LEU  15 -63.884  89.005 -24.321
  120   3HD1  LEU  15          3HD1      LEU  15 -65.284  88.023 -24.757
  121   1HD2  LEU  15          1HD2      LEU  15 -62.034  86.835 -24.045
  122   2HD2  LEU  15          2HD2      LEU  15 -62.992  85.362 -23.905
  123   3HD2  LEU  15          3HD2      LEU  15 -62.319  86.117 -22.460
  124    H    ASN  16           H        ASN  16 -62.924  89.009 -19.327
  125    HA   ASN  16           HA       ASN  16 -60.405  87.665 -19.308
  126   1HB   ASN  16          2HB       ASN  16 -59.504  89.594 -18.480
  127   2HB   ASN  16          1HB       ASN  16 -60.984  90.245 -19.168
  128   1HD2  ASN  16          1HD2      ASN  16 -62.603  90.960 -17.815
  129   2HD2  ASN  16          2HD2      ASN  16 -62.341  91.247 -16.128
  130    H    ARG  17           H        ARG  17 -63.102  87.850 -17.099
  131    HA   ARG  17           HA       ARG  17 -61.643  86.671 -14.921
  132   1HB   ARG  17          2HB       ARG  17 -63.554  86.897 -13.666
  133   2HB   ARG  17          1HB       ARG  17 -63.829  88.138 -14.878
  134   1HG   ARG  17          2HG       ARG  17 -65.123  86.318 -16.150
  135   2HG   ARG  17          1HG       ARG  17 -65.114  85.447 -14.616
  136   1HD   ARG  17          2HD       ARG  17 -66.126  88.266 -14.962
  137   2HD   ARG  17          1HD       ARG  17 -67.154  86.834 -15.003
  138    HE   ARG  17           HE       ARG  17 -65.839  87.994 -12.674
  139   1HH1  ARG  17          1HH1      ARG  17 -67.725  85.365 -14.030
  140   2HH1  ARG  17          2HH1      ARG  17 -68.280  84.794 -12.480
  141   1HH2  ARG  17          1HH2      ARG  17 -66.544  87.226 -10.631
  142   2HH2  ARG  17          2HH2      ARG  17 -67.600  85.844 -10.554
  143    H    ASN  18           H        ASN  18 -63.535  85.539 -17.615
  144    HA   ASN  18           HA       ASN  18 -63.012  82.776 -16.745
  145   1HB   ASN  18          2HB       ASN  18 -65.464  83.570 -16.627
  146   2HB   ASN  18          1HB       ASN  18 -65.422  83.532 -18.387
  147   1HD2  ASN  18          1HD2      ASN  18 -65.907  81.693 -19.341
  148   2HD2  ASN  18          2HD2      ASN  18 -65.954  80.133 -18.584
  149    H    GLN  19           H        GLN  19 -61.115  83.846 -18.165
  150    HA   GLN  19           HA       GLN  19 -61.493  83.585 -20.991
  151   1HB   GLN  19          2HB       GLN  19 -58.883  83.652 -20.922
  152   2HB   GLN  19          1HB       GLN  19 -59.806  85.094 -20.528
  153   1HG   GLN  19          2HG       GLN  19 -58.969  85.178 -18.473
  154   2HG   GLN  19          1HG       GLN  19 -59.295  83.469 -18.186
  155   1HE2  GLN  19          1HE2      GLN  19 -57.776  81.987 -19.430
  156   2HE2  GLN  19          2HE2      GLN  19 -56.096  82.400 -19.348
  157    H    ARG  20           H        ARG  20 -62.323  81.512 -21.238
  158    HA   ARG  20           HA       ARG  20 -62.187  79.343 -21.891
  159   1HB   ARG  20          2HB       ARG  20 -59.268  80.009 -21.727
  160   2HB   ARG  20          1HB       ARG  20 -59.774  78.350 -22.002
  161   1HG   ARG  20          2HG       ARG  20 -59.827  78.840 -24.162
  162   2HG   ARG  20          1HG       ARG  20 -61.258  79.815 -23.823
  163   1HD   ARG  20          2HD       ARG  20 -59.315  80.925 -25.074
  164   2HD   ARG  20          1HD       ARG  20 -60.033  81.797 -23.721
  165    HE   ARG  20           HE       ARG  20 -57.740  80.171 -23.032
  166   1HH1  ARG  20          1HH1      ARG  20 -58.832  83.326 -24.125
  167   2HH1  ARG  20          2HH1      ARG  20 -57.419  84.156 -23.524
  168   1HH2  ARG  20          1HH2      ARG  20 -55.899  81.271 -22.243
  169   2HH2  ARG  20          2HH2      ARG  20 -55.768  82.992 -22.449
  170    H    ARG  21           H        ARG  21 -60.924  77.146 -21.075
  171    HA   ARG  21           HA       ARG  21 -61.555  77.057 -18.220
  172   1HB   ARG  21          2HB       ARG  21 -61.724  75.188 -20.443
  173   2HB   ARG  21          1HB       ARG  21 -60.917  74.477 -19.051
  174   1HG   ARG  21          2HG       ARG  21 -63.160  73.946 -18.745
  175   2HG   ARG  21          1HG       ARG  21 -62.903  75.337 -17.691
  176   1HD   ARG  21          2HD       ARG  21 -64.999  75.527 -18.944
  177   2HD   ARG  21          1HD       ARG  21 -63.866  76.813 -19.367
  178    HE   ARG  21           HE       ARG  21 -63.600  75.878 -21.483
  179   1HH1  ARG  21          1HH1      ARG  21 -65.737  73.936 -19.492
  180   2HH1  ARG  21          2HH1      ARG  21 -66.306  72.972 -20.823
  181   1HH2  ARG  21          1HH2      ARG  21 -64.367  74.626 -23.234
  182   2HH2  ARG  21          2HH2      ARG  21 -65.522  73.359 -22.947
  183    H    VAL  22           H        VAL  22 -58.964  76.418 -20.499
  184    HA   VAL  22           HA       VAL  22 -56.706  76.477 -20.274
  185    HB   VAL  22           HB       VAL  22 -57.212  77.196 -17.379
  186   1HG1  VAL  22          1HG1      VAL  22 -54.993  76.206 -17.722
  187   2HG1  VAL  22          2HG1      VAL  22 -54.891  77.921 -17.324
  188   3HG1  VAL  22          3HG1      VAL  22 -54.669  77.386 -18.991
  189   1HG2  VAL  22          1HG2      VAL  22 -56.981  79.447 -17.979
  190   2HG2  VAL  22          2HG2      VAL  22 -58.010  78.768 -19.241
  191   3HG2  VAL  22          3HG2      VAL  22 -56.299  79.052 -19.557
  192    H    ASN  23           H        ASN  23 -58.038  75.056 -17.287
  193    HA   ASN  23           HA       ASN  23 -57.671  73.091 -16.220
  194   1HB   ASN  23          2HB       ASN  23 -58.480  72.313 -18.568
  195   2HB   ASN  23          1HB       ASN  23 -56.800  71.843 -18.813
  196   1HD2  ASN  23          1HD2      ASN  23 -59.117  70.146 -18.724
  197   2HD2  ASN  23          2HD2      ASN  23 -58.862  69.031 -17.420
  198    H    ARG  24           H        ARG  24 -55.730  74.659 -15.686
  199    HA   ARG  24           HA       ARG  24 -53.381  72.925 -15.673
  200   1HB   ARG  24          2HB       ARG  24 -52.979  74.468 -17.528
  201   2HB   ARG  24          1HB       ARG  24 -53.305  75.841 -16.479
  202   1HG   ARG  24          2HG       ARG  24 -51.342  74.701 -15.076
  203   2HG   ARG  24          1HG       ARG  24 -50.900  74.139 -16.690
  204   1HD   ARG  24          2HD       ARG  24 -49.764  76.144 -16.542
  205   2HD   ARG  24          1HD       ARG  24 -51.247  76.616 -17.370
  206    HE   ARG  24           HE       ARG  24 -51.590  76.912 -14.587
  207   1HH1  ARG  24          1HH1      ARG  24 -49.887  78.360 -17.280
  208   2HH1  ARG  24          2HH1      ARG  24 -49.827  79.945 -16.559
  209   1HH2  ARG  24          1HH2      ARG  24 -51.524  78.974 -13.631
  210   2HH2  ARG  24          2HH2      ARG  24 -50.761  80.299 -14.476
  211    H    GLY  25           H        GLY  25 -52.916  72.620 -13.617
  212   1HA   GLY  25          2HA       GLY  25 -53.322  74.879 -11.749
  213   2HA   GLY  25          1HA       GLY  25 -53.545  73.193 -11.299
  214    H    GLY  26           H        GLY  26 -51.249  72.227 -12.725
  215   1HA   GLY  26          2HA       GLY  26 -48.810  72.936 -12.551
  216   2HA   GLY  26          1HA       GLY  26 -49.185  73.188 -10.849
  217    H    GLY  27           H        GLY  27 -48.101  70.994 -13.144
  218   1HA   GLY  27          2HA       GLY  27 -47.123  68.915 -12.498
  219   2HA   GLY  27          1HA       GLY  27 -48.282  68.816 -11.178
  220    HA   PRO  28           HA       PRO  28 -50.377  67.526 -15.400
  221   1HB   PRO  28          2HB       PRO  28 -48.668  66.101 -16.972
  222   2HB   PRO  28          1HB       PRO  28 -48.929  67.840 -17.153
  223   1HG   PRO  28          2HG       PRO  28 -46.711  66.393 -15.760
  224   2HG   PRO  28          1HG       PRO  28 -46.629  67.808 -16.826
  225   1HD   PRO  28          2HD       PRO  28 -46.512  68.022 -14.137
  226   2HD   PRO  28          1HD       PRO  28 -47.273  69.263 -15.154
  227    H    ARG  29           H        ARG  29 -51.091  65.359 -16.017
  228    HA   ARG  29           HA       ARG  29 -50.185  63.309 -14.103
  229   1HB   ARG  29          2HB       ARG  29 -52.792  64.289 -14.695
  230   2HB   ARG  29          1HB       ARG  29 -52.704  62.628 -15.263
  231   1HG   ARG  29          2HG       ARG  29 -53.536  62.781 -12.968
  232   2HG   ARG  29          1HG       ARG  29 -52.024  61.876 -13.065
  233   1HD   ARG  29          2HD       ARG  29 -51.070  64.361 -12.630
  234   2HD   ARG  29          1HD       ARG  29 -52.613  64.468 -11.783
  235    HE   ARG  29           HE       ARG  29 -51.897  62.512 -10.477
  236   1HH1  ARG  29          1HH1      ARG  29 -49.431  64.340 -12.189
  237   2HH1  ARG  29          2HH1      ARG  29 -48.163  63.869 -11.105
  238   1HH2  ARG  29          1HH2      ARG  29 -50.207  61.910  -9.047
  239   2HH2  ARG  29          2HH2      ARG  29 -48.594  62.496  -9.328
  240    H    ARG  30           H        ARG  30 -48.714  62.164 -15.179
  241    HA   ARG  30           HA       ARG  30 -48.804  61.648 -17.973
  242   1HB   ARG  30          2HB       ARG  30 -46.808  60.464 -17.665
  243   2HB   ARG  30          1HB       ARG  30 -46.770  61.685 -16.400
  244   1HG   ARG  30          2HG       ARG  30 -47.209  60.137 -14.720
  245   2HG   ARG  30          1HG       ARG  30 -47.835  58.941 -15.856
  246   1HD   ARG  30          2HD       ARG  30 -45.821  58.024 -16.024
  247   2HD   ARG  30          1HD       ARG  30 -45.147  59.560 -16.569
  248    HE   ARG  30           HE       ARG  30 -44.854  60.112 -14.177
  249   1HH1  ARG  30          1HH1      ARG  30 -45.055  56.750 -15.183
  250   2HH1  ARG  30          2HH1      ARG  30 -44.267  56.157 -13.750
  251   1HH2  ARG  30          1HH2      ARG  30 -43.827  59.309 -12.293
  252   2HH2  ARG  30          2HH2      ARG  30 -43.577  57.591 -12.124
  253    H    ASN  31           H        ASN  31 -48.514  59.282 -18.724
  254    HA   ASN  31           HA       ASN  31 -50.872  57.791 -17.962
  255   1HB   ASN  31          2HB       ASN  31 -50.405  57.729 -20.279
  256   2HB   ASN  31          1HB       ASN  31 -48.697  57.398 -20.012
  257   1HD2  ASN  31          1HD2      ASN  31 -48.027  55.348 -19.990
  258   2HD2  ASN  31          2HD2      ASN  31 -49.062  53.961 -20.022
  259    H    ARG  32           H        ARG  32 -50.943  56.148 -16.551
  260    HA   ARG  32           HA       ARG  32 -48.432  55.365 -15.278
  261   1HB   ARG  32          2HB       ARG  32 -50.616  56.106 -14.050
  262   2HB   ARG  32          1HB       ARG  32 -51.106  54.437 -14.310
  263   1HG   ARG  32          2HG       ARG  32 -48.412  54.739 -13.205
  264   2HG   ARG  32          1HG       ARG  32 -49.703  55.340 -12.163
  265   1HD   ARG  32          2HD       ARG  32 -50.705  53.258 -11.988
  266   2HD   ARG  32          1HD       ARG  32 -49.952  52.661 -13.465
  267    HE   ARG  32           HE       ARG  32 -48.605  52.968 -10.855
  268   1HH1  ARG  32          1HH1      ARG  32 -48.757  51.568 -14.071
  269   2HH1  ARG  32          2HH1      ARG  32 -47.477  50.435 -13.766
  270   1HH2  ARG  32          1HH2      ARG  32 -46.915  51.478 -10.478
  271   2HH2  ARG  32          2HH2      ARG  32 -46.427  50.396 -11.745
  272    HA   PRO  33           HA       PRO  33 -50.433  51.004 -16.440
  273   1HB   PRO  33          2HB       PRO  33 -51.850  51.886 -18.903
  274   2HB   PRO  33          1HB       PRO  33 -52.302  50.647 -17.726
  275   1HG   PRO  33          2HG       PRO  33 -53.548  52.993 -17.757
  276   2HG   PRO  33          1HG       PRO  33 -53.145  52.202 -16.222
  277   1HD   PRO  33          2HD       PRO  33 -51.804  54.502 -17.578
  278   2HD   PRO  33          1HD       PRO  33 -52.115  54.236 -15.851
  279    H    ALA  34           H        ALA  34 -48.735  49.976 -17.229
  280    HA   ALA  34           HA       ALA  34 -47.750  50.629 -19.904
  281   1HB   ALA  34          1HB       ALA  34 -45.565  50.122 -18.048
  282   2HB   ALA  34          2HB       ALA  34 -46.457  51.597 -17.678
  283   3HB   ALA  34          3HB       ALA  34 -45.742  51.377 -19.274
  284    H    ILE  35           H        ILE  35 -48.731  48.639 -20.477
  285    HA   ILE  35           HA       ILE  35 -48.033  46.167 -19.263
  286    HB   ILE  35           HB       ILE  35 -50.085  46.553 -20.646
  287   1HG1  ILE  35          2HG1      ILE  35 -48.711  44.285 -21.979
  288   2HG1  ILE  35          1HG1      ILE  35 -48.746  44.264 -20.218
  289   1HG2  ILE  35          1HG2      ILE  35 -48.046  46.887 -22.762
  290   2HG2  ILE  35          2HG2      ILE  35 -49.618  47.662 -22.564
  291   3HG2  ILE  35          3HG2      ILE  35 -49.519  46.017 -23.193
  292   1HD1  ILE  35          1HD1      ILE  35 -50.605  43.035 -21.354
  293   2HD1  ILE  35          2HD1      ILE  35 -51.204  44.598 -21.912
  294   3HD1  ILE  35          3HD1      ILE  35 -51.116  44.252 -20.185
  295    H    ALA  36           H        ALA  36 -46.481  48.225 -21.510
  296    HA   ALA  36           HA       ALA  36 -44.443  48.206 -22.484
  297   1HB   ALA  36          1HB       ALA  36 -44.062  46.591 -20.273
  298   2HB   ALA  36          2HB       ALA  36 -42.807  47.255 -21.317
  299   3HB   ALA  36          3HB       ALA  36 -43.431  45.632 -21.613
  300    H    ARG  37           H        ARG  37 -45.223  44.726 -22.405
  301    HA   ARG  37           HA       ARG  37 -45.851  44.706 -25.205
  302   1HB   ARG  37          2HB       ARG  37 -44.037  43.496 -26.065
  303   2HB   ARG  37          1HB       ARG  37 -43.291  44.732 -25.065
  304   1HG   ARG  37          2HG       ARG  37 -43.838  42.199 -23.689
  305   2HG   ARG  37          1HG       ARG  37 -42.659  42.103 -25.000
  306   1HD   ARG  37          2HD       ARG  37 -41.722  44.278 -23.818
  307   2HD   ARG  37          1HD       ARG  37 -42.529  43.573 -22.418
  308    HE   ARG  37           HE       ARG  37 -40.279  42.413 -23.908
  309   1HH1  ARG  37          1HH1      ARG  37 -42.482  42.304 -21.179
  310   2HH1  ARG  37          2HH1      ARG  37 -41.527  41.154 -20.294
  311   1HH2  ARG  37          1HH2      ARG  37 -39.032  40.883 -22.752
  312   2HH2  ARG  37          2HH2      ARG  37 -39.580  40.339 -21.187
  313    H    GLY  38           H        GLY  38 -45.398  43.072 -22.167
  314   1HA   GLY  38          2HA       GLY  38 -47.217  41.577 -21.491
  315   2HA   GLY  38          1HA       GLY  38 -47.197  40.934 -23.129
  316    H    GLY  39           H        GLY  39 -45.307  39.731 -23.813
  317   1HA   GLY  39          2HA       GLY  39 -43.029  39.031 -22.814
  318   2HA   GLY  39          1HA       GLY  39 -44.035  38.348 -21.546
  319    H    ARG  40           H        ARG  40 -45.311  36.560 -21.967
  320    HA   ARG  40           HA       ARG  40 -45.309  34.370 -22.585
  321   1HB   ARG  40          2HB       ARG  40 -46.373  33.969 -24.741
  322   2HB   ARG  40          1HB       ARG  40 -47.140  35.292 -23.881
  323   1HG   ARG  40          2HG       ARG  40 -45.313  36.597 -25.442
  324   2HG   ARG  40          1HG       ARG  40 -45.812  35.253 -26.473
  325   1HD   ARG  40          2HD       ARG  40 -48.209  36.005 -25.583
  326   2HD   ARG  40          1HD       ARG  40 -47.375  37.552 -25.445
  327    HE   ARG  40           HE       ARG  40 -46.863  37.360 -27.839
  328   1HH1  ARG  40          1HH1      ARG  40 -49.389  35.296 -26.552
  329   2HH1  ARG  40          2HH1      ARG  40 -50.273  35.224 -28.050
  330   1HH2  ARG  40          1HH2      ARG  40 -48.006  37.248 -29.814
  331   2HH2  ARG  40          2HH2      ARG  40 -49.481  36.335 -29.911
  332    H    ASN  41           H        ASN  41 -42.727  35.299 -22.565
  333    HA   ASN  41           HA       ASN  41 -41.407  33.275 -24.039
  334   1HB   ASN  41          2HB       ASN  41 -41.764  35.121 -25.799
  335   2HB   ASN  41          1HB       ASN  41 -40.612  36.070 -24.863
  336   1HD2  ASN  41          1HD2      ASN  41 -38.831  36.103 -26.059
  337   2HD2  ASN  41          2HD2      ASN  41 -38.025  34.711 -26.694
  338    H    ARG  42           H        ARG  42 -41.230  33.156 -21.660
  339    HA   ARG  42           HA       ARG  42 -38.779  34.324 -20.713
  340   1HB   ARG  42          2HB       ARG  42 -40.045  36.197 -20.140
  341   2HB   ARG  42          1HB       ARG  42 -41.463  35.236 -19.756
  342   1HG   ARG  42          2HG       ARG  42 -40.356  34.433 -17.721
  343   2HG   ARG  42          1HG       ARG  42 -38.949  35.424 -18.108
  344   1HD   ARG  42          2HD       ARG  42 -41.567  36.801 -18.046
  345   2HD   ARG  42          1HD       ARG  42 -40.930  36.246 -16.499
  346    HE   ARG  42           HE       ARG  42 -39.967  38.427 -18.093
  347   1HH1  ARG  42          1HH1      ARG  42 -39.043  36.011 -15.728
  348   2HH1  ARG  42          2HH1      ARG  42 -37.688  36.920 -15.134
  349   1HH2  ARG  42          1HH2      ARG  42 -38.201  39.648 -17.293
  350   2HH2  ARG  42          2HH2      ARG  42 -37.207  38.991 -16.021
  351    HA   PRO  43           HA       PRO  43 -40.580  30.966 -17.620
  352   1HB   PRO  43          2HB       PRO  43 -42.794  29.899 -19.268
  353   2HB   PRO  43          1HB       PRO  43 -42.728  30.189 -17.527
  354   1HG   PRO  43          2HG       PRO  43 -44.162  31.767 -19.137
  355   2HG   PRO  43          1HG       PRO  43 -43.283  32.424 -17.745
  356   1HD   PRO  43          2HD       PRO  43 -42.567  32.492 -20.646
  357   2HD   PRO  43          1HD       PRO  43 -42.388  33.754 -19.411
  358    H    ALA  44           H        ALA  44 -41.172  30.495 -21.080
  359    HA   ALA  44           HA       ALA  44 -39.176  28.332 -21.057
  360   1HB   ALA  44          1HB       ALA  44 -41.914  28.273 -21.970
  361   2HB   ALA  44          2HB       ALA  44 -40.759  26.952 -21.805
  362   3HB   ALA  44          3HB       ALA  44 -40.799  27.908 -23.286
  363    HA   PRO  45           HA       PRO  45 -37.217  31.462 -23.665
  364   1HB   PRO  45          2HB       PRO  45 -35.168  29.316 -23.767
  365   2HB   PRO  45          1HB       PRO  45 -34.989  31.023 -23.340
  366   1HG   PRO  45          2HG       PRO  45 -34.898  29.137 -21.464
  367   2HG   PRO  45          1HG       PRO  45 -35.711  30.684 -21.159
  368   1HD   PRO  45          2HD       PRO  45 -36.899  28.014 -21.814
  369   2HD   PRO  45          1HD       PRO  45 -37.447  29.235 -20.646
  370    H    TYR  46           H        TYR  46 -37.451  28.013 -24.330
  371    HA   TYR  46           HA       TYR  46 -37.814  28.623 -27.179
  372   1HB   TYR  46          2HB       TYR  46 -36.274  26.277 -26.031
  373   2HB   TYR  46          1HB       TYR  46 -36.621  26.528 -27.740
  374    HD1  TYR  46           1HD      TYR  46 -34.350  27.200 -25.069
  375    HD2  TYR  46           2HD      TYR  46 -35.702  28.655 -28.831
  376    HE1  TYR  46           1HE      TYR  46 -32.299  28.539 -25.282
  377    HE2  TYR  46           2HE      TYR  46 -33.655  29.994 -29.056
  378    HH   TYR  46           HH       TYR  46 -30.994  29.551 -27.654
  379    H    SER  47           H        SER  47 -38.225  25.734 -27.717
  380    HA   SER  47           HA       SER  47 -40.987  25.585 -27.322
  381   1HB   SER  47          2HB       SER  47 -39.785  22.966 -27.625
  382   2HB   SER  47          1HB       SER  47 -40.774  23.880 -28.767
  383    HG   SER  47           HG       SER  47 -38.336  23.336 -29.150
  384    H    ARG  48           H        ARG  48 -38.306  24.162 -25.501
  385    HA   ARG  48           HA       ARG  48 -39.943  24.088 -23.131
  386   1HB   ARG  48          2HB       ARG  48 -40.257  21.872 -24.488
  387   2HB   ARG  48          1HB       ARG  48 -38.657  21.482 -23.873
  388   1HG   ARG  48          2HG       ARG  48 -39.710  20.639 -22.109
  389   2HG   ARG  48          1HG       ARG  48 -39.987  22.312 -21.621
  390   1HD   ARG  48          2HD       ARG  48 -41.849  20.389 -22.954
  391   2HD   ARG  48          1HD       ARG  48 -42.113  21.393 -21.530
  392    HE   ARG  48           HE       ARG  48 -41.721  22.968 -23.880
  393   1HH1  ARG  48          1HH1      ARG  48 -44.096  21.065 -22.135
  394   2HH1  ARG  48          2HH1      ARG  48 -45.448  21.899 -22.839
  395   1HH2  ARG  48          1HH2      ARG  48 -43.482  24.067 -24.784
  396   2HH2  ARG  48          2HH2      ARG  48 -45.101  23.613 -24.350
  397    HA   PRO  49           HA       PRO  49 -35.975  25.175 -21.417
  398   1HB   PRO  49          2HB       PRO  49 -36.557  24.315 -18.837
  399   2HB   PRO  49          1HB       PRO  49 -36.917  25.916 -19.486
  400   1HG   PRO  49          2HG       PRO  49 -38.700  23.543 -19.191
  401   2HG   PRO  49          1HG       PRO  49 -39.070  25.262 -18.960
  402   1HD   PRO  49          2HD       PRO  49 -39.842  23.950 -21.167
  403   2HD   PRO  49          1HD       PRO  49 -39.308  25.643 -21.237
  404    H    LYS  50           H        LYS  50 -34.084  24.136 -20.888
  405    HA   LYS  50           HA       LYS  50 -34.235  21.193 -20.858
  406   1HB   LYS  50          2HB       LYS  50 -32.427  23.036 -22.391
  407   2HB   LYS  50          1HB       LYS  50 -31.934  21.387 -22.028
  408   1HG   LYS  50          2HG       LYS  50 -33.291  20.513 -23.573
  409   2HG   LYS  50          1HG       LYS  50 -34.614  21.612 -23.177
  410   1HD   LYS  50          2HD       LYS  50 -34.149  22.495 -25.196
  411   2HD   LYS  50          1HD       LYS  50 -32.867  23.330 -24.318
  412   1HE   LYS  50          2HE       LYS  50 -31.268  21.642 -24.959
  413   2HE   LYS  50          1HE       LYS  50 -32.537  20.678 -25.715
  414   1HZ   LYS  50          1HZ       LYS  50 -32.344  23.392 -26.694
  415   2HZ   LYS  50          2HZ       LYS  50 -32.505  21.939 -27.549
  416   3HZ   LYS  50          3HZ       LYS  50 -30.976  22.439 -27.013
  417    HA   PRO  51           HA       PRO  51 -31.830  21.990 -17.074
  418   1HB   PRO  51          2HB       PRO  51 -32.760  19.276 -16.452
  419   2HB   PRO  51          1HB       PRO  51 -32.968  20.766 -15.529
  420   1HG   PRO  51          2HG       PRO  51 -35.027  19.574 -16.783
  421   2HG   PRO  51          1HG       PRO  51 -34.912  21.336 -16.635
  422   1HD   PRO  51          2HD       PRO  51 -34.254  19.585 -18.979
  423   2HD   PRO  51          1HD       PRO  51 -35.119  21.138 -18.942
  424    H    LEU  52           H        LEU  52 -32.143  18.626 -18.173
  425    HA   LEU  52           HA       LEU  52 -30.699  17.092 -18.968
  426   1HB   LEU  52          2HB       LEU  52 -29.735  19.622 -20.077
  427   2HB   LEU  52          1HB       LEU  52 -28.519  18.359 -20.014
  428    HG   LEU  52           HG       LEU  52 -30.923  17.230 -21.049
  429   1HD1  LEU  52          1HD1      LEU  52 -31.554  19.515 -21.637
  430   2HD1  LEU  52          2HD1      LEU  52 -31.199  18.553 -23.072
  431   3HD1  LEU  52          3HD1      LEU  52 -30.019  19.723 -22.482
  432   1HD2  LEU  52          1HD2      LEU  52 -29.226  17.300 -23.134
  433   2HD2  LEU  52          2HD2      LEU  52 -29.100  16.142 -21.809
  434   3HD2  LEU  52          3HD2      LEU  52 -28.100  17.595 -21.811
  435    HA   PRO  53           HA       PRO  53 -27.914  16.928 -15.430
  436   1HB   PRO  53          2HB       PRO  53 -28.050  14.227 -15.150
  437   2HB   PRO  53          1HB       PRO  53 -29.259  15.330 -14.488
  438   1HG   PRO  53          2HG       PRO  53 -29.393  13.595 -16.890
  439   2HG   PRO  53          1HG       PRO  53 -30.685  14.096 -15.788
  440   1HD   PRO  53          2HD       PRO  53 -30.185  15.171 -18.307
  441   2HD   PRO  53          1HD       PRO  53 -31.165  15.926 -17.037
  442    H    ASP  54           H        ASP  54 -27.532  13.841 -17.094
  443    HA   ASP  54           HA       ASP  54 -25.144  14.825 -18.464
  444   1HB   ASP  54          2HB       ASP  54 -24.757  13.589 -16.120
  445   2HB   ASP  54          1HB       ASP  54 -24.876  12.169 -17.157
  446    H    LYS  55           H        LYS  55 -26.641  14.649 -20.238
  447    HA   LYS  55           HA       LYS  55 -27.087  11.876 -21.114
  448   1HB   LYS  55          2HB       LYS  55 -28.918  13.869 -20.963
  449   2HB   LYS  55          1HB       LYS  55 -28.354  14.086 -22.614
  450   1HG   LYS  55          2HG       LYS  55 -29.893  12.564 -23.141
  451   2HG   LYS  55          1HG       LYS  55 -28.745  11.387 -22.501
  452   1HD   LYS  55          2HD       LYS  55 -29.842  11.806 -20.234
  453   2HD   LYS  55          1HD       LYS  55 -31.129  12.610 -21.138
  454   1HE   LYS  55          2HE       LYS  55 -32.053  10.584 -21.316
  455   2HE   LYS  55          1HE       LYS  55 -30.799  10.253 -22.508
  456   1HZ   LYS  55          1HZ       LYS  55 -31.083   9.270 -19.797
  457   2HZ   LYS  55          2HZ       LYS  55 -29.507   9.712 -20.235
  458   3HZ   LYS  55          3HZ       LYS  55 -30.345   8.546 -21.143
  459    H    TRP  56           H        TRP  56 -24.917  14.200 -21.365
  460    HA   TRP  56           HA       TRP  56 -24.246  13.585 -24.164
  461   1HB   TRP  56          2HB       TRP  56 -23.825  16.044 -22.492
  462   2HB   TRP  56          1HB       TRP  56 -22.735  15.696 -23.828
  463    HD1  TRP  56           HD       TRP  56 -26.423  16.530 -23.131
  464    HE1  TRP  56           1HE      TRP  56 -27.472  17.463 -25.292
  465    HE3  TRP  56           3HE      TRP  56 -22.505  15.753 -26.320
  466    HZ2  TRP  56           2HZ      TRP  56 -26.723  17.819 -27.992
  467    HZ3  TRP  56           3HZ      TRP  56 -22.751  16.419 -28.675
  468    HH2  TRP  56           HH       TRP  56 -24.818  17.429 -29.493
  469    H    GLN  57           H        GLN  57 -22.766  12.015 -24.196
  470    HA   GLN  57           HA       GLN  57 -21.031  11.644 -21.888
  471   1HB   GLN  57          2HB       GLN  57 -20.574   9.465 -22.753
  472   2HB   GLN  57          1HB       GLN  57 -22.303   9.744 -22.905
  473   1HG   GLN  57          2HG       GLN  57 -20.640  10.445 -25.241
  474   2HG   GLN  57          1HG       GLN  57 -20.798   8.730 -24.861
  475   1HE2  GLN  57          1HE2      GLN  57 -22.774   7.732 -25.068
  476   2HE2  GLN  57          2HE2      GLN  57 -24.112   8.472 -25.892
  477    H    HIS  58           H        HIS  58 -20.785  13.551 -24.442
  478    HA   HIS  58           HA       HIS  58 -19.106  14.529 -25.616
  479   1HB   HIS  58          2HB       HIS  58 -18.114  14.230 -23.111
  480   2HB   HIS  58          1HB       HIS  58 -16.930  13.302 -24.022
  481    HD1  HIS  58           1HD      HIS  58 -14.955  14.711 -24.423
  482    HD2  HIS  58           2HD      HIS  58 -18.496  16.878 -24.764
  483    HE1  HIS  58           1HE      HIS  58 -14.268  17.050 -25.059
  484    HE2  HIS  58           2HE      HIS  58 -16.416  18.373 -25.143
  485    H    ASP  59           H        ASP  59 -16.836  12.040 -24.768
  486    HA   ASP  59           HA       ASP  59 -17.201  10.793 -27.411
  487   1HB   ASP  59          2HB       ASP  59 -15.134  12.366 -27.024
  488   2HB   ASP  59          1HB       ASP  59 -14.494  10.985 -26.141
  489    H    LEU  60           H        LEU  60 -18.165  10.111 -24.728
  490    HA   LEU  60           HA       LEU  60 -18.579   8.252 -23.504
  491   1HB   LEU  60          2HB       LEU  60 -17.012   6.973 -25.731
  492   2HB   LEU  60          1HB       LEU  60 -17.584   6.043 -24.360
  493    HG   LEU  60           HG       LEU  60 -19.866   7.337 -25.177
  494   1HD1  LEU  60          1HD1      LEU  60 -18.626   6.337 -27.708
  495   2HD1  LEU  60          2HD1      LEU  60 -18.407   8.013 -27.207
  496   3HD1  LEU  60          3HD1      LEU  60 -20.030   7.380 -27.486
  497   1HD2  LEU  60          1HD2      LEU  60 -19.174   4.837 -24.648
  498   2HD2  LEU  60          2HD2      LEU  60 -19.211   4.715 -26.407
  499   3HD2  LEU  60          3HD2      LEU  60 -20.651   5.227 -25.527
  500    H    PHE  61           H        PHE  61 -15.473   6.962 -24.457
  501    HA   PHE  61           HA       PHE  61 -14.513   7.231 -21.734
  502   1HB   PHE  61          2HB       PHE  61 -13.422   5.858 -24.193
  503   2HB   PHE  61          1HB       PHE  61 -12.565   5.917 -22.661
  504    HD1  PHE  61           1HD      PHE  61 -13.703   4.923 -20.618
  505    HD2  PHE  61           2HD      PHE  61 -15.030   4.228 -24.599
  506    HE1  PHE  61           1HE      PHE  61 -14.922   2.927 -19.857
  507    HE2  PHE  61           2HE      PHE  61 -16.252   2.232 -23.846
  508    HZ   PHE  61           HZ       PHE  61 -16.214   1.587 -21.473
  509    H    ASP  62           H        ASP  62 -14.281   8.777 -24.750
  510    HA   ASP  62           HA       ASP  62 -13.159  10.584 -25.535
  511   1HB   ASP  62          2HB       ASP  62 -13.992  11.315 -23.101
  512   2HB   ASP  62          1HB       ASP  62 -12.260  11.390 -22.810
  513    H    SER  63           H        SER  63 -10.907  11.929 -24.623
  514    HA   SER  63           HA       SER  63  -8.818   9.860 -24.441
  515   1HB   SER  63          2HB       SER  63  -8.223  12.440 -25.827
  516   2HB   SER  63          1HB       SER  63  -7.539  10.837 -26.099
  517    HG   SER  63           HG       SER  63 -10.215  11.542 -26.768
  518    H    GLY  64           H        GLY  64  -9.988  10.988 -22.255
  519   1HA   GLY  64          2HA       GLY  64  -7.990  12.000 -20.685
  520   2HA   GLY  64          1HA       GLY  64  -8.727  13.422 -21.416
  521    H    CYS  65           H        CYS  65 -11.377  12.617 -21.520
  522    HA   CYS  65           HA       CYS  65 -12.283  13.130 -18.905
  523   1HB   CYS  65          2HB       CYS  65 -13.777  12.071 -21.309
  524   2HB   CYS  65          1HB       CYS  65 -14.543  12.606 -19.818
  525    HG   CYS  65           HG       CYS  65 -12.588  14.691 -21.696
  526    H    GLY  66           H        GLY  66 -12.150  11.771 -17.261
  527   1HA   GLY  66          2HA       GLY  66 -13.466   9.625 -16.614
  528   2HA   GLY  66          1HA       GLY  66 -12.366   8.886 -17.773
  529    H    GLY  67           H        GLY  67 -10.070   9.026 -17.347
  530   1HA   GLY  67          2HA       GLY  67  -8.194   9.193 -15.987
  531   2HA   GLY  67          1HA       GLY  67  -9.198   9.896 -14.728
  532    H    GLY  68           H        GLY  68 -10.960   8.164 -14.000
  533   1HA   GLY  68          2HA       GLY  68 -10.811   5.526 -13.903
  534   2HA   GLY  68          1HA       GLY  68  -9.370   5.937 -12.978
  535    H    GLU  69           H        GLU  69 -10.880   4.569 -11.491
  536    HA   GLU  69           HA       GLU  69 -12.980   6.076 -10.217
  537   1HB   GLU  69          2HB       GLU  69 -12.406   3.408 -10.446
  538   2HB   GLU  69          1HB       GLU  69 -11.899   3.744  -8.796
  539   1HG   GLU  69          2HG       GLU  69 -14.460   4.938  -9.358
  540   2HG   GLU  69          1HG       GLU  69 -14.471   3.207  -9.695
  541    H    GLY  70           H        GLY  70  -9.598   5.473  -9.732
  542   1HA   GLY  70          2HA       GLY  70  -8.747   7.508  -8.330
  543   2HA   GLY  70          1HA       GLY  70  -9.662   6.692  -7.069
  544    H    VAL  71           H        VAL  71  -8.958   4.039  -8.202
  545    HA   VAL  71           HA       VAL  71  -6.622   3.587  -6.696
  546    HB   VAL  71           HB       VAL  71  -6.690   1.327  -8.109
  547   1HG1  VAL  71          1HG1      VAL  71  -8.577   0.652  -6.415
  548   2HG1  VAL  71          2HG1      VAL  71  -8.275   2.265  -5.770
  549   3HG1  VAL  71          3HG1      VAL  71  -6.964   1.087  -5.849
  550   1HG2  VAL  71          1HG2      VAL  71  -9.598   2.020  -8.149
  551   2HG2  VAL  71          2HG2      VAL  71  -8.728   0.771  -9.039
  552   3HG2  VAL  71          3HG2      VAL  71  -8.574   2.462  -9.514
  553    H    GLU  72           H        GLU  72  -7.155   3.561 -10.169
  554    HA   GLU  72           HA       GLU  72  -4.371   3.194 -10.768
  555   1HB   GLU  72          2HB       GLU  72  -6.678   2.743 -12.161
  556   2HB   GLU  72          1HB       GLU  72  -6.105   4.226 -12.912
  557   1HG   GLU  72          2HG       GLU  72  -4.002   2.247 -12.571
  558   2HG   GLU  72          1HG       GLU  72  -5.338   1.672 -13.566
  559    H    THR  73           H        THR  73  -6.582   5.877 -10.515
  560    HA   THR  73           HA       THR  73  -4.588   7.777 -11.444
  561    HB   THR  73           HB       THR  73  -6.748   9.206 -10.421
  562    HG1  THR  73           1HG      THR  73  -8.550   8.096 -10.873
  563   1HG2  THR  73          1HG2      THR  73  -7.270   8.747 -13.145
  564   2HG2  THR  73          2HG2      THR  73  -5.519   8.647 -12.960
  565   3HG2  THR  73          3HG2      THR  73  -6.380  10.093 -12.433
  566    H    GLY  74           H        GLY  74  -4.034   6.246  -9.098
  567   1HA   GLY  74          2HA       GLY  74  -4.326   8.221  -6.936
  568   2HA   GLY  74          1HA       GLY  74  -4.099   6.494  -6.697
  569    H    ALA  75           H        ALA  75  -2.244   6.376  -5.591
  570    HA   ALA  75           HA       ALA  75   0.081   7.841  -6.655
  571   1HB   ALA  75          1HB       ALA  75  -0.320   7.182  -3.750
  572   2HB   ALA  75          2HB       ALA  75  -0.958   8.668  -4.462
  573   3HB   ALA  75          3HB       ALA  75   0.781   8.360  -4.472
  574    H    LYS  76           H        LYS  76   1.564   6.448  -7.431
  575    HA   LYS  76           HA       LYS  76   1.746   3.793  -6.217
  576   1HB   LYS  76          2HB       LYS  76   3.490   3.925  -8.410
  577   2HB   LYS  76          1HB       LYS  76   1.936   3.119  -8.321
  578   1HG   LYS  76          2HG       LYS  76   0.856   5.223  -9.062
  579   2HG   LYS  76          1HG       LYS  76   2.465   5.906  -9.296
  580   1HD   LYS  76          2HD       LYS  76   1.359   3.462 -10.676
  581   2HD   LYS  76          1HD       LYS  76   1.548   5.061 -11.396
  582   1HE   LYS  76          2HE       LYS  76   4.053   4.660 -10.524
  583   2HE   LYS  76          1HE       LYS  76   3.569   2.987 -10.802
  584   1HZ   LYS  76          1HZ       LYS  76   3.814   5.194 -12.740
  585   2HZ   LYS  76          2HZ       LYS  76   2.770   3.898 -13.062
  586   3HZ   LYS  76          3HZ       LYS  76   4.425   3.614 -12.830
  587    H    LEU  77           H        LEU  77   3.179   3.524  -4.721
  588    HA   LEU  77           HA       LEU  77   5.524   5.289  -4.585
  589   1HB   LEU  77          2HB       LEU  77   4.047   5.418  -2.679
  590   2HB   LEU  77          1HB       LEU  77   4.009   3.679  -2.524
  591    HG   LEU  77           HG       LEU  77   5.335   5.000  -0.802
  592   1HD1  LEU  77          1HD1      LEU  77   6.648   2.744  -2.276
  593   2HD1  LEU  77          2HD1      LEU  77   5.497   2.627  -0.943
  594   3HD1  LEU  77          3HD1      LEU  77   7.099   3.312  -0.667
  595   1HD2  LEU  77          1HD2      LEU  77   6.570   6.539  -2.056
  596   2HD2  LEU  77          2HD2      LEU  77   7.142   5.302  -3.175
  597   3HD2  LEU  77          3HD2      LEU  77   7.748   5.342  -1.519
  598    H    LEU  78           H        LEU  78   7.448   4.448  -5.017
  599    HA   LEU  78           HA       LEU  78   7.767   1.524  -5.016
  600   1HB   LEU  78          2HB       LEU  78   9.964   3.172  -6.062
  601   2HB   LEU  78          1HB       LEU  78   9.219   1.738  -6.737
  602    HG   LEU  78           HG       LEU  78   7.694   4.301  -6.848
  603   1HD1  LEU  78          1HD1      LEU  78   8.874   5.214  -8.587
  604   2HD1  LEU  78          2HD1      LEU  78   9.628   3.682  -9.028
  605   3HD1  LEU  78          3HD1      LEU  78  10.184   4.561  -7.603
  606   1HD2  LEU  78          1HD2      LEU  78   7.262   1.745  -7.749
  607   2HD2  LEU  78          2HD2      LEU  78   7.859   2.570  -9.188
  608   3HD2  LEU  78          3HD2      LEU  78   6.447   3.195  -8.335
  609    H    VAL  79           H        VAL  79   9.845   0.680  -4.162
  610    HA   VAL  79           HA       VAL  79  11.019   2.324  -2.055
  611    HB   VAL  79           HB       VAL  79  10.239  -0.451  -1.259
  612   1HG1  VAL  79          1HG1      VAL  79  11.759   1.324  -0.035
  613   2HG1  VAL  79          2HG1      VAL  79  10.690   0.246   0.866
  614   3HG1  VAL  79          3HG1      VAL  79  10.198   1.911   0.545
  615   1HG2  VAL  79          1HG2      VAL  79   8.375   1.838  -1.518
  616   2HG2  VAL  79          2HG2      VAL  79   8.249   0.829  -0.076
  617   3HG2  VAL  79          3HG2      VAL  79   8.075   0.108  -1.677
  618    H    SER  80           H        SER  80  13.112   2.167  -2.455
  619    HA   SER  80           HA       SER  80  14.228  -0.505  -2.951
  620   1HB   SER  80          2HB       SER  80  15.750   1.532  -4.343
  621   2HB   SER  80          1HB       SER  80  15.067   0.024  -4.957
  622    HG   SER  80           HG       SER  80  13.990   2.619  -4.946
  623    H    ASN  81           H        ASN  81  16.598  -0.587  -2.621
  624    HA   ASN  81           HA       ASN  81  18.534  -0.185  -1.516
  625   1HB   ASN  81          2HB       ASN  81  18.031   2.243  -2.336
  626   2HB   ASN  81          1HB       ASN  81  17.633   2.539  -0.646
  627   1HD2  ASN  81          1HD2      ASN  81  19.251   3.367   0.453
  628   2HD2  ASN  81          2HD2      ASN  81  20.937   3.039   0.198
  629    H    LEU  82           H        LEU  82  17.309  -1.792  -0.160
  630    HA   LEU  82           HA       LEU  82  17.167  -0.735   2.585
  631   1HB   LEU  82          2HB       LEU  82  15.372  -2.637   1.150
  632   2HB   LEU  82          1HB       LEU  82  15.649  -2.884   2.865
  633    HG   LEU  82           HG       LEU  82  15.042  -0.170   2.635
  634   1HD1  LEU  82          1HD1      LEU  82  14.119  -0.197   0.522
  635   2HD1  LEU  82          2HD1      LEU  82  12.710  -0.489   1.541
  636   3HD1  LEU  82          3HD1      LEU  82  13.486  -1.833   0.704
  637   1HD2  LEU  82          1HD2      LEU  82  12.708  -1.533   3.374
  638   2HD2  LEU  82          2HD2      LEU  82  13.951  -0.868   4.434
  639   3HD2  LEU  82          3HD2      LEU  82  14.053  -2.546   3.901
  640    H    ASP  83           H        ASP  83  17.575  -3.701   0.685
  641    HA   ASP  83           HA       ASP  83  19.116  -5.362   0.727
  642   1HB   ASP  83          2HB       ASP  83  20.667  -3.285   1.266
  643   2HB   ASP  83          1HB       ASP  83  20.776  -4.065   2.841
  644    H    PHE  84           H        PHE  84  17.232  -4.499   3.249
  645    HA   PHE  84           HA       PHE  84  18.170  -6.390   5.208
  646   1HB   PHE  84          2HB       PHE  84  15.551  -4.879   5.112
  647   2HB   PHE  84          1HB       PHE  84  16.225  -5.710   6.508
  648    HD1  PHE  84           1HD      PHE  84  18.918  -4.892   6.717
  649    HD2  PHE  84           2HD      PHE  84  15.569  -2.610   5.422
  650    HE1  PHE  84           1HE      PHE  84  20.071  -2.825   7.389
  651    HE2  PHE  84           2HE      PHE  84  16.715  -0.540   6.093
  652    HZ   PHE  84           HZ       PHE  84  18.948  -0.639   7.089
  653    H    GLY  85           H        GLY  85  16.405  -6.630   2.373
  654   1HA   GLY  85          2HA       GLY  85  15.102  -8.285   1.454
  655   2HA   GLY  85          1HA       GLY  85  15.709  -9.334   2.730
  656    H    VAL  86           H        VAL  86  13.787  -6.384   2.954
  657    HA   VAL  86           HA       VAL  86  12.115  -7.339   4.989
  658    HB   VAL  86           HB       VAL  86  10.586  -5.398   4.181
  659   1HG1  VAL  86          1HG1      VAL  86  11.830  -5.076   6.134
  660   2HG1  VAL  86          2HG1      VAL  86  12.287  -3.722   5.099
  661   3HG1  VAL  86          3HG1      VAL  86  13.367  -5.108   5.270
  662   1HG2  VAL  86          1HG2      VAL  86  12.887  -4.147   2.896
  663   2HG2  VAL  86          2HG2      VAL  86  11.187  -4.144   2.427
  664   3HG2  VAL  86          3HG2      VAL  86  12.225  -5.498   1.978
  665    H    SER  87           H        SER  87  10.349  -8.553   4.991
  666    HA   SER  87           HA       SER  87   9.442  -9.823   2.642
  667   1HB   SER  87          2HB       SER  87   7.573 -10.017   4.818
  668   2HB   SER  87          1HB       SER  87   8.651 -11.258   4.177
  669    HG   SER  87           HG       SER  87   8.813 -10.025   6.501
  670    H    ASP  88           H        ASP  88   7.056  -9.917   2.158
  671    HA   ASP  88           HA       ASP  88   6.178  -7.454   1.169
  672   1HB   ASP  88          2HB       ASP  88   3.842  -8.801   1.234
  673   2HB   ASP  88          1HB       ASP  88   5.082  -9.070   0.015
  674    H    ALA  89           H        ALA  89   5.278  -9.160   4.122
  675    HA   ALA  89           HA       ALA  89   3.351  -7.240   4.955
  676   1HB   ALA  89          1HB       ALA  89   3.553  -9.653   5.720
  677   2HB   ALA  89          2HB       ALA  89   3.204  -8.450   6.961
  678   3HB   ALA  89          3HB       ALA  89   4.839  -9.092   6.790
  679    H    ASP  90           H        ASP  90   6.810  -7.446   5.234
  680    HA   ASP  90           HA       ASP  90   7.186  -5.889   7.546
  681   1HB   ASP  90          2HB       ASP  90   8.838  -7.129   5.628
  682   2HB   ASP  90          1HB       ASP  90   9.317  -5.435   5.670
  683    H    ILE  91           H        ILE  91   7.740  -4.823   4.181
  684    HA   ILE  91           HA       ILE  91   7.811  -2.098   4.727
  685    HB   ILE  91           HB       ILE  91   7.195  -3.643   2.231
  686   1HG1  ILE  91          2HG1      ILE  91   9.512  -3.542   2.995
  687   2HG1  ILE  91          1HG1      ILE  91   9.321  -2.646   1.492
  688   1HG2  ILE  91          1HG2      ILE  91   5.824  -1.594   2.139
  689   2HG2  ILE  91          2HG2      ILE  91   7.105  -1.610   0.927
  690   3HG2  ILE  91          3HG2      ILE  91   7.283  -0.633   2.383
  691   1HD1  ILE  91          1HD1      ILE  91   9.973  -1.683   4.210
  692   2HD1  ILE  91          2HD1      ILE  91   8.983  -0.634   3.194
  693   3HD1  ILE  91          3HD1      ILE  91  10.575  -1.154   2.639
  694    H    GLN  92           H        GLN  92   5.036  -4.169   4.051
  695    HA   GLN  92           HA       GLN  92   3.137  -2.116   3.686
  696   1HB   GLN  92          2HB       GLN  92   2.913  -4.643   3.209
  697   2HB   GLN  92          1HB       GLN  92   2.463  -4.780   4.904
  698   1HG   GLN  92          2HG       GLN  92   0.814  -2.805   4.182
  699   2HG   GLN  92          1HG       GLN  92   0.973  -3.631   2.631
  700   1HE2  GLN  92          1HE2      GLN  92   0.962  -6.182   3.085
  701   2HE2  GLN  92          2HE2      GLN  92  -0.418  -6.706   3.987
  702    H    GLU  93           H        GLU  93   3.937  -4.055   6.550
  703    HA   GLU  93           HA       GLU  93   2.328  -2.759   8.413
  704   1HB   GLU  93          2HB       GLU  93   4.080  -4.820   8.495
  705   2HB   GLU  93          1HB       GLU  93   5.012  -3.588   9.332
  706   1HG   GLU  93          2HG       GLU  93   2.888  -3.260  10.749
  707   2HG   GLU  93          1HG       GLU  93   2.409  -4.831  10.106
  708    H    LEU  94           H        LEU  94   5.432  -1.856   7.090
  709    HA   LEU  94           HA       LEU  94   6.054   0.152   9.014
  710   1HB   LEU  94          2HB       LEU  94   7.431  -1.098   7.005
  711   2HB   LEU  94          1HB       LEU  94   7.174   0.497   6.323
  712    HG   LEU  94           HG       LEU  94   8.175   1.442   8.450
  713   1HD1  LEU  94          1HD1      LEU  94   8.896   0.132  10.102
  714   2HD1  LEU  94          2HD1      LEU  94   9.662  -0.998   8.986
  715   3HD1  LEU  94          3HD1      LEU  94   7.943  -1.148   9.350
  716   1HD2  LEU  94          1HD2      LEU  94  10.529   0.328   7.665
  717   2HD2  LEU  94          2HD2      LEU  94   9.739   1.685   6.862
  718   3HD2  LEU  94          3HD2      LEU  94   9.514   0.047   6.249
  719    H    PHE  95           H        PHE  95   5.145   0.485   5.589
  720    HA   PHE  95           HA       PHE  95   4.436   3.162   5.672
  721   1HB   PHE  95          2HB       PHE  95   4.126   0.977   3.827
  722   2HB   PHE  95          1HB       PHE  95   2.693   2.003   3.813
  723    HD1  PHE  95           1HD      PHE  95   2.841   4.341   3.168
  724    HD2  PHE  95           2HD      PHE  95   6.244   1.788   3.076
  725    HE1  PHE  95           1HE      PHE  95   4.023   5.969   1.753
  726    HE2  PHE  95           2HE      PHE  95   7.432   3.413   1.665
  727    HZ   PHE  95           HZ       PHE  95   6.329   5.542   1.057
  728    H    ALA  96           H        ALA  96   2.524   0.415   6.764
  729    HA   ALA  96           HA       ALA  96   0.112   1.912   7.112
  730   1HB   ALA  96          1HB       ALA  96  -0.749   0.041   8.191
  731   2HB   ALA  96          2HB       ALA  96   0.826  -0.443   8.822
  732   3HB   ALA  96          3HB       ALA  96   0.456  -0.663   7.110
  733    H    GLU  97           H        GLU  97   2.634   0.883   9.338
  734    HA   GLU  97           HA       GLU  97   2.136   2.436  11.560
  735   1HB   GLU  97          2HB       GLU  97   4.177   0.896  10.946
  736   2HB   GLU  97          1HB       GLU  97   4.923   2.408  10.451
  737   1HG   GLU  97          2HG       GLU  97   3.685   2.273  13.141
  738   2HG   GLU  97          1HG       GLU  97   5.215   1.437  12.877
  739    H    PHE  98           H        PHE  98   3.621   3.420   8.538
  740    HA   PHE  98           HA       PHE  98   4.080   6.125   9.108
  741   1HB   PHE  98          2HB       PHE  98   5.048   4.716   7.249
  742   2HB   PHE  98          1HB       PHE  98   3.533   4.940   6.387
  743    HD1  PHE  98           1HD      PHE  98   4.153   6.170   4.554
  744    HD2  PHE  98           2HD      PHE  98   5.403   7.422   8.419
  745    HE1  PHE  98           1HE      PHE  98   4.990   8.278   3.595
  746    HE2  PHE  98           2HE      PHE  98   6.251   9.525   7.474
  747    HZ   PHE  98           HZ       PHE  98   6.039   9.963   5.056
  748    H    GLY  99           H        GLY  99   1.127   4.770   9.137
  749   1HA   GLY  99          2HA       GLY  99  -0.638   6.574   9.341
  750   2HA   GLY  99          1HA       GLY  99  -0.154   7.037   7.722
  751    H    THR 100           H        THR 100  -1.233   6.200   6.058
  752    HA   THR 100           HA       THR 100  -3.156   4.049   6.653
  753    HB   THR 100           HB       THR 100  -4.315   5.436   4.597
  754    HG1  THR 100           1HG      THR 100  -3.047   7.222   4.624
  755   1HG2  THR 100          1HG2      THR 100  -5.944   6.108   6.174
  756   2HG2  THR 100          2HG2      THR 100  -4.764   6.155   7.485
  757   3HG2  THR 100          3HG2      THR 100  -5.265   4.607   6.805
  758    H    LEU 101           H        LEU 101  -2.600   2.271   5.550
  759    HA   LEU 101           HA       LEU 101  -1.457   2.634   2.872
  760   1HB   LEU 101          2HB       LEU 101  -0.672   1.014   5.069
  761   2HB   LEU 101          1HB       LEU 101  -1.155  -0.045   3.756
  762    HG   LEU 101           HG       LEU 101   1.184   1.739   3.980
  763   1HD1  LEU 101          1HD1      LEU 101   1.560  -0.584   4.042
  764   2HD1  LEU 101          2HD1      LEU 101   2.082  -0.041   2.447
  765   3HD1  LEU 101          3HD1      LEU 101   0.534  -0.862   2.637
  766   1HD2  LEU 101          1HD2      LEU 101   1.273   1.706   1.389
  767   2HD2  LEU 101          2HD2      LEU 101   0.335   2.959   2.202
  768   3HD2  LEU 101          3HD2      LEU 101  -0.482   1.562   1.500
  769    H    LYS 102           H        LYS 102  -2.984   2.543   1.445
  770    HA   LYS 102           HA       LYS 102  -5.297   0.901   1.592
  771   1HB   LYS 102          2HB       LYS 102  -4.482   2.995  -0.018
  772   2HB   LYS 102          1HB       LYS 102  -4.503   1.629  -1.122
  773   1HG   LYS 102          2HG       LYS 102  -6.634   3.120  -0.740
  774   2HG   LYS 102          1HG       LYS 102  -6.765   1.379  -0.998
  775   1HD   LYS 102          2HD       LYS 102  -8.156   1.753   0.831
  776   2HD   LYS 102          1HD       LYS 102  -6.650   1.217   1.577
  777   1HE   LYS 102          2HE       LYS 102  -6.816   3.050   2.845
  778   2HE   LYS 102          1HE       LYS 102  -6.300   3.933   1.408
  779   1HZ   LYS 102          1HZ       LYS 102  -9.146   3.368   1.585
  780   2HZ   LYS 102          2HZ       LYS 102  -8.343   4.778   1.081
  781   3HZ   LYS 102          3HZ       LYS 102  -8.544   4.459   2.737
  782    H    LYS 103           H        LYS 103  -2.586   0.652  -0.760
  783    HA   LYS 103           HA       LYS 103  -2.658  -2.253  -0.348
  784   1HB   LYS 103          2HB       LYS 103  -2.037  -2.076  -3.006
  785   2HB   LYS 103          1HB       LYS 103  -3.615  -2.499  -2.364
  786   1HG   LYS 103          2HG       LYS 103  -4.122  -0.003  -2.413
  787   2HG   LYS 103          1HG       LYS 103  -2.674   0.148  -3.410
  788   1HD   LYS 103          2HD       LYS 103  -4.996  -1.671  -4.045
  789   2HD   LYS 103          1HD       LYS 103  -4.795  -0.049  -4.709
  790   1HE   LYS 103          2HE       LYS 103  -3.440  -0.827  -6.289
  791   2HE   LYS 103          1HE       LYS 103  -2.370  -1.517  -5.069
  792   1HZ   LYS 103          1HZ       LYS 103  -4.840  -2.876  -5.984
  793   2HZ   LYS 103          2HZ       LYS 103  -3.555  -3.537  -5.091
  794   3HZ   LYS 103          3HZ       LYS 103  -3.332  -3.124  -6.721
  795    H    ALA 104           H        ALA 104  -0.656  -3.287  -0.530
  796    HA   ALA 104           HA       ALA 104   1.580  -1.963  -1.739
  797   1HB   ALA 104          1HB       ALA 104   2.660  -2.506   0.782
  798   2HB   ALA 104          2HB       ALA 104   1.162  -1.628   1.090
  799   3HB   ALA 104          3HB       ALA 104   2.400  -0.922   0.048
  800    H    ALA 105           H        ALA 105   3.093  -3.376  -2.360
  801    HA   ALA 105           HA       ALA 105   3.165  -6.038  -1.126
  802   1HB   ALA 105          1HB       ALA 105   3.457  -5.873  -4.079
  803   2HB   ALA 105          2HB       ALA 105   1.829  -5.803  -3.401
  804   3HB   ALA 105          3HB       ALA 105   2.862  -7.195  -3.076
  805    H    VAL 106           H        VAL 106   5.227  -7.005  -1.192
  806    HA   VAL 106           HA       VAL 106   7.370  -5.159  -1.920
  807    HB   VAL 106           HB       VAL 106   7.279  -7.549  -0.086
  808   1HG1  VAL 106          1HG1      VAL 106   9.720  -6.047  -1.020
  809   2HG1  VAL 106          2HG1      VAL 106   9.365  -7.757  -1.266
  810   3HG1  VAL 106          3HG1      VAL 106   9.684  -7.148   0.357
  811   1HG2  VAL 106          1HG2      VAL 106   7.819  -5.981   1.620
  812   2HG2  VAL 106          2HG2      VAL 106   6.503  -5.289   0.671
  813   3HG2  VAL 106          3HG2      VAL 106   8.155  -4.717   0.437
  814    H    ASP 107           H        ASP 107   8.415  -5.428  -3.685
  815    HA   ASP 107           HA       ASP 107   8.208  -7.945  -5.144
  816   1HB   ASP 107          2HB       ASP 107   7.711  -5.393  -5.966
  817   2HB   ASP 107          1HB       ASP 107   9.369  -5.618  -6.518
  818    H    TYR 108           H        TYR 108  10.158  -8.168  -6.717
  819    HA   TYR 108           HA       TYR 108  12.681  -7.909  -5.356
  820   1HB   TYR 108          2HB       TYR 108  11.188 -10.521  -5.404
  821   2HB   TYR 108          1HB       TYR 108  12.949 -10.511  -5.458
  822    HD1  TYR 108           1HD      TYR 108  14.219  -9.471  -3.558
  823    HD2  TYR 108           2HD      TYR 108  10.022 -10.147  -3.374
  824    HE1  TYR 108           1HE      TYR 108  14.291  -9.229  -1.112
  825    HE2  TYR 108           2HE      TYR 108  10.081  -9.903  -0.928
  826    HH   TYR 108           HH       TYR 108  11.553  -8.778   0.781
  827    H    ASP 109           H        ASP 109  14.279  -9.553  -6.729
  828    HA   ASP 109           HA       ASP 109  13.798  -8.600  -9.460
  829   1HB   ASP 109          2HB       ASP 109  16.143  -9.083  -9.875
  830   2HB   ASP 109          1HB       ASP 109  16.012  -8.131  -8.398
  831    H    ARG 110           H        ARG 110  14.706 -10.306 -11.144
  832    HA   ARG 110           HA       ARG 110  12.896 -12.405 -11.213
  833   1HB   ARG 110          2HB       ARG 110  15.248 -11.590 -12.755
  834   2HB   ARG 110          1HB       ARG 110  14.935 -13.319 -12.804
  835   1HG   ARG 110          2HG       ARG 110  12.663 -12.896 -13.579
  836   2HG   ARG 110          1HG       ARG 110  12.964 -11.157 -13.515
  837   1HD   ARG 110          2HD       ARG 110  14.963 -11.704 -15.073
  838   2HD   ARG 110          1HD       ARG 110  14.096 -13.209 -15.376
  839    HE   ARG 110           HE       ARG 110  12.320 -11.959 -16.343
  840   1HH1  ARG 110          1HH1      ARG 110  15.113 -10.013 -15.490
  841   2HH1  ARG 110          2HH1      ARG 110  14.687  -8.705 -16.560
  842   1HH2  ARG 110          1HH2      ARG 110  11.760 -10.249 -17.746
  843   2HH2  ARG 110          2HH2      ARG 110  12.786  -8.849 -17.848
  844    H    SER 111           H        SER 111  16.171 -12.356  -9.925
  845    HA   SER 111           HA       SER 111  16.152 -15.232  -9.508
  846   1HB   SER 111          2HB       SER 111  18.414 -14.018  -8.286
  847   2HB   SER 111          1HB       SER 111  18.356 -14.969  -9.771
  848    HG   SER 111           HG       SER 111  18.089 -12.159  -9.459
  849    H    GLY 112           H        GLY 112  14.882 -12.671  -7.887
  850   1HA   GLY 112          2HA       GLY 112  14.286 -12.227  -5.716
  851   2HA   GLY 112          1HA       GLY 112  14.245 -13.975  -5.541
  852    H    ARG 113           H        ARG 113  16.697 -11.410  -5.812
  853    HA   ARG 113           HA       ARG 113  18.744 -12.889  -4.582
  854   1HB   ARG 113          2HB       ARG 113  18.366  -9.919  -4.949
  855   2HB   ARG 113          1HB       ARG 113  19.825 -10.612  -4.255
  856   1HG   ARG 113          2HG       ARG 113  18.748 -11.187  -7.007
  857   2HG   ARG 113          1HG       ARG 113  20.090 -10.106  -6.627
  858   1HD   ARG 113          2HD       ARG 113  20.064 -13.020  -5.880
  859   2HD   ARG 113          1HD       ARG 113  20.711 -12.427  -7.409
  860    HE   ARG 113           HE       ARG 113  21.924 -10.967  -5.372
  861   1HH1  ARG 113          1HH1      ARG 113  21.780 -14.279  -6.489
  862   2HH1  ARG 113          2HH1      ARG 113  23.383 -14.669  -5.934
  863   1HH2  ARG 113          1HH2      ARG 113  24.018 -11.464  -4.633
  864   2HH2  ARG 113          2HH2      ARG 113  24.657 -13.068  -4.860
  865    H    SER 114           H        SER 114  17.213 -10.003  -3.157
  866    HA   SER 114           HA       SER 114  16.613 -10.711  -0.648
  867   1HB   SER 114          2HB       SER 114  18.901 -10.111   0.558
  868   2HB   SER 114          1HB       SER 114  18.555 -11.760   0.039
  869    HG   SER 114           HG       SER 114  20.020 -11.606  -1.503
  870    H    LEU 115           H        LEU 115  16.972  -8.451  -2.830
  871    HA   LEU 115           HA       LEU 115  17.949  -6.196  -1.471
  872   1HB   LEU 115          2HB       LEU 115  16.346  -5.018  -3.235
  873   2HB   LEU 115          1HB       LEU 115  17.891  -5.714  -3.678
  874    HG   LEU 115           HG       LEU 115  15.644  -7.602  -3.882
  875   1HD1  LEU 115          1HD1      LEU 115  15.439  -4.931  -5.039
  876   2HD1  LEU 115          2HD1      LEU 115  14.216  -6.193  -4.862
  877   3HD1  LEU 115          3HD1      LEU 115  15.327  -6.226  -6.232
  878   1HD2  LEU 115          1HD2      LEU 115  17.850  -6.700  -5.732
  879   2HD2  LEU 115          2HD2      LEU 115  16.725  -8.016  -6.063
  880   3HD2  LEU 115          3HD2      LEU 115  17.849  -8.138  -4.711
  881    H    GLY 116           H        GLY 116  14.535  -6.693  -2.387
  882   1HA   GLY 116          2HA       GLY 116  12.747  -6.664  -0.787
  883   2HA   GLY 116          1HA       GLY 116  13.776  -5.721   0.282
  884    H    THR 117           H        THR 117  12.837  -5.328  -3.126
  885    HA   THR 117           HA       THR 117  12.221  -2.542  -2.741
  886    HB   THR 117           HB       THR 117  11.244  -2.971  -5.170
  887    HG1  THR 117           1HG      THR 117  11.637  -5.353  -4.732
  888   1HG2  THR 117          1HG2      THR 117  13.244  -1.623  -4.618
  889   2HG2  THR 117          2HG2      THR 117  13.441  -2.545  -6.110
  890   3HG2  THR 117          3HG2      THR 117  14.213  -3.096  -4.623
  891    H    ALA 118           H        ALA 118  10.000  -1.680  -3.305
  892    HA   ALA 118           HA       ALA 118   7.861  -3.635  -3.238
  893   1HB   ALA 118          1HB       ALA 118   7.658  -1.502  -1.164
  894   2HB   ALA 118          2HB       ALA 118   8.545  -2.987  -0.821
  895   3HB   ALA 118          3HB       ALA 118   6.836  -3.061  -1.263
  896    H    ASP 119           H        ASP 119   5.742  -2.708  -3.458
  897    HA   ASP 119           HA       ASP 119   5.641  -0.012  -4.625
  898   1HB   ASP 119          2HB       ASP 119   5.618  -1.719  -6.449
  899   2HB   ASP 119          1HB       ASP 119   4.207  -2.460  -5.706
  900    H    VAL 120           H        VAL 120   4.442   1.082  -3.182
  901    HA   VAL 120           HA       VAL 120   2.040  -0.262  -2.141
  902    HB   VAL 120           HB       VAL 120   2.237   0.692  -0.110
  903   1HG1  VAL 120          1HG1      VAL 120   4.908   1.551  -0.038
  904   2HG1  VAL 120          2HG1      VAL 120   4.833   0.231  -1.209
  905   3HG1  VAL 120          3HG1      VAL 120   4.253  -0.018   0.440
  906   1HG2  VAL 120          1HG2      VAL 120   2.968   3.119  -1.610
  907   2HG2  VAL 120          2HG2      VAL 120   3.561   3.015   0.048
  908   3HG2  VAL 120          3HG2      VAL 120   1.833   2.899  -0.280
  909    H    HIS 121           H        HIS 121   0.067   0.851  -2.186
  910    HA   HIS 121           HA       HIS 121   0.033   3.165  -4.004
  911   1HB   HIS 121          2HB       HIS 121  -1.042   0.475  -4.342
  912   2HB   HIS 121          1HB       HIS 121  -2.270   1.718  -4.532
  913    HD1  HIS 121           1HD      HIS 121   0.695   0.233  -6.207
  914    HD2  HIS 121           2HD      HIS 121  -1.822   3.515  -6.696
  915    HE1  HIS 121           1HE      HIS 121   1.028   0.996  -8.572
  916    HE2  HIS 121           2HE      HIS 121  -0.656   2.844  -8.910
  917    H    PHE 122           H        PHE 122  -1.085   4.823  -3.148
  918    HA   PHE 122           HA       PHE 122  -3.459   4.109  -1.566
  919   1HB   PHE 122          2HB       PHE 122  -2.721   6.766  -0.902
  920   2HB   PHE 122          1HB       PHE 122  -2.780   5.357   0.147
  921    HD1  PHE 122           1HD      PHE 122  -0.846   4.634   1.183
  922    HD2  PHE 122           2HD      PHE 122  -0.555   7.077  -2.284
  923    HE1  PHE 122           1HE      PHE 122   1.589   4.743   1.470
  924    HE2  PHE 122           2HE      PHE 122   1.882   7.193  -2.002
  925    HZ   PHE 122           HZ       PHE 122   2.941   6.101  -0.023
  926    H    GLU 123           H        GLU 123  -5.221   5.670  -1.727
  927    HA   GLU 123           HA       GLU 123  -5.581   6.367  -4.508
  928   1HB   GLU 123          2HB       GLU 123  -7.707   7.237  -2.723
  929   2HB   GLU 123          1HB       GLU 123  -7.769   6.127  -4.084
  930   1HG   GLU 123          2HG       GLU 123  -8.401   4.771  -2.352
  931   2HG   GLU 123          1HG       GLU 123  -6.669   4.454  -2.426
  932    H    ARG 124           H        ARG 124  -4.305   7.980  -1.879
  933    HA   ARG 124           HA       ARG 124  -5.369  10.581  -2.705
  934   1HB   ARG 124          2HB       ARG 124  -4.094   9.580  -0.175
  935   2HB   ARG 124          1HB       ARG 124  -4.245  11.300  -0.508
  936   1HG   ARG 124          2HG       ARG 124  -6.326  11.283   0.243
  937   2HG   ARG 124          1HG       ARG 124  -6.773  10.079  -0.966
  938   1HD   ARG 124          2HD       ARG 124  -7.208   9.442   1.437
  939   2HD   ARG 124          1HD       ARG 124  -6.265   8.288   0.494
  940    HE   ARG 124           HE       ARG 124  -4.337   8.882   1.706
  941   1HH1  ARG 124          1HH1      ARG 124  -7.204  10.564   2.832
  942   2HH1  ARG 124          2HH1      ARG 124  -6.465  11.084   4.317
  943   1HH2  ARG 124          1HH2      ARG 124  -3.360   9.578   3.635
  944   2HH2  ARG 124          2HH2      ARG 124  -4.290  10.495   4.794
  945    H    ARG 125           H        ARG 125  -4.069  12.137  -3.545
  946    HA   ARG 125           HA       ARG 125  -1.394  11.433  -4.299
  947   1HB   ARG 125          2HB       ARG 125  -2.614  14.173  -4.545
  948   2HB   ARG 125          1HB       ARG 125  -1.398  13.417  -5.569
  949   1HG   ARG 125          2HG       ARG 125  -2.945  12.163  -6.715
  950   2HG   ARG 125          1HG       ARG 125  -4.118  12.212  -5.397
  951   1HD   ARG 125          2HD       ARG 125  -3.363  14.755  -6.748
  952   2HD   ARG 125          1HD       ARG 125  -4.454  13.644  -7.576
  953    HE   ARG 125           HE       ARG 125  -4.982  15.099  -5.089
  954   1HH1  ARG 125          1HH1      ARG 125  -6.085  12.877  -7.579
  955   2HH1  ARG 125          2HH1      ARG 125  -7.754  12.993  -7.109
  956   1HH2  ARG 125          1HH2      ARG 125  -7.191  15.232  -4.473
  957   2HH2  ARG 125          2HH2      ARG 125  -8.384  14.314  -5.353
  958    H    ALA 126           H        ALA 126  -2.915  13.563  -1.924
  959    HA   ALA 126           HA       ALA 126  -0.617  14.827  -0.943
  960   1HB   ALA 126          1HB       ALA 126  -3.311  14.232   0.129
  961   2HB   ALA 126          2HB       ALA 126  -2.457  15.768  -0.007
  962   3HB   ALA 126          3HB       ALA 126  -2.057  14.649   1.297
  963    H    ASP 127           H        ASP 127  -1.972  11.675  -0.299
  964    HA   ASP 127           HA       ASP 127  -0.367  10.798   1.802
  965   1HB   ASP 127          2HB       ASP 127  -1.947   9.532  -0.322
  966   2HB   ASP 127          1HB       ASP 127  -0.576   8.559   0.195
  967    H    ALA 128           H        ALA 128   0.278  11.042  -1.634
  968    HA   ALA 128           HA       ALA 128   2.837   9.728  -1.487
  969   1HB   ALA 128          1HB       ALA 128   2.230  11.435  -3.817
  970   2HB   ALA 128          2HB       ALA 128   1.106  10.108  -3.521
  971   3HB   ALA 128          3HB       ALA 128   2.825   9.774  -3.749
  972    H    LEU 129           H        LEU 129   1.605  13.017  -1.714
  973    HA   LEU 129           HA       LEU 129   3.997  14.418  -1.959
  974   1HB   LEU 129          2HB       LEU 129   1.690  15.354  -2.137
  975   2HB   LEU 129          1HB       LEU 129   1.550  15.245  -0.394
  976    HG   LEU 129           HG       LEU 129   3.920  16.723  -1.113
  977   1HD1  LEU 129          1HD1      LEU 129   2.563  17.173  -3.159
  978   2HD1  LEU 129          2HD1      LEU 129   2.934  18.607  -2.203
  979   3HD1  LEU 129          3HD1      LEU 129   1.328  17.883  -2.119
  980   1HD2  LEU 129          1HD2      LEU 129   2.830  16.786   1.067
  981   2HD2  LEU 129          2HD2      LEU 129   1.380  17.474   0.334
  982   3HD2  LEU 129          3HD2      LEU 129   2.885  18.395   0.345
  983    H    LYS 130           H        LYS 130   2.214  13.565   1.004
  984    HA   LYS 130           HA       LYS 130   4.100  14.552   2.821
  985   1HB   LYS 130          2HB       LYS 130   2.200  14.090   3.969
  986   2HB   LYS 130          1HB       LYS 130   1.776  12.738   2.928
  987   1HG   LYS 130          2HG       LYS 130   2.289  11.436   4.657
  988   2HG   LYS 130          1HG       LYS 130   3.978  11.807   4.292
  989   1HD   LYS 130          2HD       LYS 130   4.190  13.206   6.059
  990   2HD   LYS 130          1HD       LYS 130   2.528  13.788   5.936
  991   1HE   LYS 130          2HE       LYS 130   2.326  11.092   6.643
  992   2HE   LYS 130          1HE       LYS 130   3.636  11.738   7.630
  993   1HZ   LYS 130          1HZ       LYS 130   2.195  12.830   8.888
  994   2HZ   LYS 130          2HZ       LYS 130   0.946  11.993   8.103
  995   3HZ   LYS 130          3HZ       LYS 130   1.421  13.525   7.548
  996    H    ALA 131           H        ALA 131   3.796  11.389   1.285
  997    HA   ALA 131           HA       ALA 131   5.801  10.128   2.871
  998   1HB   ALA 131          1HB       ALA 131   5.626   8.268   1.396
  999   2HB   ALA 131          2HB       ALA 131   4.919   9.268   0.125
 1000   3HB   ALA 131          3HB       ALA 131   4.004   8.935   1.596
 1001    H    MET 132           H        MET 132   5.886  11.871  -0.198
 1002    HA   MET 132           HA       MET 132   8.586  11.119  -0.768
 1003   1HB   MET 132          2HB       MET 132   8.405  12.380  -2.709
 1004   2HB   MET 132          1HB       MET 132   6.748  11.875  -2.422
 1005   1HG   MET 132          2HG       MET 132   6.226  14.050  -1.478
 1006   2HG   MET 132          1HG       MET 132   7.898  14.560  -1.699
 1007   1HE   MET 132          1HE       MET 132   4.865  13.663  -5.008
 1008   2HE   MET 132          2HE       MET 132   4.996  12.888  -3.428
 1009   3HE   MET 132          3HE       MET 132   6.085  12.419  -4.734
 1010    H    LYS 133           H        LYS 133   7.091  13.593   1.146
 1011    HA   LYS 133           HA       LYS 133   9.580  15.098   1.302
 1012   1HB   LYS 133          2HB       LYS 133   6.774  15.571   1.957
 1013   2HB   LYS 133          1HB       LYS 133   7.870  16.139   3.210
 1014   1HG   LYS 133          2HG       LYS 133   7.703  17.995   1.877
 1015   2HG   LYS 133          1HG       LYS 133   9.144  17.225   1.212
 1016   1HD   LYS 133          2HD       LYS 133   8.115  17.408  -0.769
 1017   2HD   LYS 133          1HD       LYS 133   7.122  16.053  -0.228
 1018   1HE   LYS 133          2HE       LYS 133   5.376  17.406  -0.553
 1019   2HE   LYS 133          1HE       LYS 133   5.886  18.218   0.926
 1020   1HZ   LYS 133          1HZ       LYS 133   7.170  19.769  -0.399
 1021   2HZ   LYS 133          2HZ       LYS 133   5.547  19.783  -0.892
 1022   3HZ   LYS 133          3HZ       LYS 133   6.708  18.977  -1.827
 1023    H    GLN 134           H        GLN 134   7.544  13.077   3.360
 1024    HA   GLN 134           HA       GLN 134   9.258  13.431   5.649
 1025   1HB   GLN 134          2HB       GLN 134   6.656  12.181   5.092
 1026   2HB   GLN 134          1HB       GLN 134   7.612  11.360   6.316
 1027   1HG   GLN 134          2HG       GLN 134   5.980  13.130   7.108
 1028   2HG   GLN 134          1HG       GLN 134   7.630  13.225   7.721
 1029   1HE2  GLN 134          1HE2      GLN 134   5.554  14.468   5.143
 1030   2HE2  GLN 134          2HE2      GLN 134   6.261  16.047   5.093
 1031    H    TYR 135           H        TYR 135   8.276  10.551   3.762
 1032    HA   TYR 135           HA       TYR 135  10.146   8.877   5.101
 1033   1HB   TYR 135          2HB       TYR 135   8.007   8.550   3.247
 1034   2HB   TYR 135          1HB       TYR 135   9.425   7.734   2.597
 1035    HD1  TYR 135           1HD      TYR 135   8.740   5.492   2.852
 1036    HD2  TYR 135           2HD      TYR 135   8.620   8.128   6.183
 1037    HE1  TYR 135           1HE      TYR 135   8.310   3.581   4.341
 1038    HE2  TYR 135           2HE      TYR 135   8.188   6.237   7.683
 1039    HH   TYR 135           HH       TYR 135   7.622   4.040   7.779
 1040    H    LYS 136           H        LYS 136  10.093  10.327   1.861
 1041    HA   LYS 136           HA       LYS 136  12.564   9.196   1.063
 1042   1HB   LYS 136          2HB       LYS 136  10.689  10.236  -0.387
 1043   2HB   LYS 136          1HB       LYS 136  11.489  11.767  -0.055
 1044   1HG   LYS 136          2HG       LYS 136  13.577  10.199  -0.841
 1045   2HG   LYS 136          1HG       LYS 136  12.256   9.595  -1.844
 1046   1HD   LYS 136          2HD       LYS 136  13.424  11.394  -2.987
 1047   2HD   LYS 136          1HD       LYS 136  11.781  11.893  -2.580
 1048   1HE   LYS 136          2HE       LYS 136  13.604  12.540  -0.443
 1049   2HE   LYS 136          1HE       LYS 136  14.167  13.221  -1.969
 1050   1HZ   LYS 136          1HZ       LYS 136  11.426  13.575  -0.876
 1051   2HZ   LYS 136          2HZ       LYS 136  12.064  14.311  -2.264
 1052   3HZ   LYS 136          3HZ       LYS 136  12.672  14.717  -0.734
 1053    H    GLY 137           H        GLY 137  14.481   9.637   1.833
 1054   1HA   GLY 137          2HA       GLY 137  16.234  11.315   2.153
 1055   2HA   GLY 137          1HA       GLY 137  15.006  12.354   2.868
 1056    H    VAL 138           H        VAL 138  14.236   9.395   3.956
 1057    HA   VAL 138           HA       VAL 138  15.593   9.812   6.494
 1058    HB   VAL 138           HB       VAL 138  13.442   7.869   5.651
 1059   1HG1  VAL 138          1HG1      VAL 138  13.808   8.010   8.495
 1060   2HG1  VAL 138          2HG1      VAL 138  15.304   7.493   7.717
 1061   3HG1  VAL 138          3HG1      VAL 138  13.808   6.598   7.437
 1062   1HG2  VAL 138          1HG2      VAL 138  12.462   9.300   7.732
 1063   2HG2  VAL 138          2HG2      VAL 138  12.225   9.719   6.035
 1064   3HG2  VAL 138          3HG2      VAL 138  13.508  10.495   6.964
 1065    HA   PRO 139           HA       PRO 139  18.648   6.667   5.456
 1066   1HB   PRO 139          2HB       PRO 139  20.095   7.025   7.732
 1067   2HB   PRO 139          1HB       PRO 139  20.273   8.064   6.312
 1068   1HG   PRO 139          2HG       PRO 139  18.760   8.552   8.841
 1069   2HG   PRO 139          1HG       PRO 139  19.748   9.675   7.890
 1070   1HD   PRO 139          2HD       PRO 139  17.026   9.619   7.784
 1071   2HD   PRO 139          1HD       PRO 139  18.042  10.125   6.420
 1072    H    LEU 140           H        LEU 140  18.142   4.564   5.843
 1073    HA   LEU 140           HA       LEU 140  16.700   4.009   8.341
 1074   1HB   LEU 140          2HB       LEU 140  15.554   3.713   6.040
 1075   2HB   LEU 140          1HB       LEU 140  16.585   2.306   5.864
 1076    HG   LEU 140           HG       LEU 140  15.581   1.564   8.136
 1077   1HD1  LEU 140          1HD1      LEU 140  13.434   3.474   7.228
 1078   2HD1  LEU 140          2HD1      LEU 140  14.509   3.742   8.601
 1079   3HD1  LEU 140          3HD1      LEU 140  13.375   2.391   8.619
 1080   1HD2  LEU 140          1HD2      LEU 140  15.145   0.346   6.133
 1081   2HD2  LEU 140          2HD2      LEU 140  14.036   1.588   5.550
 1082   3HD2  LEU 140          3HD2      LEU 140  13.601   0.602   6.947
 1083    H    ASP 141           H        ASP 141  18.197   3.280   9.701
 1084    HA   ASP 141           HA       ASP 141  20.115   2.363  10.503
 1085   1HB   ASP 141          2HB       ASP 141  18.594   0.338  10.042
 1086   2HB   ASP 141          1HB       ASP 141  19.629   0.039   8.650
 1087    H    GLY 142           H        GLY 142  21.563   3.872   9.618
 1088   1HA   GLY 142          2HA       GLY 142  23.750   3.951   8.776
 1089   2HA   GLY 142          1HA       GLY 142  23.383   2.580   7.743
 1090    H    ARG 143           H        ARG 143  21.517   3.184   6.028
 1091    HA   ARG 143           HA       ARG 143  22.486   5.700   4.834
 1092   1HB   ARG 143          2HB       ARG 143  21.946   3.122   3.349
 1093   2HB   ARG 143          1HB       ARG 143  22.604   4.607   2.679
 1094   1HG   ARG 143          2HG       ARG 143  24.312   3.920   4.779
 1095   2HG   ARG 143          1HG       ARG 143  23.959   2.411   3.938
 1096   1HD   ARG 143          2HD       ARG 143  25.624   3.056   2.575
 1097   2HD   ARG 143          1HD       ARG 143  24.383   4.072   1.843
 1098    HE   ARG 143           HE       ARG 143  25.333   5.948   2.834
 1099   1HH1  ARG 143          1HH1      ARG 143  26.952   3.021   3.904
 1100   2HH1  ARG 143          2HH1      ARG 143  28.326   3.870   4.552
 1101   1HH2  ARG 143          1HH2      ARG 143  27.140   7.061   3.689
 1102   2HH2  ARG 143          2HH2      ARG 143  28.440   6.164   4.418
 1103    HA   PRO 144           HA       PRO 144  18.284   6.799   4.143
 1104   1HB   PRO 144          2HB       PRO 144  19.039   7.798   1.472
 1105   2HB   PRO 144          1HB       PRO 144  18.381   8.675   2.857
 1106   1HG   PRO 144          2HG       PRO 144  20.936   8.959   2.109
 1107   2HG   PRO 144          1HG       PRO 144  20.457   8.989   3.816
 1108   1HD   PRO 144          2HD       PRO 144  21.709   6.776   2.233
 1109   2HD   PRO 144          1HD       PRO 144  22.041   7.300   3.899
 1110    H    MET 145           H        MET 145  16.504   5.872   3.360
 1111    HA   MET 145           HA       MET 145  16.836   3.751   1.382
 1112   1HB   MET 145          2HB       MET 145  14.570   3.045   2.040
 1113   2HB   MET 145          1HB       MET 145  15.657   3.146   3.418
 1114   1HG   MET 145          2HG       MET 145  14.669   5.196   4.136
 1115   2HG   MET 145          1HG       MET 145  13.707   5.304   2.661
 1116   1HE   MET 145          1HE       MET 145  11.118   5.056   5.188
 1117   2HE   MET 145          2HE       MET 145  12.667   5.898   5.118
 1118   3HE   MET 145          3HE       MET 145  12.397   4.650   6.333
 1119    H    ASP 146           H        ASP 146  15.278   3.501  -0.330
 1120    HA   ASP 146           HA       ASP 146  14.699   6.117  -1.549
 1121   1HB   ASP 146          2HB       ASP 146  16.202   4.582  -2.779
 1122   2HB   ASP 146          1HB       ASP 146  14.910   3.383  -2.830
 1123    H    ILE 147           H        ILE 147  12.697   6.764  -1.914
 1124    HA   ILE 147           HA       ILE 147  10.515   4.883  -2.170
 1125    HB   ILE 147           HB       ILE 147   9.195   6.477  -0.521
 1126   1HG1  ILE 147          2HG1      ILE 147  11.736   7.466  -0.133
 1127   2HG1  ILE 147          1HG1      ILE 147  10.373   7.692   0.956
 1128   1HG2  ILE 147          1HG2      ILE 147  10.823   4.410   0.864
 1129   2HG2  ILE 147          2HG2      ILE 147   9.778   3.920  -0.469
 1130   3HG2  ILE 147          3HG2      ILE 147   9.089   4.726   0.940
 1131   1HD1  ILE 147          1HD1      ILE 147  11.113   5.662   2.186
 1132   2HD1  ILE 147          2HD1      ILE 147  12.259   7.003   2.229
 1133   3HD1  ILE 147          3HD1      ILE 147  12.548   5.630   1.161
 1134    H    GLN 148           H        GLN 148   9.892   5.574  -4.092
 1135    HA   GLN 148           HA       GLN 148   9.523   8.475  -4.478
 1136   1HB   GLN 148          2HB       GLN 148  10.091   6.333  -6.534
 1137   2HB   GLN 148          1HB       GLN 148   9.772   8.023  -6.905
 1138   1HG   GLN 148          2HG       GLN 148  11.773   8.730  -5.888
 1139   2HG   GLN 148          1HG       GLN 148  12.017   7.167  -5.110
 1140   1HE2  GLN 148          1HE2      GLN 148  13.787   6.331  -5.948
 1141   2HE2  GLN 148          2HE2      GLN 148  14.142   6.210  -7.645
 1142    H    LEU 149           H        LEU 149   7.597   9.227  -5.355
 1143    HA   LEU 149           HA       LEU 149   5.460   7.214  -5.489
 1144   1HB   LEU 149          2HB       LEU 149   5.268   9.954  -4.249
 1145   2HB   LEU 149          1HB       LEU 149   3.972   8.775  -4.367
 1146    HG   LEU 149           HG       LEU 149   5.973   7.381  -3.081
 1147   1HD1  LEU 149          1HD1      LEU 149   6.513   8.899  -1.155
 1148   2HD1  LEU 149          2HD1      LEU 149   5.973  10.239  -2.167
 1149   3HD1  LEU 149          3HD1      LEU 149   7.346   9.250  -2.669
 1150   1HD2  LEU 149          1HD2      LEU 149   4.310   8.505  -1.112
 1151   2HD2  LEU 149          2HD2      LEU 149   4.170   6.931  -1.893
 1152   3HD2  LEU 149          3HD2      LEU 149   3.339   8.329  -2.572
 1153    H    VAL 150           H        VAL 150   4.955   7.149  -7.542
 1154    HA   VAL 150           HA       VAL 150   5.210   9.622  -9.111
 1155    HB   VAL 150           HB       VAL 150   5.350   7.920 -11.066
 1156   1HG1  VAL 150          1HG1      VAL 150   7.282   9.098 -10.798
 1157   2HG1  VAL 150          2HG1      VAL 150   7.859   7.501 -10.319
 1158   3HG1  VAL 150          3HG1      VAL 150   7.425   8.688  -9.088
 1159   1HG2  VAL 150          1HG2      VAL 150   6.260   5.755 -10.503
 1160   2HG2  VAL 150          2HG2      VAL 150   4.700   5.962  -9.705
 1161   3HG2  VAL 150          3HG2      VAL 150   6.193   6.140  -8.784
 1162    H    ALA 151           H        ALA 151   3.767  10.022 -10.797
 1163    HA   ALA 151           HA       ALA 151   1.800  10.131 -11.918
 1164   1HB   ALA 151          1HB       ALA 151   0.468   7.873 -11.958
 1165   2HB   ALA 151          2HB       ALA 151   1.963   7.231 -11.275
 1166   3HB   ALA 151          3HB       ALA 151   1.987   8.048 -12.838
 1167    H    SER 152           H        SER 152   1.942  10.550  -8.930
 1168    HA   SER 152           HA       SER 152  -0.651   9.845  -7.936
 1169   1HB   SER 152          2HB       SER 152   0.262  11.768  -6.231
 1170   2HB   SER 152          1HB       SER 152   0.700  10.062  -6.122
 1171    HG   SER 152           HG       SER 152   2.671  10.571  -6.648
 1172    H    GLN 153           H        GLN 153   0.926  12.951  -8.612
 1173    HA   GLN 153           HA       GLN 153  -1.728  14.095  -9.188
 1174   1HB   GLN 153          2HB       GLN 153   0.303  16.098  -8.743
 1175   2HB   GLN 153          1HB       GLN 153  -1.223  15.866  -7.908
 1176   1HG   GLN 153          2HG       GLN 153   0.257  15.668  -6.179
 1177   2HG   GLN 153          1HG       GLN 153   0.075  13.981  -6.653
 1178   1HE2  GLN 153          1HE2      GLN 153   2.282  15.553  -5.351
 1179   2HE2  GLN 153          2HE2      GLN 153   3.687  15.174  -6.281
 1180    H    ILE 154           H        ILE 154   1.703  14.456  -9.934
 1181    HA   ILE 154           HA       ILE 154   2.833  15.203 -11.759
 1182    HB   ILE 154           HB       ILE 154   2.337  13.787 -13.825
 1183   1HG1  ILE 154          2HG1      ILE 154   0.864  11.880 -12.123
 1184   2HG1  ILE 154          1HG1      ILE 154  -0.064  13.292 -12.619
 1185   1HG2  ILE 154          1HG2      ILE 154   3.114  12.737 -11.134
 1186   2HG2  ILE 154          2HG2      ILE 154   4.140  13.168 -12.501
 1187   3HG2  ILE 154          3HG2      ILE 154   3.156  11.705 -12.564
 1188   1HD1  ILE 154          1HD1      ILE 154  -0.432  11.528 -14.187
 1189   2HD1  ILE 154          2HD1      ILE 154   1.303  11.299 -14.408
 1190   3HD1  ILE 154          3HD1      ILE 154   0.531  12.781 -14.971
 1191    H    ASP 155           H        ASP 155   0.592  16.890 -11.294
 1192    HA   ASP 155           HA       ASP 155   0.636  18.589 -13.452
 1193   1HB   ASP 155          2HB       ASP 155  -0.665  16.658 -14.562
 1194   2HB   ASP 155          1HB       ASP 155  -1.997  17.109 -13.497
 1195    H    LEU 156           H        LEU 156  -1.708  17.167 -11.232
 1196    HA   LEU 156           HA       LEU 156  -3.086  19.485 -10.518
 1197   1HB   LEU 156          2HB       LEU 156  -2.514  17.009  -8.885
 1198   2HB   LEU 156          1HB       LEU 156  -3.709  18.224  -8.469
 1199    HG   LEU 156           HG       LEU 156  -3.758  16.402 -10.873
 1200   1HD1  LEU 156          1HD1      LEU 156  -5.539  15.301  -9.848
 1201   2HD1  LEU 156          2HD1      LEU 156  -5.790  16.596  -8.680
 1202   3HD1  LEU 156          3HD1      LEU 156  -4.382  15.545  -8.540
 1203   1HD2  LEU 156          1HD2      LEU 156  -4.839  18.130 -11.813
 1204   2HD2  LEU 156          2HD2      LEU 156  -5.158  18.910 -10.262
 1205   3HD2  LEU 156          3HD2      LEU 156  -6.182  17.579 -10.806
 1206    H    GLU 157           H        GLU 157  -0.523  17.830  -8.727
 1207    HA   GLU 157           HA       GLU 157   0.350  20.411  -7.649
 1208   1HB   GLU 157          2HB       GLU 157   0.129  17.826  -6.092
 1209   2HB   GLU 157          1HB       GLU 157   0.733  19.356  -5.471
 1210   1HG   GLU 157          2HG       GLU 157  -1.556  20.303  -6.044
 1211   2HG   GLU 157          1HG       GLU 157  -2.068  18.629  -6.246
 1212    H    HIS 158           H        HIS 158   2.594  20.543  -7.237
 1213    HA   HIS 158           HA       HIS 158   4.330  18.315  -7.751
 1214   1HB   HIS 158          2HB       HIS 158   3.482  19.382 -10.035
 1215   2HB   HIS 158          1HB       HIS 158   4.732  20.569  -9.675
 1216    HD1  HIS 158           1HD      HIS 158   6.993  20.004 -10.482
 1217    HD2  HIS 158           2HD      HIS 158   4.599  16.627 -10.084
 1218    HE1  HIS 158           1HE      HIS 158   8.361  18.092 -11.378
 1219    HE2  HIS 158           2HE      HIS 158   6.805  16.109 -11.342
  Start of MODEL    3
    1    H    MET   1           H        MET   1 -15.833  69.579  17.878
    2    HA   MET   1           HA       MET   1 -14.559  67.101  17.106
    3   1HB   MET   1          2HB       MET   1 -16.911  68.419  16.395
    4   2HB   MET   1          1HB       MET   1 -15.891  68.552  14.970
    5   1HG   MET   1          2HG       MET   1 -15.568  65.934  15.645
    6   2HG   MET   1          1HG       MET   1 -17.243  66.231  16.108
    7   1HE   MET   1          1HE       MET   1 -15.819  64.447  13.062
    8   2HE   MET   1          2HE       MET   1 -14.694  65.624  13.740
    9   3HE   MET   1          3HE       MET   1 -15.321  65.844  12.107
   10    H    ALA   2           H        ALA   2 -14.467  70.506  16.231
   11    HA   ALA   2           HA       ALA   2 -12.862  71.823  15.327
   12   1HB   ALA   2          1HB       ALA   2 -11.244  69.493  16.180
   13   2HB   ALA   2          2HB       ALA   2 -11.124  71.190  16.644
   14   3HB   ALA   2          3HB       ALA   2 -10.506  70.658  15.080
   15    H    ASP   3           H        ASP   3 -14.363  69.592  13.848
   16    HA   ASP   3           HA       ASP   3 -13.012  70.051  11.270
   17   1HB   ASP   3          2HB       ASP   3 -12.826  67.680  11.821
   18   2HB   ASP   3          1HB       ASP   3 -14.544  67.587  12.145
   19    H    LYS   4           H        LYS   4 -16.030  68.532  12.132
   20    HA   LYS   4           HA       LYS   4 -18.215  69.031  11.762
   21   1HB   LYS   4          2HB       LYS   4 -17.059  71.815  11.770
   22   2HB   LYS   4          1HB       LYS   4 -18.788  71.508  11.629
   23   1HG   LYS   4          2HG       LYS   4 -17.017  70.705  13.931
   24   2HG   LYS   4          1HG       LYS   4 -18.151  72.056  13.913
   25   1HD   LYS   4          2HD       LYS   4 -19.450  69.600  13.134
   26   2HD   LYS   4          1HD       LYS   4 -18.662  69.429  14.704
   27   1HE   LYS   4          2HE       LYS   4 -20.525  71.681  13.967
   28   2HE   LYS   4          1HE       LYS   4 -21.020  70.225  14.827
   29   1HZ   LYS   4          1HZ       LYS   4 -20.332  72.404  16.091
   30   2HZ   LYS   4          2HZ       LYS   4 -18.771  71.765  15.918
   31   3HZ   LYS   4          3HZ       LYS   4 -19.972  70.872  16.722
   32    H    MET   5           H        MET   5 -16.315  68.482   9.581
   33    HA   MET   5           HA       MET   5 -17.643  69.873   7.347
   34   1HB   MET   5          2HB       MET   5 -14.858  69.179   7.889
   35   2HB   MET   5          1HB       MET   5 -15.394  68.629   6.308
   36   1HG   MET   5          2HG       MET   5 -15.301  71.425   7.378
   37   2HG   MET   5          1HG       MET   5 -14.478  70.755   5.970
   38   1HE   MET   5          1HE       MET   5 -18.529  72.483   6.515
   39   2HE   MET   5          2HE       MET   5 -17.173  73.530   6.099
   40   3HE   MET   5          3HE       MET   5 -17.078  72.488   7.518
   41    H    ASP   6           H        ASP   6 -16.125  66.763   8.203
   42    HA   ASP   6           HA       ASP   6 -18.047  65.444   6.396
   43   1HB   ASP   6          2HB       ASP   6 -15.223  64.976   6.986
   44   2HB   ASP   6          1HB       ASP   6 -16.197  63.513   7.104
   45    H    MET   7           H        MET   7 -16.943  65.754   9.631
   46    HA   MET   7           HA       MET   7 -17.825  65.141  11.619
   47   1HB   MET   7          2HB       MET   7 -20.045  65.283   9.834
   48   2HB   MET   7          1HB       MET   7 -20.298  63.929  10.927
   49   1HG   MET   7          2HG       MET   7 -21.237  65.583  12.153
   50   2HG   MET   7          1HG       MET   7 -19.578  65.702  12.734
   51   1HE   MET   7          1HE       MET   7 -22.376  67.716  10.487
   52   2HE   MET   7          2HE       MET   7 -21.392  66.596   9.544
   53   3HE   MET   7          3HE       MET   7 -21.183  68.336   9.346
   54    H    SER   8           H        SER   8 -19.745  62.615  10.182
   55    HA   SER   8           HA       SER   8 -18.337  60.652  11.754
   56   1HB   SER   8          2HB       SER   8 -20.400  59.768   9.822
   57   2HB   SER   8          1HB       SER   8 -20.207  59.372  11.531
   58    HG   SER   8           HG       SER   8 -21.002  61.494  12.003
   59    H    LEU   9           H        LEU   9 -16.298  60.798  10.686
   60    HA   LEU   9           HA       LEU   9 -15.865  60.225   7.966
   61   1HB   LEU   9          2HB       LEU   9 -14.232  60.301  10.431
   62   2HB   LEU   9          1HB       LEU   9 -13.597  59.308   9.135
   63    HG   LEU   9           HG       LEU   9 -12.572  61.419   8.901
   64   1HD1  LEU   9          1HD1      LEU   9 -14.855  61.150   6.961
   65   2HD1  LEU   9          2HD1      LEU   9 -13.201  60.569   6.775
   66   3HD1  LEU   9          3HD1      LEU   9 -13.534  62.301   6.765
   67   1HD2  LEU   9          1HD2      LEU   9 -13.558  63.112   9.975
   68   2HD2  LEU   9          2HD2      LEU   9 -15.165  62.411   9.795
   69   3HD2  LEU   9          3HD2      LEU   9 -14.462  63.356   8.482
   70    H    ASP  10           H        ASP  10 -16.054  58.186  10.823
   71    HA   ASP  10           HA       ASP  10 -15.286  55.745   9.705
   72   1HB   ASP  10          2HB       ASP  10 -16.957  54.839  11.547
   73   2HB   ASP  10          1HB       ASP  10 -15.431  55.593  11.995
   74    H    ASP  11           H        ASP  11 -18.510  57.199   9.990
   75    HA   ASP  11           HA       ASP  11 -19.941  55.093   8.822
   76   1HB   ASP  11          2HB       ASP  11 -20.825  57.190  10.057
   77   2HB   ASP  11          1HB       ASP  11 -20.763  57.963   8.474
   78    H    ILE  12           H        ILE  12 -18.288  57.852   7.385
   79    HA   ILE  12           HA       ILE  12 -19.121  57.436   4.724
   80    HB   ILE  12           HB       ILE  12 -16.488  58.548   5.692
   81   1HG1  ILE  12          2HG1      ILE  12 -18.811  60.181   4.712
   82   2HG1  ILE  12          1HG1      ILE  12 -18.758  59.640   6.387
   83   1HG2  ILE  12          1HG2      ILE  12 -17.241  57.810   3.112
   84   2HG2  ILE  12          2HG2      ILE  12 -15.904  58.879   3.564
   85   3HG2  ILE  12          3HG2      ILE  12 -17.481  59.562   3.165
   86   1HD1  ILE  12          1HD1      ILE  12 -16.995  60.992   6.909
   87   2HD1  ILE  12          2HD1      ILE  12 -17.814  61.972   5.693
   88   3HD1  ILE  12          3HD1      ILE  12 -16.390  61.028   5.253
   89    H    ILE  13           H        ILE  13 -16.194  56.388   6.444
   90    HA   ILE  13           HA       ILE  13 -15.010  54.846   4.489
   91    HB   ILE  13           HB       ILE  13 -15.141  54.230   7.444
   92   1HG1  ILE  13          2HG1      ILE  13 -12.782  55.452   6.076
   93   2HG1  ILE  13          1HG1      ILE  13 -14.164  56.478   6.435
   94   1HG2  ILE  13          1HG2      ILE  13 -13.015  53.327   5.519
   95   2HG2  ILE  13          2HG2      ILE  13 -14.431  52.344   5.894
   96   3HG2  ILE  13          3HG2      ILE  13 -13.301  52.786   7.173
   97   1HD1  ILE  13          1HD1      ILE  13 -13.826  56.381   8.681
   98   2HD1  ILE  13          2HD1      ILE  13 -12.164  56.206   8.117
   99   3HD1  ILE  13          3HD1      ILE  13 -13.081  54.784   8.613
  100    H    LYS  14           H        LYS  14 -17.445  53.774   6.849
  101    HA   LYS  14           HA       LYS  14 -17.753  51.152   5.908
  102   1HB   LYS  14          2HB       LYS  14 -19.860  52.949   7.118
  103   2HB   LYS  14          1HB       LYS  14 -19.937  51.195   7.019
  104   1HG   LYS  14          2HG       LYS  14 -17.859  52.737   8.559
  105   2HG   LYS  14          1HG       LYS  14 -19.315  52.027   9.256
  106   1HD   LYS  14          2HD       LYS  14 -18.113  49.969   7.799
  107   2HD   LYS  14          1HD       LYS  14 -16.786  50.792   8.624
  108   1HE   LYS  14          2HE       LYS  14 -18.730  50.634  10.567
  109   2HE   LYS  14          1HE       LYS  14 -18.918  49.111   9.700
  110   1HZ   LYS  14          1HZ       LYS  14 -17.225  48.367  10.892
  111   2HZ   LYS  14          2HZ       LYS  14 -16.882  49.908  11.515
  112   3HZ   LYS  14          3HZ       LYS  14 -16.209  49.422  10.035
  113    H    LEU  15           H        LEU  15 -19.487  54.116   5.064
  114    HA   LEU  15           HA       LEU  15 -21.287  52.994   3.215
  115   1HB   LEU  15          2HB       LEU  15 -21.454  55.243   4.298
  116   2HB   LEU  15          1HB       LEU  15 -20.162  55.797   3.253
  117    HG   LEU  15           HG       LEU  15 -22.320  54.629   1.713
  118   1HD1  LEU  15          1HD1      LEU  15 -24.128  55.501   2.648
  119   2HD1  LEU  15          2HD1      LEU  15 -23.406  57.109   2.587
  120   3HD1  LEU  15          3HD1      LEU  15 -23.145  56.077   3.995
  121   1HD2  LEU  15          1HD2      LEU  15 -21.573  57.510   1.655
  122   2HD2  LEU  15          2HD2      LEU  15 -21.908  56.403   0.324
  123   3HD2  LEU  15          3HD2      LEU  15 -20.368  56.314   1.179
  124    H    ASN  16           H        ASN  16 -18.009  54.165   2.923
  125    HA   ASN  16           HA       ASN  16 -18.006  54.177   0.054
  126   1HB   ASN  16          2HB       ASN  16 -16.041  54.788   2.194
  127   2HB   ASN  16          1HB       ASN  16 -15.406  54.359   0.606
  128   1HD2  ASN  16          1HD2      ASN  16 -18.098  56.280   1.873
  129   2HD2  ASN  16          2HD2      ASN  16 -17.793  57.684   0.895
  130    H    ARG  17           H        ARG  17 -17.354  51.916   2.551
  131    HA   ARG  17           HA       ARG  17 -15.821  50.096   0.932
  132   1HB   ARG  17          2HB       ARG  17 -17.008  50.048   3.678
  133   2HB   ARG  17          1HB       ARG  17 -16.565  48.522   2.925
  134   1HG   ARG  17          2HG       ARG  17 -14.320  48.999   2.959
  135   2HG   ARG  17          1HG       ARG  17 -14.583  50.744   2.998
  136   1HD   ARG  17          2HD       ARG  17 -13.783  50.067   5.145
  137   2HD   ARG  17          1HD       ARG  17 -15.488  50.488   5.302
  138    HE   ARG  17           HE       ARG  17 -15.988  48.109   5.368
  139   1HH1  ARG  17          1HH1      ARG  17 -12.617  49.005   5.782
  140   2HH1  ARG  17          2HH1      ARG  17 -12.221  47.572   6.689
  141   1HH2  ARG  17          1HH2      ARG  17 -15.452  46.209   6.530
  142   2HH2  ARG  17          2HH2      ARG  17 -13.825  45.991   7.103
  143    H    ASN  18           H        ASN  18 -19.090  50.077   2.333
  144    HA   ASN  18           HA       ASN  18 -19.821  47.902   0.521
  145   1HB   ASN  18          2HB       ASN  18 -20.385  48.269   3.165
  146   2HB   ASN  18          1HB       ASN  18 -21.853  48.886   2.411
  147   1HD2  ASN  18          1HD2      ASN  18 -22.868  47.062   3.471
  148   2HD2  ASN  18          2HD2      ASN  18 -22.825  45.511   2.707
  149    H    GLN  19           H        GLN  19 -19.410  50.473  -0.594
  150    HA   GLN  19           HA       GLN  19 -21.971  51.660  -1.137
  151   1HB   GLN  19          2HB       GLN  19 -20.678  52.923  -2.898
  152   2HB   GLN  19          1HB       GLN  19 -20.087  53.116  -1.253
  153   1HG   GLN  19          2HG       GLN  19 -18.103  52.240  -1.747
  154   2HG   GLN  19          1HG       GLN  19 -18.816  50.912  -2.660
  155   1HE2  GLN  19          1HE2      GLN  19 -18.600  54.446  -2.998
  156   2HE2  GLN  19          2HE2      GLN  19 -18.072  54.417  -4.651
  157    H    ARG  20           H        ARG  20 -20.522  48.864  -2.094
  158    HA   ARG  20           HA       ARG  20 -21.627  48.860  -4.795
  159   1HB   ARG  20          2HB       ARG  20 -20.143  46.604  -3.449
  160   2HB   ARG  20          1HB       ARG  20 -20.384  46.863  -5.170
  161   1HG   ARG  20          2HG       ARG  20 -18.369  47.783  -5.208
  162   2HG   ARG  20          1HG       ARG  20 -19.059  49.143  -4.318
  163   1HD   ARG  20          2HD       ARG  20 -17.247  48.524  -3.006
  164   2HD   ARG  20          1HD       ARG  20 -18.600  47.712  -2.221
  165    HE   ARG  20           HE       ARG  20 -17.321  46.056  -4.172
  166   1HH1  ARG  20          1HH1      ARG  20 -17.063  47.233  -0.876
  167   2HH1  ARG  20          2HH1      ARG  20 -16.148  45.861  -0.323
  168   1HH2  ARG  20          1HH2      ARG  20 -16.115  44.253  -3.446
  169   2HH2  ARG  20          2HH2      ARG  20 -15.611  44.170  -1.784
  170    H    ARG  21           H        ARG  21 -23.819  49.015  -3.854
  171    HA   ARG  21           HA       ARG  21 -24.838  46.840  -2.296
  172   1HB   ARG  21          2HB       ARG  21 -25.961  49.282  -3.558
  173   2HB   ARG  21          1HB       ARG  21 -27.082  47.969  -3.229
  174   1HG   ARG  21          2HG       ARG  21 -27.272  48.997  -1.241
  175   2HG   ARG  21          1HG       ARG  21 -25.809  48.083  -0.867
  176   1HD   ARG  21          2HD       ARG  21 -25.829  50.590  -0.332
  177   2HD   ARG  21          1HD       ARG  21 -24.429  49.937  -1.181
  178    HE   ARG  21           HE       ARG  21 -25.365  50.859  -3.241
  179   1HH1  ARG  21          1HH1      ARG  21 -26.650  52.059  -0.204
  180   2HH1  ARG  21          2HH1      ARG  21 -27.188  53.565  -0.890
  181   1HH2  ARG  21          1HH2      ARG  21 -26.111  52.815  -4.144
  182   2HH2  ARG  21          2HH2      ARG  21 -26.908  53.982  -3.132
  183    H    VAL  22           H        VAL  22 -24.073  47.187  -5.523
  184    HA   VAL  22           HA       VAL  22 -26.054  45.488  -6.677
  185    HB   VAL  22           HB       VAL  22 -23.325  45.718  -7.873
  186   1HG1  VAL  22          1HG1      VAL  22 -25.926  46.104  -9.285
  187   2HG1  VAL  22          2HG1      VAL  22 -25.425  44.483  -8.800
  188   3HG1  VAL  22          3HG1      VAL  22 -24.409  45.434  -9.886
  189   1HG2  VAL  22          1HG2      VAL  22 -25.005  47.983  -7.158
  190   2HG2  VAL  22          2HG2      VAL  22 -24.659  47.908  -8.885
  191   3HG2  VAL  22          3HG2      VAL  22 -23.334  47.946  -7.721
  192    H    ASN  23           H        ASN  23 -23.275  44.960  -4.748
  193    HA   ASN  23           HA       ASN  23 -22.790  42.281  -5.670
  194   1HB   ASN  23          2HB       ASN  23 -21.111  43.839  -4.450
  195   2HB   ASN  23          1HB       ASN  23 -21.919  43.303  -2.977
  196   1HD2  ASN  23          1HD2      ASN  23 -21.447  41.341  -2.150
  197   2HD2  ASN  23          2HD2      ASN  23 -20.363  40.206  -2.887
  198    H    ARG  24           H        ARG  24 -24.587  41.096  -5.545
  199    HA   ARG  24           HA       ARG  24 -26.229  41.054  -3.170
  200   1HB   ARG  24          2HB       ARG  24 -26.355  39.145  -5.507
  201   2HB   ARG  24          1HB       ARG  24 -27.635  39.534  -4.366
  202   1HG   ARG  24          2HG       ARG  24 -28.382  40.990  -5.864
  203   2HG   ARG  24          1HG       ARG  24 -26.966  41.978  -5.493
  204   1HD   ARG  24          2HD       ARG  24 -25.709  40.785  -7.245
  205   2HD   ARG  24          1HD       ARG  24 -27.164  39.870  -7.643
  206    HE   ARG  24           HE       ARG  24 -27.800  42.584  -7.791
  207   1HH1  ARG  24          1HH1      ARG  24 -25.690  40.301  -9.409
  208   2HH1  ARG  24          2HH1      ARG  24 -25.755  41.125 -10.936
  209   1HH2  ARG  24          1HH2      ARG  24 -27.889  43.677  -9.791
  210   2HH2  ARG  24          2HH2      ARG  24 -27.005  43.053 -11.153
  211    H    GLY  25           H        GLY  25 -23.659  39.211  -4.607
  212   1HA   GLY  25          2HA       GLY  25 -22.237  37.706  -3.548
  213   2HA   GLY  25          1HA       GLY  25 -23.290  37.739  -2.139
  214    H    GLY  26           H        GLY  26 -25.427  36.645  -2.423
  215   1HA   GLY  26          2HA       GLY  26 -26.747  34.888  -3.171
  216   2HA   GLY  26          1HA       GLY  26 -25.589  34.606  -4.464
  217    H    GLY  27           H        GLY  27 -25.021  34.724  -0.977
  218   1HA   GLY  27          2HA       GLY  27 -23.452  32.394  -0.882
  219   2HA   GLY  27          1HA       GLY  27 -24.251  33.140   0.498
  220    HA   PRO  28           HA       PRO  28 -27.706  30.200   0.682
  221   1HB   PRO  28          2HB       PRO  28 -29.576  31.589  -1.007
  222   2HB   PRO  28          1HB       PRO  28 -29.614  31.401   0.747
  223   1HG   PRO  28          2HG       PRO  28 -28.685  33.664  -0.876
  224   2HG   PRO  28          1HG       PRO  28 -29.174  33.625   0.824
  225   1HD   PRO  28          2HD       PRO  28 -26.608  33.956   0.051
  226   2HD   PRO  28          1HD       PRO  28 -27.049  33.116   1.552
  227    H    ARG  29           H        ARG  29 -27.121  31.672  -2.475
  228    HA   ARG  29           HA       ARG  29 -26.677  30.797  -4.512
  229   1HB   ARG  29          2HB       ARG  29 -26.455  28.344  -2.831
  230   2HB   ARG  29          1HB       ARG  29 -26.520  28.163  -4.579
  231   1HG   ARG  29          2HG       ARG  29 -24.482  29.142  -4.897
  232   2HG   ARG  29          1HG       ARG  29 -24.606  30.129  -3.439
  233   1HD   ARG  29          2HD       ARG  29 -24.595  27.622  -2.390
  234   2HD   ARG  29          1HD       ARG  29 -23.562  27.407  -3.803
  235    HE   ARG  29           HE       ARG  29 -22.341  29.462  -2.841
  236   1HH1  ARG  29          1HH1      ARG  29 -23.912  26.990  -0.925
  237   2HH1  ARG  29          2HH1      ARG  29 -22.847  27.172   0.434
  238   1HH2  ARG  29          1HH2      ARG  29 -20.938  29.718  -1.063
  239   2HH2  ARG  29          2HH2      ARG  29 -21.151  28.741   0.360
  240    H    ARG  30           H        ARG  30 -29.079  28.778  -2.829
  241    HA   ARG  30           HA       ARG  30 -31.128  28.006  -3.430
  242   1HB   ARG  30          2HB       ARG  30 -31.032  30.439  -5.220
  243   2HB   ARG  30          1HB       ARG  30 -32.456  29.426  -5.038
  244   1HG   ARG  30          2HG       ARG  30 -32.965  30.275  -3.020
  245   2HG   ARG  30          1HG       ARG  30 -31.274  30.403  -2.530
  246   1HD   ARG  30          2HD       ARG  30 -31.825  32.619  -2.716
  247   2HD   ARG  30          1HD       ARG  30 -31.220  32.298  -4.341
  248    HE   ARG  30           HE       ARG  30 -34.095  32.325  -3.652
  249   1HH1  ARG  30          1HH1      ARG  30 -31.440  33.058  -5.829
  250   2HH1  ARG  30          2HH1      ARG  30 -32.461  33.806  -7.020
  251   1HH2  ARG  30          1HH2      ARG  30 -35.432  33.322  -5.233
  252   2HH2  ARG  30          2HH2      ARG  30 -34.712  33.978  -6.676
  253    H    ASN  31           H        ASN  31 -28.958  26.768  -4.628
  254    HA   ASN  31           HA       ASN  31 -30.089  26.006  -7.228
  255   1HB   ASN  31          2HB       ASN  31 -28.041  26.040  -8.300
  256   2HB   ASN  31          1HB       ASN  31 -27.851  27.401  -7.203
  257   1HD2  ASN  31          1HD2      ASN  31 -26.462  24.612  -8.338
  258   2HD2  ASN  31          2HD2      ASN  31 -25.288  24.363  -7.090
  259    H    ARG  32           H        ARG  32 -29.643  23.809  -7.866
  260    HA   ARG  32           HA       ARG  32 -29.528  22.046  -5.535
  261   1HB   ARG  32          2HB       ARG  32 -30.073  21.091  -8.322
  262   2HB   ARG  32          1HB       ARG  32 -30.658  20.446  -6.794
  263   1HG   ARG  32          2HG       ARG  32 -31.515  23.135  -7.806
  264   2HG   ARG  32          1HG       ARG  32 -32.329  21.646  -8.290
  265   1HD   ARG  32          2HD       ARG  32 -31.887  22.329  -5.403
  266   2HD   ARG  32          1HD       ARG  32 -33.274  22.953  -6.293
  267    HE   ARG  32           HE       ARG  32 -33.135  20.166  -6.655
  268   1HH1  ARG  32          1HH1      ARG  32 -33.904  22.566  -4.221
  269   2HH1  ARG  32          2HH1      ARG  32 -34.923  21.495  -3.298
  270   1HH2  ARG  32          1HH2      ARG  32 -34.497  18.752  -5.455
  271   2HH2  ARG  32          2HH2      ARG  32 -35.242  19.327  -3.990
  272    HA   PRO  33           HA       PRO  33 -25.271  20.975  -6.266
  273   1HB   PRO  33          2HB       PRO  33 -26.165  18.402  -5.059
  274   2HB   PRO  33          1HB       PRO  33 -24.802  19.438  -4.620
  275   1HG   PRO  33          2HG       PRO  33 -27.003  19.386  -3.122
  276   2HG   PRO  33          1HG       PRO  33 -26.138  20.906  -3.415
  277   1HD   PRO  33          2HD       PRO  33 -28.680  19.908  -4.621
  278   2HD   PRO  33          1HD       PRO  33 -28.217  21.562  -4.168
  279    H    ALA  34           H        ALA  34 -27.834  18.601  -6.899
  280    HA   ALA  34           HA       ALA  34 -28.164  17.068  -8.541
  281   1HB   ALA  34          1HB       ALA  34 -26.842  17.931 -10.777
  282   2HB   ALA  34          2HB       ALA  34 -27.045  19.424  -9.861
  283   3HB   ALA  34          3HB       ALA  34 -28.454  18.448 -10.280
  284    H    ILE  35           H        ILE  35 -26.626  15.851  -7.040
  285    HA   ILE  35           HA       ILE  35 -24.171  15.115  -8.491
  286    HB   ILE  35           HB       ILE  35 -23.796  16.180  -6.277
  287   1HG1  ILE  35          2HG1      ILE  35 -22.728  13.686  -5.470
  288   2HG1  ILE  35          1HG1      ILE  35 -22.722  13.697  -7.231
  289   1HG2  ILE  35          1HG2      ILE  35 -25.919  15.100  -5.310
  290   2HG2  ILE  35          2HG2      ILE  35 -24.511  15.280  -4.262
  291   3HG2  ILE  35          3HG2      ILE  35 -24.882  13.711  -4.979
  292   1HD1  ILE  35          1HD1      ILE  35 -21.477  15.761  -5.429
  293   2HD1  ILE  35          2HD1      ILE  35 -21.504  15.827  -7.192
  294   3HD1  ILE  35          3HD1      ILE  35 -20.629  14.534  -6.371
  295    H    ALA  36           H        ALA  36 -27.188  14.052  -7.292
  296    HA   ALA  36           HA       ALA  36 -26.473  11.240  -7.326
  297   1HB   ALA  36          1HB       ALA  36 -28.742  10.807  -6.659
  298   2HB   ALA  36          2HB       ALA  36 -29.200  12.479  -6.992
  299   3HB   ALA  36          3HB       ALA  36 -28.090  12.114  -5.668
  300    H    ARG  37           H        ARG  37 -26.344  10.182  -9.133
  301    HA   ARG  37           HA       ARG  37 -27.281  11.105 -11.626
  302   1HB   ARG  37          2HB       ARG  37 -26.220   9.273 -12.526
  303   2HB   ARG  37          1HB       ARG  37 -25.387   9.395 -10.984
  304   1HG   ARG  37          2HG       ARG  37 -27.752   7.593 -11.421
  305   2HG   ARG  37          1HG       ARG  37 -26.088   7.082 -11.702
  306   1HD   ARG  37          2HD       ARG  37 -26.594   8.364  -9.097
  307   2HD   ARG  37          1HD       ARG  37 -27.396   6.813  -9.345
  308    HE   ARG  37           HE       ARG  37 -24.535   7.297  -9.139
  309   1HH1  ARG  37          1HH1      ARG  37 -27.109   5.035  -9.888
  310   2HH1  ARG  37          2HH1      ARG  37 -26.089   3.633  -9.724
  311   1HH2  ARG  37          1HH2      ARG  37 -23.212   5.471  -8.893
  312   2HH2  ARG  37          2HH2      ARG  37 -23.885   3.876  -9.108
  313    H    GLY  38           H        GLY  38 -28.767   9.984 -13.064
  314   1HA   GLY  38          2HA       GLY  38 -30.715   8.172 -11.931
  315   2HA   GLY  38          1HA       GLY  38 -31.349   9.772 -12.291
  316    H    GLY  39           H        GLY  39 -32.604   9.457 -14.035
  317   1HA   GLY  39          2HA       GLY  39 -33.069   9.245 -16.275
  318   2HA   GLY  39          1HA       GLY  39 -31.342   9.091 -16.561
  319    H    ARG  40           H        ARG  40 -30.830   7.283 -17.549
  320    HA   ARG  40           HA       ARG  40 -32.446   4.876 -17.020
  321   1HB   ARG  40          2HB       ARG  40 -30.601   4.863 -19.330
  322   2HB   ARG  40          1HB       ARG  40 -32.239   4.244 -19.196
  323   1HG   ARG  40          2HG       ARG  40 -31.996   7.173 -19.162
  324   2HG   ARG  40          1HG       ARG  40 -31.535   6.382 -20.672
  325   1HD   ARG  40          2HD       ARG  40 -33.743   6.545 -21.108
  326   2HD   ARG  40          1HD       ARG  40 -33.822   5.072 -20.140
  327    HE   ARG  40           HE       ARG  40 -34.337   7.776 -19.064
  328   1HH1  ARG  40          1HH1      ARG  40 -35.065   4.350 -19.245
  329   2HH1  ARG  40          2HH1      ARG  40 -36.267   4.411 -17.985
  330   1HH2  ARG  40          1HH2      ARG  40 -35.935   7.875 -17.467
  331   2HH2  ARG  40          2HH2      ARG  40 -36.794   6.430 -17.004
  332    H    ASN  41           H        ASN  41 -30.520   5.557 -15.154
  333    HA   ASN  41           HA       ASN  41 -28.117   4.063 -15.745
  334   1HB   ASN  41          2HB       ASN  41 -28.302   6.174 -14.238
  335   2HB   ASN  41          1HB       ASN  41 -28.859   5.049 -13.004
  336   1HD2  ASN  41          1HD2      ASN  41 -27.427   3.457 -12.237
  337   2HD2  ASN  41          2HD2      ASN  41 -25.718   3.620 -12.428
  338    H    ARG  42           H        ARG  42 -29.443   2.181 -16.246
  339    HA   ARG  42           HA       ARG  42 -29.495   0.401 -13.976
  340   1HB   ARG  42          2HB       ARG  42 -31.696   1.180 -13.726
  341   2HB   ARG  42          1HB       ARG  42 -31.964   1.229 -15.461
  342   1HG   ARG  42          2HG       ARG  42 -33.217  -0.598 -14.650
  343   2HG   ARG  42          1HG       ARG  42 -31.791  -1.299 -15.422
  344   1HD   ARG  42          2HD       ARG  42 -30.775  -1.770 -13.356
  345   2HD   ARG  42          1HD       ARG  42 -31.877  -0.709 -12.480
  346    HE   ARG  42           HE       ARG  42 -33.609  -2.474 -13.334
  347   1HH1  ARG  42          1HH1      ARG  42 -30.354  -3.076 -12.184
  348   2HH1  ARG  42          2HH1      ARG  42 -30.742  -4.642 -11.526
  349   1HH2  ARG  42          1HH2      ARG  42 -34.116  -4.536 -12.484
  350   2HH2  ARG  42          2HH2      ARG  42 -32.886  -5.453 -11.669
  351    HA   PRO  43           HA       PRO  43 -29.762  -2.106 -18.134
  352   1HB   PRO  43          2HB       PRO  43 -29.655  -0.639 -20.437
  353   2HB   PRO  43          1HB       PRO  43 -31.165  -1.196 -19.709
  354   1HG   PRO  43          2HG       PRO  43 -29.852   1.488 -19.531
  355   2HG   PRO  43          1HG       PRO  43 -31.566   1.091 -19.765
  356   1HD   PRO  43          2HD       PRO  43 -30.589   1.835 -17.370
  357   2HD   PRO  43          1HD       PRO  43 -31.899   0.646 -17.523
  358    H    ALA  44           H        ALA  44 -28.034   0.816 -17.643
  359    HA   ALA  44           HA       ALA  44 -25.586  -0.339 -18.781
  360   1HB   ALA  44          1HB       ALA  44 -25.036   2.277 -18.015
  361   2HB   ALA  44          2HB       ALA  44 -26.666   2.347 -18.686
  362   3HB   ALA  44          3HB       ALA  44 -25.341   1.700 -19.654
  363    HA   PRO  45           HA       PRO  45 -24.527  -1.342 -14.486
  364   1HB   PRO  45          2HB       PRO  45 -21.920  -1.675 -15.902
  365   2HB   PRO  45          1HB       PRO  45 -22.718  -2.755 -14.750
  366   1HG   PRO  45          2HG       PRO  45 -22.733  -3.314 -17.345
  367   2HG   PRO  45          1HG       PRO  45 -24.177  -3.594 -16.354
  368   1HD   PRO  45          2HD       PRO  45 -23.611  -1.412 -18.310
  369   2HD   PRO  45          1HD       PRO  45 -25.139  -2.243 -17.955
  370    H    TYR  46           H        TYR  46 -22.832   0.796 -16.682
  371    HA   TYR  46           HA       TYR  46 -22.460   2.745 -14.612
  372   1HB   TYR  46          2HB       TYR  46 -20.403   0.942 -14.903
  373   2HB   TYR  46          1HB       TYR  46 -19.887   2.250 -15.958
  374    HD1  TYR  46           1HD      TYR  46 -18.768   1.178 -13.197
  375    HD2  TYR  46           2HD      TYR  46 -21.131   4.525 -14.342
  376    HE1  TYR  46           1HE      TYR  46 -17.949   2.419 -11.240
  377    HE2  TYR  46           2HE      TYR  46 -20.317   5.775 -12.388
  378    HH   TYR  46           HH       TYR  46 -18.955   5.781 -10.634
  379    H    SER  47           H        SER  47 -20.216   3.852 -16.470
  380    HA   SER  47           HA       SER  47 -21.751   5.571 -18.006
  381   1HB   SER  47          2HB       SER  47 -18.949   4.703 -18.715
  382   2HB   SER  47          1HB       SER  47 -19.710   6.267 -19.014
  383    HG   SER  47           HG       SER  47 -19.328   6.859 -17.017
  384    H    ARG  48           H        ARG  48 -20.285   2.465 -18.891
  385    HA   ARG  48           HA       ARG  48 -22.099   2.387 -21.198
  386   1HB   ARG  48          2HB       ARG  48 -19.803   3.052 -21.945
  387   2HB   ARG  48          1HB       ARG  48 -19.207   1.518 -21.325
  388   1HG   ARG  48          2HG       ARG  48 -20.131   0.312 -23.019
  389   2HG   ARG  48          1HG       ARG  48 -21.467   1.444 -23.245
  390   1HD   ARG  48          2HD       ARG  48 -18.628   2.135 -23.945
  391   2HD   ARG  48          1HD       ARG  48 -19.712   1.338 -25.083
  392    HE   ARG  48           HE       ARG  48 -20.900   3.684 -23.993
  393   1HH1  ARG  48          1HH1      ARG  48 -18.568   2.562 -26.353
  394   2HH1  ARG  48          2HH1      ARG  48 -18.707   3.981 -27.357
  395   1HH2  ARG  48          1HH2      ARG  48 -21.097   5.549 -25.320
  396   2HH2  ARG  48          2HH2      ARG  48 -20.173   5.651 -26.790
  397    HA   PRO  49           HA       PRO  49 -23.033  -1.691 -19.563
  398   1HB   PRO  49          2HB       PRO  49 -23.938  -2.133 -22.350
  399   2HB   PRO  49          1HB       PRO  49 -24.817  -2.352 -20.836
  400   1HG   PRO  49          2HG       PRO  49 -25.335  -0.296 -22.470
  401   2HG   PRO  49          1HG       PRO  49 -25.420  -0.131 -20.708
  402   1HD   PRO  49          2HD       PRO  49 -23.313   0.803 -22.602
  403   2HD   PRO  49          1HD       PRO  49 -23.916   1.560 -21.113
  404    H    LYS  50           H        LYS  50 -21.302  -2.960 -19.316
  405    HA   LYS  50           HA       LYS  50 -19.619  -3.605 -21.610
  406   1HB   LYS  50          2HB       LYS  50 -19.012  -4.757 -18.947
  407   2HB   LYS  50          1HB       LYS  50 -17.931  -4.045 -20.134
  408   1HG   LYS  50          2HG       LYS  50 -19.743  -2.120 -18.891
  409   2HG   LYS  50          1HG       LYS  50 -18.646  -2.914 -17.758
  410   1HD   LYS  50          2HD       LYS  50 -17.716  -1.654 -20.329
  411   2HD   LYS  50          1HD       LYS  50 -17.805  -0.770 -18.804
  412   1HE   LYS  50          2HE       LYS  50 -16.106  -2.002 -17.839
  413   2HE   LYS  50          1HE       LYS  50 -16.351  -3.378 -18.918
  414   1HZ   LYS  50          1HZ       LYS  50 -14.406  -2.425 -19.687
  415   2HZ   LYS  50          2HZ       LYS  50 -14.948  -0.836 -19.450
  416   3HZ   LYS  50          3HZ       LYS  50 -15.567  -1.757 -20.730
  417    HA   PRO  51           HA       PRO  51 -21.299  -7.697 -22.141
  418   1HB   PRO  51          2HB       PRO  51 -18.526  -8.643 -22.542
  419   2HB   PRO  51          1HB       PRO  51 -19.902  -8.696 -23.649
  420   1HG   PRO  51          2HG       PRO  51 -17.880  -7.002 -24.054
  421   2HG   PRO  51          1HG       PRO  51 -19.555  -6.532 -24.398
  422   1HD   PRO  51          2HD       PRO  51 -17.844  -5.849 -22.032
  423   2HD   PRO  51          1HD       PRO  51 -18.945  -4.808 -22.962
  424    H    LEU  52           H        LEU  52 -19.112  -6.833 -19.748
  425    HA   LEU  52           HA       LEU  52 -19.501  -9.368 -18.318
  426   1HB   LEU  52          2HB       LEU  52 -17.527  -7.194 -17.631
  427   2HB   LEU  52          1HB       LEU  52 -17.595  -8.821 -16.975
  428    HG   LEU  52           HG       LEU  52 -17.292  -9.258 -19.679
  429   1HD1  LEU  52          1HD1      LEU  52 -15.016  -7.605 -19.534
  430   2HD1  LEU  52          2HD1      LEU  52 -16.400  -6.594 -19.118
  431   3HD1  LEU  52          3HD1      LEU  52 -16.380  -7.478 -20.645
  432   1HD2  LEU  52          1HD2      LEU  52 -14.843  -9.037 -18.027
  433   2HD2  LEU  52          2HD2      LEU  52 -15.420 -10.366 -19.034
  434   3HD2  LEU  52          3HD2      LEU  52 -16.124 -10.099 -17.439
  435    HA   PRO  53           HA       PRO  53 -22.334  -6.463 -16.264
  436   1HB   PRO  53          2HB       PRO  53 -24.301  -8.227 -15.796
  437   2HB   PRO  53          1HB       PRO  53 -24.001  -7.609 -17.416
  438   1HG   PRO  53          2HG       PRO  53 -23.125 -10.210 -16.210
  439   2HG   PRO  53          1HG       PRO  53 -23.882  -9.909 -17.788
  440   1HD   PRO  53          2HD       PRO  53 -21.183 -10.206 -17.453
  441   2HD   PRO  53          1HD       PRO  53 -21.910  -9.232 -18.746
  442    H    ASP  54           H        ASP  54 -23.803  -8.418 -14.210
  443    HA   ASP  54           HA       ASP  54 -21.951  -7.880 -12.079
  444   1HB   ASP  54          2HB       ASP  54 -24.588  -7.845 -12.080
  445   2HB   ASP  54          1HB       ASP  54 -24.402  -9.554 -11.697
  446    H    LYS  55           H        LYS  55 -20.597  -9.465 -13.688
  447    HA   LYS  55           HA       LYS  55 -20.462 -12.009 -12.234
  448   1HB   LYS  55          2HB       LYS  55 -21.252 -11.707 -14.940
  449   2HB   LYS  55          1HB       LYS  55 -19.637 -12.404 -14.950
  450   1HG   LYS  55          2HG       LYS  55 -22.092 -13.504 -13.605
  451   2HG   LYS  55          1HG       LYS  55 -21.214 -14.189 -14.974
  452   1HD   LYS  55          2HD       LYS  55 -19.237 -14.469 -13.497
  453   2HD   LYS  55          1HD       LYS  55 -20.213 -13.904 -12.141
  454   1HE   LYS  55          2HE       LYS  55 -20.640 -16.385 -13.798
  455   2HE   LYS  55          1HE       LYS  55 -20.164 -16.301 -12.102
  456   1HZ   LYS  55          1HZ       LYS  55 -22.383 -16.691 -11.895
  457   2HZ   LYS  55          2HZ       LYS  55 -22.795 -15.873 -13.322
  458   3HZ   LYS  55          3HZ       LYS  55 -22.413 -14.996 -11.921
  459    H    TRP  56           H        TRP  56 -18.616 -11.737 -11.149
  460    HA   TRP  56           HA       TRP  56 -16.348 -10.363 -12.189
  461   1HB   TRP  56          2HB       TRP  56 -17.154 -11.501  -9.694
  462   2HB   TRP  56          1HB       TRP  56 -15.556 -12.119 -10.102
  463    HD1  TRP  56           HD       TRP  56 -17.243  -9.190  -8.618
  464    HE1  TRP  56           1HE      TRP  56 -15.560  -7.278  -8.227
  465    HE3  TRP  56           3HE      TRP  56 -13.325 -10.985 -11.368
  466    HZ2  TRP  56           2HZ      TRP  56 -12.922  -6.622  -8.997
  467    HZ3  TRP  56           3HZ      TRP  56 -11.260  -9.656 -11.491
  468    HH2  TRP  56           HH       TRP  56 -11.065  -7.518 -10.330
  469    H    GLN  57           H        GLN  57 -14.277 -11.273 -12.581
  470    HA   GLN  57           HA       GLN  57 -14.353 -13.998 -13.686
  471   1HB   GLN  57          2HB       GLN  57 -12.260 -11.910 -14.287
  472   2HB   GLN  57          1HB       GLN  57 -12.641 -13.360 -15.203
  473   1HG   GLN  57          2HG       GLN  57 -14.510 -11.022 -14.909
  474   2HG   GLN  57          1HG       GLN  57 -13.389 -11.231 -16.255
  475   1HE2  GLN  57          1HE2      GLN  57 -16.484 -11.771 -15.200
  476   2HE2  GLN  57          2HE2      GLN  57 -16.945 -13.000 -16.327
  477    H    HIS  58           H        HIS  58 -11.540 -14.359 -13.786
  478    HA   HIS  58           HA       HIS  58 -10.920 -15.149 -11.153
  479   1HB   HIS  58          2HB       HIS  58  -9.872 -15.880 -13.437
  480   2HB   HIS  58          1HB       HIS  58  -8.775 -14.533 -13.159
  481    HD1  HIS  58           1HD      HIS  58  -8.518 -15.017 -10.012
  482    HD2  HIS  58           2HD      HIS  58  -8.034 -17.873 -12.998
  483    HE1  HIS  58           1HE      HIS  58  -7.070 -16.804  -9.011
  484    HE2  HIS  58           2HE      HIS  58  -6.963 -18.612 -10.761
  485    H    ASP  59           H        ASP  59  -9.443 -12.548 -13.085
  486    HA   ASP  59           HA       ASP  59  -9.564 -10.663 -10.953
  487   1HB   ASP  59          2HB       ASP  59  -7.225 -12.366 -11.112
  488   2HB   ASP  59          1HB       ASP  59  -6.789 -10.679 -11.358
  489    H    LEU  60           H        LEU  60  -8.076 -11.657 -13.978
  490    HA   LEU  60           HA       LEU  60  -7.851 -10.638 -15.985
  491   1HB   LEU  60          2HB       LEU  60 -10.017  -9.213 -14.770
  492   2HB   LEU  60          1HB       LEU  60  -9.014  -8.078 -15.652
  493    HG   LEU  60           HG       LEU  60  -9.289  -9.367 -17.700
  494   1HD1  LEU  60          1HD1      LEU  60 -10.217 -11.424 -17.849
  495   2HD1  LEU  60          2HD1      LEU  60 -11.361 -11.124 -16.541
  496   3HD1  LEU  60          3HD1      LEU  60  -9.685 -11.528 -16.171
  497   1HD2  LEU  60          1HD2      LEU  60 -12.061  -9.330 -17.302
  498   2HD2  LEU  60          2HD2      LEU  60 -11.055  -8.056 -17.991
  499   3HD2  LEU  60          3HD2      LEU  60 -11.405  -8.065 -16.263
  500    H    PHE  61           H        PHE  61  -7.903  -7.673 -14.040
  501    HA   PHE  61           HA       PHE  61  -5.159  -7.135 -14.909
  502   1HB   PHE  61          2HB       PHE  61  -7.474  -5.493 -14.242
  503   2HB   PHE  61          1HB       PHE  61  -6.013  -4.947 -13.424
  504    HD1  PHE  61           1HD      PHE  61  -6.828  -6.280 -16.816
  505    HD2  PHE  61           2HD      PHE  61  -4.963  -3.231 -14.507
  506    HE1  PHE  61           1HE      PHE  61  -6.086  -5.175 -18.884
  507    HE2  PHE  61           2HE      PHE  61  -4.218  -2.119 -16.571
  508    HZ   PHE  61           HZ       PHE  61  -4.781  -3.091 -18.763
  509    H    ASP  62           H        ASP  62  -6.793  -8.490 -12.418
  510    HA   ASP  62           HA       ASP  62  -6.176  -9.379 -10.445
  511   1HB   ASP  62          2HB       ASP  62  -3.530  -8.467 -11.421
  512   2HB   ASP  62          1HB       ASP  62  -3.692  -8.703  -9.686
  513    H    SER  63           H        SER  63  -6.644  -8.787  -8.484
  514    HA   SER  63           HA       SER  63  -6.580  -5.953  -7.794
  515   1HB   SER  63          2HB       SER  63  -7.597  -8.041  -5.909
  516   2HB   SER  63          1HB       SER  63  -8.209  -6.416  -6.220
  517    HG   SER  63           HG       SER  63  -8.360  -8.447  -8.192
  518    H    GLY  64           H        GLY  64  -5.138  -9.019  -6.975
  519   1HA   GLY  64          2HA       GLY  64  -3.562  -7.910  -4.812
  520   2HA   GLY  64          1HA       GLY  64  -3.472  -9.550  -5.443
  521    H    CYS  65           H        CYS  65  -2.827  -9.336  -7.998
  522    HA   CYS  65           HA       CYS  65  -0.153  -8.210  -7.898
  523   1HB   CYS  65          2HB       CYS  65  -1.096  -9.550 -10.359
  524   2HB   CYS  65          1HB       CYS  65   0.425  -9.728  -9.490
  525    HG   CYS  65           HG       CYS  65  -2.502 -11.383  -9.053
  526    H    GLY  66           H        GLY  66  -2.027  -6.210  -7.926
  527   1HA   GLY  66          2HA       GLY  66  -1.167  -4.407  -9.721
  528   2HA   GLY  66          1HA       GLY  66  -2.377  -5.288 -10.643
  529    H    GLY  67           H        GLY  67  -2.840  -2.699 -10.356
  530   1HA   GLY  67          2HA       GLY  67  -5.119  -2.690  -8.493
  531   2HA   GLY  67          1HA       GLY  67  -4.021  -1.316  -8.543
  532    H    GLY  68           H        GLY  68  -4.643  -3.020 -11.458
  533   1HA   GLY  68          2HA       GLY  68  -5.831  -2.476 -13.352
  534   2HA   GLY  68          1HA       GLY  68  -6.829  -1.425 -12.358
  535    H    GLU  69           H        GLU  69  -6.723  -0.025 -14.282
  536    HA   GLU  69           HA       GLU  69  -4.242   1.344 -14.806
  537   1HB   GLU  69          2HB       GLU  69  -7.065   2.044 -15.628
  538   2HB   GLU  69          1HB       GLU  69  -5.592   2.741 -16.296
  539   1HG   GLU  69          2HG       GLU  69  -5.856   1.197 -17.886
  540   2HG   GLU  69          1HG       GLU  69  -5.143   0.103 -16.699
  541    H    GLY  70           H        GLY  70  -7.408   2.443 -13.600
  542   1HA   GLY  70          2HA       GLY  70  -6.026   4.048 -11.567
  543   2HA   GLY  70          1HA       GLY  70  -7.117   4.871 -12.677
  544    H    VAL  71           H        VAL  71  -8.016   1.686 -11.970
  545    HA   VAL  71           HA       VAL  71 -10.417   2.518 -10.687
  546    HB   VAL  71           HB       VAL  71 -10.790   0.024 -10.393
  547   1HG1  VAL  71          1HG1      VAL  71 -11.598   1.397 -12.324
  548   2HG1  VAL  71          2HG1      VAL  71 -11.361  -0.315 -12.682
  549   3HG1  VAL  71          3HG1      VAL  71 -10.167   0.873 -13.215
  550   1HG2  VAL  71          1HG2      VAL  71  -9.281  -1.531 -11.108
  551   2HG2  VAL  71          2HG2      VAL  71  -8.159  -0.267 -10.598
  552   3HG2  VAL  71          3HG2      VAL  71  -8.568  -0.448 -12.306
  553    H    GLU  72           H        GLU  72  -7.325   1.764  -9.609
  554    HA   GLU  72           HA       GLU  72  -8.112   1.955  -6.836
  555   1HB   GLU  72          2HB       GLU  72  -8.176  -0.527  -7.699
  556   2HB   GLU  72          1HB       GLU  72  -6.427  -0.414  -7.563
  557   1HG   GLU  72          2HG       GLU  72  -7.955   0.496  -5.222
  558   2HG   GLU  72          1HG       GLU  72  -8.037  -1.229  -5.584
  559    H    THR  73           H        THR  73  -5.697   1.708  -9.324
  560    HA   THR  73           HA       THR  73  -3.423   2.333  -7.762
  561    HB   THR  73           HB       THR  73  -2.777   3.133 -10.290
  562    HG1  THR  73           1HG      THR  73  -4.248   2.440 -11.640
  563   1HG2  THR  73          1HG2      THR  73  -1.791   0.974 -10.567
  564   2HG2  THR  73          2HG2      THR  73  -2.955   0.235  -9.466
  565   3HG2  THR  73          3HG2      THR  73  -1.734   1.346  -8.844
  566    H    GLY  74           H        GLY  74  -4.685   4.151  -6.604
  567   1HA   GLY  74          2HA       GLY  74  -4.899   6.655  -8.021
  568   2HA   GLY  74          1HA       GLY  74  -5.146   6.401  -6.299
  569    H    ALA  75           H        ALA  75  -3.003   5.790  -5.126
  570    HA   ALA  75           HA       ALA  75  -0.918   7.651  -6.076
  571   1HB   ALA  75          1HB       ALA  75  -0.427   8.217  -3.837
  572   2HB   ALA  75          2HB       ALA  75  -1.396   6.880  -3.209
  573   3HB   ALA  75          3HB       ALA  75  -2.185   8.265  -3.970
  574    H    LYS  76           H        LYS  76   0.957   6.740  -6.596
  575    HA   LYS  76           HA       LYS  76   1.442   3.966  -5.735
  576   1HB   LYS  76          2HB       LYS  76   1.104   4.186  -8.123
  577   2HB   LYS  76          1HB       LYS  76   2.298   5.472  -8.213
  578   1HG   LYS  76          2HG       LYS  76   4.067   3.916  -7.681
  579   2HG   LYS  76          1HG       LYS  76   2.890   2.616  -7.463
  580   1HD   LYS  76          2HD       LYS  76   2.255   3.498  -9.956
  581   2HD   LYS  76          1HD       LYS  76   3.998   3.775  -9.927
  582   1HE   LYS  76          2HE       LYS  76   2.585   1.171  -9.355
  583   2HE   LYS  76          1HE       LYS  76   3.497   1.568 -10.810
  584   1HZ   LYS  76          1HZ       LYS  76   4.880   0.271  -9.401
  585   2HZ   LYS  76          2HZ       LYS  76   4.550   1.248  -8.054
  586   3HZ   LYS  76          3HZ       LYS  76   5.470   1.860  -9.348
  587    H    LEU  77           H        LEU  77   2.747   4.296  -3.854
  588    HA   LEU  77           HA       LEU  77   5.170   5.797  -4.122
  589   1HB   LEU  77          2HB       LEU  77   3.915   5.901  -2.099
  590   2HB   LEU  77          1HB       LEU  77   3.734   4.172  -2.026
  591    HG   LEU  77           HG       LEU  77   5.124   5.100  -0.236
  592   1HD1  LEU  77          1HD1      LEU  77   6.471   3.333  -0.073
  593   2HD1  LEU  77          2HD1      LEU  77   7.072   3.480  -1.725
  594   3HD1  LEU  77          3HD1      LEU  77   5.480   2.780  -1.424
  595   1HD2  LEU  77          1HD2      LEU  77   6.406   6.486  -2.369
  596   2HD2  LEU  77          2HD2      LEU  77   7.594   5.505  -1.513
  597   3HD2  LEU  77          3HD2      LEU  77   6.616   6.676  -0.629
  598    H    LEU  78           H        LEU  78   7.224   4.730  -3.355
  599    HA   LEU  78           HA       LEU  78   7.513   1.953  -4.122
  600   1HB   LEU  78          2HB       LEU  78   8.914   4.212  -5.540
  601   2HB   LEU  78          1HB       LEU  78   9.568   2.585  -5.508
  602    HG   LEU  78           HG       LEU  78   6.813   3.194  -6.564
  603   1HD1  LEU  78          1HD1      LEU  78   8.357   2.682  -8.756
  604   2HD1  LEU  78          2HD1      LEU  78   9.424   3.687  -7.774
  605   3HD1  LEU  78          3HD1      LEU  78   7.827   4.280  -8.232
  606   1HD2  LEU  78          1HD2      LEU  78   6.690   1.024  -7.115
  607   2HD2  LEU  78          2HD2      LEU  78   7.941   0.820  -5.888
  608   3HD2  LEU  78          3HD2      LEU  78   8.387   0.943  -7.590
  609    H    VAL  79           H        VAL  79   9.533   1.079  -3.359
  610    HA   VAL  79           HA       VAL  79  10.948   2.682  -1.373
  611    HB   VAL  79           HB       VAL  79  10.731   0.889   0.367
  612   1HG1  VAL  79          1HG1      VAL  79   8.061   1.494   0.570
  613   2HG1  VAL  79          2HG1      VAL  79   8.711   2.832  -0.382
  614   3HG1  VAL  79          3HG1      VAL  79   9.396   2.459   1.200
  615   1HG2  VAL  79          1HG2      VAL  79   9.422  -0.440  -1.712
  616   2HG2  VAL  79          2HG2      VAL  79   8.206  -0.129  -0.470
  617   3HG2  VAL  79          3HG2      VAL  79   9.685  -0.999  -0.061
  618    H    SER  80           H        SER  80  13.013   1.898  -0.931
  619    HA   SER  80           HA       SER  80  13.890  -0.652  -1.880
  620   1HB   SER  80          2HB       SER  80  15.641   1.056  -3.296
  621   2HB   SER  80          1HB       SER  80  14.503  -0.108  -3.970
  622    HG   SER  80           HG       SER  80  14.452   2.500  -4.227
  623    H    ASN  81           H        ASN  81  16.339  -0.841  -1.558
  624    HA   ASN  81           HA       ASN  81  18.171  -0.653  -0.209
  625   1HB   ASN  81          2HB       ASN  81  17.798   1.802  -1.357
  626   2HB   ASN  81          1HB       ASN  81  17.811   2.218   0.351
  627   1HD2  ASN  81          1HD2      ASN  81  19.738   3.341  -0.872
  628   2HD2  ASN  81          2HD2      ASN  81  21.256   2.533  -0.670
  629    H    LEU  82           H        LEU  82  15.939  -1.508   1.068
  630    HA   LEU  82           HA       LEU  82  15.706   0.017   3.560
  631   1HB   LEU  82          2HB       LEU  82  13.823  -2.051   3.568
  632   2HB   LEU  82          1HB       LEU  82  13.524  -0.351   3.268
  633    HG   LEU  82           HG       LEU  82  14.150  -0.946   0.804
  634   1HD1  LEU  82          1HD1      LEU  82  14.918  -3.228   1.359
  635   2HD1  LEU  82          2HD1      LEU  82  13.632  -3.203   0.152
  636   3HD1  LEU  82          3HD1      LEU  82  13.266  -3.641   1.819
  637   1HD2  LEU  82          1HD2      LEU  82  11.562  -1.742   2.122
  638   2HD2  LEU  82          2HD2      LEU  82  11.789  -1.584   0.379
  639   3HD2  LEU  82          3HD2      LEU  82  11.970  -0.175   1.424
  640    H    ASP  83           H        ASP  83  14.613  -2.323   4.976
  641    HA   ASP  83           HA       ASP  83  17.084  -3.411   5.909
  642   1HB   ASP  83          2HB       ASP  83  15.095  -3.011   7.381
  643   2HB   ASP  83          1HB       ASP  83  14.288  -4.353   6.573
  644    H    PHE  84           H        PHE  84  17.578  -5.696   6.002
  645    HA   PHE  84           HA       PHE  84  17.213  -6.922   3.432
  646   1HB   PHE  84          2HB       PHE  84  18.584  -8.037   5.887
  647   2HB   PHE  84          1HB       PHE  84  18.768  -8.607   4.229
  648    HD1  PHE  84           1HD      PHE  84  19.494  -6.698   2.525
  649    HD2  PHE  84           2HD      PHE  84  20.212  -6.647   6.718
  650    HE1  PHE  84           1HE      PHE  84  21.341  -5.112   2.184
  651    HE2  PHE  84           2HE      PHE  84  22.064  -5.062   6.385
  652    HZ   PHE  84           HZ       PHE  84  22.631  -4.291   4.117
  653    H    GLY  85           H        GLY  85  15.652  -7.065   6.468
  654   1HA   GLY  85          2HA       GLY  85  14.395  -9.643   5.913
  655   2HA   GLY  85          1HA       GLY  85  14.171  -8.660   7.356
  656    H    VAL  86           H        VAL  86  13.993  -7.114   4.301
  657    HA   VAL  86           HA       VAL  86  11.516  -5.967   4.651
  658    HB   VAL  86           HB       VAL  86  13.027  -5.092   3.008
  659   1HG1  VAL  86          1HG1      VAL  86  13.181  -6.448   0.777
  660   2HG1  VAL  86          2HG1      VAL  86  12.849  -7.823   1.830
  661   3HG1  VAL  86          3HG1      VAL  86  14.261  -6.810   2.122
  662   1HG2  VAL  86          1HG2      VAL  86  10.294  -5.683   2.419
  663   2HG2  VAL  86          2HG2      VAL  86  11.227  -5.693   0.924
  664   3HG2  VAL  86          3HG2      VAL  86  11.249  -4.271   1.966
  665    H    SER  87           H        SER  87   9.443  -6.428   4.052
  666    HA   SER  87           HA       SER  87   8.814  -8.923   2.752
  667   1HB   SER  87          2HB       SER  87   7.389  -8.493   5.349
  668   2HB   SER  87          1HB       SER  87   7.668  -9.987   4.453
  669    HG   SER  87           HG       SER  87   9.927  -8.690   5.433
  670    H    ASP  88           H        ASP  88   6.777  -8.689   1.638
  671    HA   ASP  88           HA       ASP  88   5.567  -6.293   1.313
  672   1HB   ASP  88          2HB       ASP  88   3.781  -7.391   0.305
  673   2HB   ASP  88          1HB       ASP  88   5.070  -8.584   0.198
  674    H    ALA  89           H        ALA  89   4.859  -8.591   3.915
  675    HA   ALA  89           HA       ALA  89   2.759  -7.063   5.054
  676   1HB   ALA  89          1HB       ALA  89   4.342  -9.432   5.833
  677   2HB   ALA  89          2HB       ALA  89   2.596  -9.177   5.839
  678   3HB   ALA  89          3HB       ALA  89   3.588  -8.523   7.143
  679    H    ASP  90           H        ASP  90   6.245  -7.150   5.552
  680    HA   ASP  90           HA       ASP  90   6.270  -5.432   7.815
  681   1HB   ASP  90          2HB       ASP  90   8.312  -6.381   7.807
  682   2HB   ASP  90          1HB       ASP  90   8.227  -6.748   6.090
  683    H    ILE  91           H        ILE  91   6.726  -4.899   4.358
  684    HA   ILE  91           HA       ILE  91   7.130  -2.120   4.459
  685    HB   ILE  91           HB       ILE  91   6.060  -3.918   2.297
  686   1HG1  ILE  91          2HG1      ILE  91   8.439  -4.064   2.756
  687   2HG1  ILE  91          1HG1      ILE  91   8.194  -3.264   1.206
  688   1HG2  ILE  91          1HG2      ILE  91   5.173  -2.206   1.193
  689   2HG2  ILE  91          2HG2      ILE  91   6.757  -1.432   1.162
  690   3HG2  ILE  91          3HG2      ILE  91   5.637  -1.097   2.484
  691   1HD1  ILE  91          1HD1      ILE  91   8.262  -1.150   2.930
  692   2HD1  ILE  91          2HD1      ILE  91   9.632  -1.751   1.990
  693   3HD1  ILE  91          3HD1      ILE  91   9.414  -2.270   3.661
  694    H    GLN  92           H        GLN  92   4.099  -3.922   3.819
  695    HA   GLN  92           HA       GLN  92   2.302  -1.853   4.016
  696   1HB   GLN  92          2HB       GLN  92   1.830  -4.313   3.554
  697   2HB   GLN  92          1HB       GLN  92   1.818  -4.539   5.298
  698   1HG   GLN  92          2HG       GLN  92   0.027  -2.808   5.430
  699   2HG   GLN  92          1HG       GLN  92  -0.030  -2.816   3.668
  700   1HE2  GLN  92          1HE2      GLN  92  -0.034  -5.153   6.343
  701   2HE2  GLN  92          2HE2      GLN  92  -1.304  -6.145   5.691
  702    H    GLU  93           H        GLU  93   3.807  -3.653   6.605
  703    HA   GLU  93           HA       GLU  93   2.413  -2.513   8.778
  704   1HB   GLU  93          2HB       GLU  93   4.295  -4.450   8.598
  705   2HB   GLU  93          1HB       GLU  93   5.268  -3.136   9.242
  706   1HG   GLU  93          2HG       GLU  93   4.156  -4.753  10.885
  707   2HG   GLU  93          1HG       GLU  93   4.048  -3.024  11.210
  708    H    LEU  94           H        LEU  94   5.489  -1.601   7.281
  709    HA   LEU  94           HA       LEU  94   6.109   0.621   8.844
  710   1HB   LEU  94          2HB       LEU  94   6.747  -0.236   6.060
  711   2HB   LEU  94          1HB       LEU  94   7.154   1.401   6.541
  712    HG   LEU  94           HG       LEU  94   8.063  -0.811   8.310
  713   1HD1  LEU  94          1HD1      LEU  94  10.043  -0.256   6.308
  714   2HD1  LEU  94          2HD1      LEU  94   8.580  -0.895   5.560
  715   3HD1  LEU  94          3HD1      LEU  94   9.389  -1.805   6.836
  716   1HD2  LEU  94          1HD2      LEU  94   9.155   0.901   9.206
  717   2HD2  LEU  94          2HD2      LEU  94   8.543   1.977   7.949
  718   3HD2  LEU  94          3HD2      LEU  94  10.052   1.099   7.700
  719    H    PHE  95           H        PHE  95   4.272   0.437   5.821
  720    HA   PHE  95           HA       PHE  95   3.955   3.300   5.784
  721   1HB   PHE  95          2HB       PHE  95   3.532   1.124   3.894
  722   2HB   PHE  95          1HB       PHE  95   2.291   2.376   3.805
  723    HD1  PHE  95           1HD      PHE  95   2.833   4.628   3.128
  724    HD2  PHE  95           2HD      PHE  95   5.852   1.637   3.421
  725    HE1  PHE  95           1HE      PHE  95   4.363   6.042   1.825
  726    HE2  PHE  95           2HE      PHE  95   7.385   3.050   2.125
  727    HZ   PHE  95           HZ       PHE  95   6.676   5.338   1.465
  728    H    ALA  96           H        ALA  96   1.805   0.549   6.446
  729    HA   ALA  96           HA       ALA  96  -0.517   2.000   6.951
  730   1HB   ALA  96          1HB       ALA  96   0.040  -0.588   7.117
  731   2HB   ALA  96          2HB       ALA  96  -1.343   0.126   7.946
  732   3HB   ALA  96          3HB       ALA  96   0.146  -0.196   8.833
  733    H    GLU  97           H        GLU  97   2.413   1.716   8.775
  734    HA   GLU  97           HA       GLU  97   1.397   3.066  11.126
  735   1HB   GLU  97          2HB       GLU  97   3.470   1.434  10.859
  736   2HB   GLU  97          1HB       GLU  97   4.316   2.930  10.482
  737   1HG   GLU  97          2HG       GLU  97   2.639   2.925  12.913
  738   2HG   GLU  97          1HG       GLU  97   4.107   1.949  12.949
  739    H    PHE  98           H        PHE  98   3.192   3.832   8.214
  740    HA   PHE  98           HA       PHE  98   3.931   6.474   8.874
  741   1HB   PHE  98          2HB       PHE  98   3.740   4.898   6.330
  742   2HB   PHE  98          1HB       PHE  98   4.047   6.628   6.262
  743    HD1  PHE  98           1HD      PHE  98   5.860   4.433   5.257
  744    HD2  PHE  98           2HD      PHE  98   5.679   6.488   8.979
  745    HE1  PHE  98           1HE      PHE  98   8.260   4.019   5.599
  746    HE2  PHE  98           2HE      PHE  98   8.078   6.074   9.327
  747    HZ   PHE  98           HZ       PHE  98   9.373   4.841   7.636
  748    H    GLY  99           H        GLY  99   0.980   5.095   7.693
  749   1HA   GLY  99          2HA       GLY  99  -0.655   7.238   8.144
  750   2HA   GLY  99          1HA       GLY  99  -0.030   7.531   6.529
  751    H    THR 100           H        THR 100  -0.771   6.341   4.822
  752    HA   THR 100           HA       THR 100  -3.026   4.535   5.421
  753    HB   THR 100           HB       THR 100  -3.167   5.613   2.756
  754    HG1  THR 100           1HG      THR 100  -2.010   7.374   3.865
  755   1HG2  THR 100          1HG2      THR 100  -4.931   5.891   5.192
  756   2HG2  THR 100          2HG2      THR 100  -5.065   4.668   3.928
  757   3HG2  THR 100          3HG2      THR 100  -5.392   6.360   3.556
  758    H    LEU 101           H        LEU 101  -3.478   3.013   3.509
  759    HA   LEU 101           HA       LEU 101  -1.563   2.167   1.747
  760   1HB   LEU 101          2HB       LEU 101  -0.708   1.712   4.379
  761   2HB   LEU 101          1HB       LEU 101  -1.258   0.152   3.801
  762    HG   LEU 101           HG       LEU 101   1.237   1.346   3.368
  763   1HD1  LEU 101          1HD1      LEU 101  -0.148  -1.037   2.197
  764   2HD1  LEU 101          2HD1      LEU 101   0.923  -0.981   3.597
  765   3HD1  LEU 101          3HD1      LEU 101   1.575  -0.706   1.977
  766   1HD2  LEU 101          1HD2      LEU 101   0.243   2.645   1.535
  767   2HD2  LEU 101          2HD2      LEU 101  -0.312   1.145   0.789
  768   3HD2  LEU 101          3HD2      LEU 101   1.416   1.463   0.954
  769    H    LYS 102           H        LYS 102  -2.723   0.870   0.391
  770    HA   LYS 102           HA       LYS 102  -4.734  -0.889   1.616
  771   1HB   LYS 102          2HB       LYS 102  -5.353   1.285   0.081
  772   2HB   LYS 102          1HB       LYS 102  -5.275   0.010  -1.128
  773   1HG   LYS 102          2HG       LYS 102  -6.754  -0.783   1.245
  774   2HG   LYS 102          1HG       LYS 102  -7.444   0.628   0.442
  775   1HD   LYS 102          2HD       LYS 102  -6.646  -1.478  -1.410
  776   2HD   LYS 102          1HD       LYS 102  -7.878  -1.995  -0.257
  777   1HE   LYS 102          2HE       LYS 102  -8.984  -1.126  -2.192
  778   2HE   LYS 102          1HE       LYS 102  -9.204   0.019  -0.870
  779   1HZ   LYS 102          1HZ       LYS 102  -8.617   1.040  -3.043
  780   2HZ   LYS 102          2HZ       LYS 102  -7.096   0.290  -2.944
  781   3HZ   LYS 102          3HZ       LYS 102  -7.556   1.442  -1.780
  782    H    LYS 103           H        LYS 103  -1.965  -0.629  -0.109
  783    HA   LYS 103           HA       LYS 103  -1.784  -3.343  -0.585
  784   1HB   LYS 103          2HB       LYS 103  -1.620  -3.396  -3.118
  785   2HB   LYS 103          1HB       LYS 103  -3.226  -3.339  -2.414
  786   1HG   LYS 103          2HG       LYS 103  -3.681  -1.306  -3.272
  787   2HG   LYS 103          1HG       LYS 103  -2.012  -0.748  -3.132
  788   1HD   LYS 103          2HD       LYS 103  -2.978  -1.135  -5.492
  789   2HD   LYS 103          1HD       LYS 103  -1.374  -1.776  -5.132
  790   1HE   LYS 103          2HE       LYS 103  -2.545  -3.482  -6.285
  791   2HE   LYS 103          1HE       LYS 103  -2.497  -3.966  -4.590
  792   1HZ   LYS 103          1HZ       LYS 103  -4.807  -2.439  -5.574
  793   2HZ   LYS 103          2HZ       LYS 103  -4.725  -3.584  -4.321
  794   3HZ   LYS 103          3HZ       LYS 103  -4.701  -4.095  -5.938
  795    H    ALA 104           H        ALA 104   0.240  -3.142   0.322
  796    HA   ALA 104           HA       ALA 104   2.231  -1.986  -1.483
  797   1HB   ALA 104          1HB       ALA 104   3.105  -1.304   0.451
  798   2HB   ALA 104          2HB       ALA 104   3.632  -2.976   0.669
  799   3HB   ALA 104          3HB       ALA 104   2.117  -2.431   1.389
  800    H    ALA 105           H        ALA 105   2.878  -3.249  -3.017
  801    HA   ALA 105           HA       ALA 105   3.091  -6.157  -2.575
  802   1HB   ALA 105          1HB       ALA 105   3.337  -4.928  -5.276
  803   2HB   ALA 105          2HB       ALA 105   1.741  -5.000  -4.528
  804   3HB   ALA 105          3HB       ALA 105   2.654  -6.483  -4.805
  805    H    VAL 106           H        VAL 106   5.038  -7.108  -3.967
  806    HA   VAL 106           HA       VAL 106   7.313  -5.363  -3.353
  807    HB   VAL 106           HB       VAL 106   7.088  -8.299  -2.695
  808   1HG1  VAL 106          1HG1      VAL 106   9.371  -8.081  -1.779
  809   2HG1  VAL 106          2HG1      VAL 106   9.475  -6.462  -2.471
  810   3HG1  VAL 106          3HG1      VAL 106   9.327  -7.867  -3.529
  811   1HG2  VAL 106          1HG2      VAL 106   5.990  -6.699  -1.177
  812   2HG2  VAL 106          2HG2      VAL 106   7.542  -5.884  -0.944
  813   3HG2  VAL 106          3HG2      VAL 106   7.330  -7.557  -0.411
  814    H    ASP 107           H        ASP 107   8.971  -5.387  -4.650
  815    HA   ASP 107           HA       ASP 107   8.656  -6.831  -7.207
  816   1HB   ASP 107          2HB       ASP 107   8.529  -4.164  -6.969
  817   2HB   ASP 107          1HB       ASP 107  10.273  -4.341  -7.141
  818    H    TYR 108           H        TYR 108  10.115  -8.286  -7.577
  819    HA   TYR 108           HA       TYR 108  12.624  -8.369  -6.188
  820   1HB   TYR 108          2HB       TYR 108  11.295 -10.080  -8.265
  821   2HB   TYR 108          1HB       TYR 108  13.006 -10.302  -7.909
  822    HD1  TYR 108           1HD      TYR 108   9.895  -9.766  -5.890
  823    HD2  TYR 108           2HD      TYR 108  13.428 -12.061  -6.485
  824    HE1  TYR 108           1HE      TYR 108   9.300 -11.174  -3.965
  825    HE2  TYR 108           2HE      TYR 108  12.841 -13.476  -4.563
  826    HH   TYR 108           HH       TYR 108  11.071 -14.095  -3.206
  827    H    ASP 109           H        ASP 109  14.633  -8.930  -7.798
  828    HA   ASP 109           HA       ASP 109  15.034  -6.353  -9.044
  829   1HB   ASP 109          2HB       ASP 109  17.142  -6.663  -8.362
  830   2HB   ASP 109          1HB       ASP 109  16.671  -8.219  -7.698
  831    H    ARG 110           H        ARG 110  16.247  -6.332 -11.182
  832    HA   ARG 110           HA       ARG 110  14.510  -7.322 -13.154
  833   1HB   ARG 110          2HB       ARG 110  17.340  -6.334 -13.535
  834   2HB   ARG 110          1HB       ARG 110  16.082  -6.409 -14.761
  835   1HG   ARG 110          2HG       ARG 110  14.768  -4.767 -13.495
  836   2HG   ARG 110          1HG       ARG 110  16.067  -4.668 -12.305
  837   1HD   ARG 110          2HD       ARG 110  17.013  -3.089 -13.546
  838   2HD   ARG 110          1HD       ARG 110  17.278  -4.293 -14.806
  839    HE   ARG 110           HE       ARG 110  14.830  -2.645 -14.637
  840   1HH1  ARG 110          1HH1      ARG 110  17.420  -4.140 -16.467
  841   2HH1  ARG 110          2HH1      ARG 110  16.841  -3.557 -18.002
  842   1HH2  ARG 110          1HH2      ARG 110  14.036  -1.922 -16.659
  843   2HH2  ARG 110          2HH2      ARG 110  14.902  -2.327 -18.115
  844    H    SER 111           H        SER 111  17.334  -8.685 -11.700
  845    HA   SER 111           HA       SER 111  17.536 -10.773 -13.731
  846   1HB   SER 111          2HB       SER 111  19.261 -10.945 -11.348
  847   2HB   SER 111          1HB       SER 111  19.684 -11.035 -13.058
  848    HG   SER 111           HG       SER 111  19.165  -8.682 -11.536
  849    H    GLY 112           H        GLY 112  15.327 -10.407 -11.602
  850   1HA   GLY 112          2HA       GLY 112  13.943 -11.821 -10.455
  851   2HA   GLY 112          1HA       GLY 112  14.756 -13.131 -11.292
  852    H    ARG 113           H        ARG 113  16.345 -10.896  -9.094
  853    HA   ARG 113           HA       ARG 113  16.667 -13.112  -7.175
  854   1HB   ARG 113          2HB       ARG 113  18.611 -11.613  -8.388
  855   2HB   ARG 113          1HB       ARG 113  18.384 -10.739  -6.881
  856   1HG   ARG 113          2HG       ARG 113  19.638 -12.215  -5.828
  857   2HG   ARG 113          1HG       ARG 113  18.515 -13.503  -6.275
  858   1HD   ARG 113          2HD       ARG 113  19.705 -13.576  -8.508
  859   2HD   ARG 113          1HD       ARG 113  20.934 -12.541  -7.780
  860    HE   ARG 113           HE       ARG 113  20.382 -15.336  -7.143
  861   1HH1  ARG 113          1HH1      ARG 113  22.207 -12.416  -6.476
  862   2HH1  ARG 113          2HH1      ARG 113  23.452 -13.252  -5.592
  863   1HH2  ARG 113          1HH2      ARG 113  21.976 -16.424  -5.920
  864   2HH2  ARG 113          2HH2      ARG 113  23.297 -15.517  -5.229
  865    H    SER 114           H        SER 114  16.868 -12.335  -4.831
  866    HA   SER 114           HA       SER 114  14.691 -10.790  -4.015
  867   1HB   SER 114          2HB       SER 114  17.262 -11.172  -2.463
  868   2HB   SER 114          1HB       SER 114  15.645 -10.901  -1.814
  869    HG   SER 114           HG       SER 114  15.045 -12.938  -2.427
  870    H    LEU 115           H        LEU 115  14.876  -8.659  -2.781
  871    HA   LEU 115           HA       LEU 115  16.841  -6.823  -3.716
  872   1HB   LEU 115          2HB       LEU 115  15.668  -7.280  -5.825
  873   2HB   LEU 115          1HB       LEU 115  14.153  -6.804  -5.085
  874    HG   LEU 115           HG       LEU 115  15.404  -4.535  -4.679
  875   1HD1  LEU 115          1HD1      LEU 115  16.865  -4.100  -6.717
  876   2HD1  LEU 115          2HD1      LEU 115  16.993  -5.855  -6.859
  877   3HD1  LEU 115          3HD1      LEU 115  17.579  -5.040  -5.408
  878   1HD2  LEU 115          1HD2      LEU 115  14.235  -5.541  -7.258
  879   2HD2  LEU 115          2HD2      LEU 115  14.627  -3.842  -6.975
  880   3HD2  LEU 115          3HD2      LEU 115  13.434  -4.653  -5.956
  881    H    GLY 116           H        GLY 116  13.307  -6.750  -3.176
  882   1HA   GLY 116          2HA       GLY 116  12.414  -6.175  -1.017
  883   2HA   GLY 116          1HA       GLY 116  13.855  -5.219  -0.741
  884    H    THR 117           H        THR 117  13.218  -4.372  -3.763
  885    HA   THR 117           HA       THR 117  12.058  -1.889  -3.041
  886    HB   THR 117           HB       THR 117  12.326  -3.114  -5.798
  887    HG1  THR 117           1HG      THR 117  14.105  -1.163  -4.987
  888   1HG2  THR 117          1HG2      THR 117  10.791  -1.200  -5.735
  889   2HG2  THR 117          2HG2      THR 117  12.279  -0.798  -6.594
  890   3HG2  THR 117          3HG2      THR 117  12.034  -0.231  -4.940
  891    H    ALA 118           H        ALA 118   9.965  -1.684  -2.437
  892    HA   ALA 118           HA       ALA 118   8.023  -3.497  -3.705
  893   1HB   ALA 118          1HB       ALA 118   8.501  -3.043  -1.005
  894   2HB   ALA 118          2HB       ALA 118   7.107  -3.869  -1.707
  895   3HB   ALA 118          3HB       ALA 118   7.018  -2.145  -1.344
  896    H    ASP 119           H        ASP 119   5.846  -2.686  -3.938
  897    HA   ASP 119           HA       ASP 119   5.731   0.186  -4.594
  898   1HB   ASP 119          2HB       ASP 119   5.575  -0.929  -6.680
  899   2HB   ASP 119          1HB       ASP 119   4.570  -2.212  -6.012
  900    H    VAL 120           H        VAL 120   4.531   1.148  -3.065
  901    HA   VAL 120           HA       VAL 120   2.305  -0.399  -1.936
  902    HB   VAL 120           HB       VAL 120   2.580   0.540   0.102
  903   1HG1  VAL 120          1HG1      VAL 120   5.036   0.058  -1.174
  904   2HG1  VAL 120          2HG1      VAL 120   4.671  -0.008   0.550
  905   3HG1  VAL 120          3HG1      VAL 120   5.256   1.495  -0.169
  906   1HG2  VAL 120          1HG2      VAL 120   3.480   3.043  -1.288
  907   2HG2  VAL 120          2HG2      VAL 120   3.570   2.840   0.462
  908   3HG2  VAL 120          3HG2      VAL 120   2.008   2.772  -0.354
  909    H    HIS 121           H        HIS 121   0.270   0.637  -1.637
  910    HA   HIS 121           HA       HIS 121  -0.114   2.979  -3.348
  911   1HB   HIS 121          2HB       HIS 121  -1.110   0.238  -3.780
  912   2HB   HIS 121          1HB       HIS 121  -2.319   1.507  -3.947
  913    HD1  HIS 121           1HD      HIS 121   0.835   0.197  -5.531
  914    HD2  HIS 121           2HD      HIS 121  -2.033   3.147  -6.165
  915    HE1  HIS 121           1HE      HIS 121   1.226   1.034  -7.864
  916    HE2  HIS 121           2HE      HIS 121  -0.406   2.938  -8.162
  917    H    PHE 122           H        PHE 122  -1.467   4.401  -2.578
  918    HA   PHE 122           HA       PHE 122  -3.433   3.582  -0.558
  919   1HB   PHE 122          2HB       PHE 122  -2.835   6.240   0.052
  920   2HB   PHE 122          1HB       PHE 122  -2.422   4.827   1.007
  921    HD1  PHE 122           1HD      PHE 122  -0.196   4.362   1.469
  922    HD2  PHE 122           2HD      PHE 122  -1.134   6.989  -1.735
  923    HE1  PHE 122           1HE      PHE 122   2.182   4.920   1.234
  924    HE2  PHE 122           2HE      PHE 122   1.242   7.545  -1.982
  925    HZ   PHE 122           HZ       PHE 122   2.907   6.513  -0.495
  926    H    GLU 123           H        GLU 123  -5.323   4.936  -0.484
  927    HA   GLU 123           HA       GLU 123  -6.090   5.975  -3.061
  928   1HB   GLU 123          2HB       GLU 123  -7.460   5.615  -0.421
  929   2HB   GLU 123          1HB       GLU 123  -8.196   6.628  -1.655
  930   1HG   GLU 123          2HG       GLU 123  -9.065   4.821  -2.572
  931   2HG   GLU 123          1HG       GLU 123  -7.438   4.246  -2.932
  932    H    ARG 124           H        ARG 124  -4.316   7.221  -0.630
  933    HA   ARG 124           HA       ARG 124  -5.365   9.952  -0.935
  934   1HB   ARG 124          2HB       ARG 124  -3.436   9.065   1.202
  935   2HB   ARG 124          1HB       ARG 124  -4.449  10.502   1.178
  936   1HG   ARG 124          2HG       ARG 124  -5.526   7.698   1.359
  937   2HG   ARG 124          1HG       ARG 124  -5.186   8.717   2.758
  938   1HD   ARG 124          2HD       ARG 124  -6.818  10.014   0.703
  939   2HD   ARG 124          1HD       ARG 124  -7.574   8.596   1.429
  940    HE   ARG 124           HE       ARG 124  -6.522  10.206   3.478
  941   1HH1  ARG 124          1HH1      ARG 124  -9.092  10.243   1.093
  942   2HH1  ARG 124          2HH1      ARG 124 -10.129  11.277   2.028
  943   1HH2  ARG 124          1HH2      ARG 124  -7.871  11.563   4.710
  944   2HH2  ARG 124          2HH2      ARG 124  -9.427  12.039   4.095
  945    H    ARG 125           H        ARG 125  -4.263  11.038  -2.449
  946    HA   ARG 125           HA       ARG 125  -1.656  10.180  -3.271
  947   1HB   ARG 125          2HB       ARG 125  -3.743  11.737  -4.377
  948   2HB   ARG 125          1HB       ARG 125  -2.313  12.760  -4.318
  949   1HG   ARG 125          2HG       ARG 125  -1.351  11.676  -5.998
  950   2HG   ARG 125          1HG       ARG 125  -1.696  10.102  -5.278
  951   1HD   ARG 125          2HD       ARG 125  -2.750  10.762  -7.574
  952   2HD   ARG 125          1HD       ARG 125  -3.705   9.891  -6.375
  953    HE   ARG 125           HE       ARG 125  -3.900  12.778  -6.247
  954   1HH1  ARG 125          1HH1      ARG 125  -5.234   9.835  -7.582
  955   2HH1  ARG 125          2HH1      ARG 125  -6.814  10.509  -7.840
  956   1HH2  ARG 125          1HH2      ARG 125  -5.929  13.682  -6.576
  957   2HH2  ARG 125          2HH2      ARG 125  -7.212  12.733  -7.276
  958    H    ALA 126           H        ALA 126  -2.899  12.410  -0.990
  959    HA   ALA 126           HA       ALA 126  -0.579  14.076  -0.844
  960   1HB   ALA 126          1HB       ALA 126  -1.535  14.514   1.522
  961   2HB   ALA 126          2HB       ALA 126  -2.949  13.648   0.913
  962   3HB   ALA 126          3HB       ALA 126  -2.397  15.117   0.106
  963    H    ASP 127           H        ASP 127  -1.240  10.886   0.079
  964    HA   ASP 127           HA       ASP 127   0.658  10.840   2.264
  965   1HB   ASP 127          2HB       ASP 127  -1.351   9.054   1.248
  966   2HB   ASP 127          1HB       ASP 127   0.192   8.205   1.323
  967    H    ALA 128           H        ALA 128   0.586  10.529  -1.127
  968    HA   ALA 128           HA       ALA 128   3.201   9.348  -1.405
  969   1HB   ALA 128          1HB       ALA 128   1.187   9.441  -3.112
  970   2HB   ALA 128          2HB       ALA 128   2.856   9.471  -3.682
  971   3HB   ALA 128          3HB       ALA 128   1.935  10.971  -3.570
  972    H    LEU 129           H        LEU 129   1.933  12.531  -2.346
  973    HA   LEU 129           HA       LEU 129   4.065  14.162  -2.202
  974   1HB   LEU 129          2HB       LEU 129   1.669  14.845  -2.502
  975   2HB   LEU 129          1HB       LEU 129   1.496  14.807  -0.758
  976    HG   LEU 129           HG       LEU 129   3.708  16.479  -1.769
  977   1HD1  LEU 129          1HD1      LEU 129   0.954  16.812  -2.705
  978   2HD1  LEU 129          2HD1      LEU 129   2.461  17.480  -3.336
  979   3HD1  LEU 129          3HD1      LEU 129   1.658  18.252  -1.968
  980   1HD2  LEU 129          1HD2      LEU 129   1.631  17.521   0.036
  981   2HD2  LEU 129          2HD2      LEU 129   3.390  17.577   0.168
  982   3HD2  LEU 129          3HD2      LEU 129   2.517  16.111   0.624
  983    H    LYS 130           H        LYS 130   2.571  12.626   0.530
  984    HA   LYS 130           HA       LYS 130   4.041  14.157   2.508
  985   1HB   LYS 130          2HB       LYS 130   1.957  13.264   3.292
  986   2HB   LYS 130          1HB       LYS 130   2.400  11.635   2.787
  987   1HG   LYS 130          2HG       LYS 130   4.356  11.854   4.425
  988   2HG   LYS 130          1HG       LYS 130   3.477  13.244   5.075
  989   1HD   LYS 130          2HD       LYS 130   2.920  11.301   6.378
  990   2HD   LYS 130          1HD       LYS 130   1.508  11.781   5.437
  991   1HE   LYS 130          2HE       LYS 130   2.173  10.061   3.740
  992   2HE   LYS 130          1HE       LYS 130   3.403   9.509   4.877
  993   1HZ   LYS 130          1HZ       LYS 130   0.776   9.744   6.028
  994   2HZ   LYS 130          2HZ       LYS 130   1.887   8.473   6.121
  995   3HZ   LYS 130          3HZ       LYS 130   0.859   8.602   4.777
  996    H    ALA 131           H        ALA 131   4.229  10.950   1.023
  997    HA   ALA 131           HA       ALA 131   6.435  10.050   2.538
  998   1HB   ALA 131          1HB       ALA 131   4.691   8.851   0.855
  999   2HB   ALA 131          2HB       ALA 131   6.229   8.134   1.342
 1000   3HB   ALA 131          3HB       ALA 131   6.102   8.987  -0.197
 1001    H    MET 132           H        MET 132   6.124  11.791  -0.507
 1002    HA   MET 132           HA       MET 132   8.907  11.646  -1.127
 1003   1HB   MET 132          2HB       MET 132   8.388  12.684  -3.092
 1004   2HB   MET 132          1HB       MET 132   6.804  12.052  -2.672
 1005   1HG   MET 132          2HG       MET 132   6.003  14.145  -2.046
 1006   2HG   MET 132          1HG       MET 132   7.624  14.823  -1.895
 1007   1HE   MET 132          1HE       MET 132   4.629  14.509  -3.509
 1008   2HE   MET 132          2HE       MET 132   4.833  14.321  -5.251
 1009   3HE   MET 132          3HE       MET 132   4.864  15.930  -4.527
 1010    H    LYS 133           H        LYS 133   7.037  13.706   0.947
 1011    HA   LYS 133           HA       LYS 133   9.142  15.744   0.905
 1012   1HB   LYS 133          2HB       LYS 133   6.306  15.686   1.655
 1013   2HB   LYS 133          1HB       LYS 133   7.324  16.541   2.804
 1014   1HG   LYS 133          2HG       LYS 133   6.538  18.151   1.275
 1015   2HG   LYS 133          1HG       LYS 133   8.227  17.853   0.856
 1016   1HD   LYS 133          2HD       LYS 133   7.309  16.140  -0.812
 1017   2HD   LYS 133          1HD       LYS 133   5.748  16.919  -0.552
 1018   1HE   LYS 133          2HE       LYS 133   7.147  17.732  -2.526
 1019   2HE   LYS 133          1HE       LYS 133   6.472  18.952  -1.448
 1020   1HZ   LYS 133          1HZ       LYS 133   8.552  19.338  -0.479
 1021   2HZ   LYS 133          2HZ       LYS 133   8.885  19.216  -2.136
 1022   3HZ   LYS 133          3HZ       LYS 133   9.227  17.913  -1.105
 1023    H    GLN 134           H        GLN 134   7.921  13.099   2.747
 1024    HA   GLN 134           HA       GLN 134   9.325  13.973   5.161
 1025   1HB   GLN 134          2HB       GLN 134   6.947  12.377   4.648
 1026   2HB   GLN 134          1HB       GLN 134   8.047  11.592   5.773
 1027   1HG   GLN 134          2HG       GLN 134   6.459  12.895   7.001
 1028   2HG   GLN 134          1HG       GLN 134   8.051  13.638   7.148
 1029   1HE2  GLN 134          1HE2      GLN 134   5.771  13.820   4.459
 1030   2HE2  GLN 134          2HE2      GLN 134   5.534  15.531   4.546
 1031    H    TYR 135           H        TYR 135   8.857  10.880   3.415
 1032    HA   TYR 135           HA       TYR 135  11.189   9.833   4.799
 1033   1HB   TYR 135          2HB       TYR 135   9.606   8.265   2.794
 1034   2HB   TYR 135          1HB       TYR 135  10.441   7.703   4.240
 1035    HD1  TYR 135           1HD      TYR 135   9.493   8.885   6.475
 1036    HD2  TYR 135           2HD      TYR 135   7.311   8.262   2.884
 1037    HE1  TYR 135           1HE      TYR 135   7.393   8.942   7.753
 1038    HE2  TYR 135           2HE      TYR 135   5.196   8.322   4.149
 1039    HH   TYR 135           HH       TYR 135   4.242   8.690   6.141
 1040    H    LYS 136           H        LYS 136  10.377  10.899   1.572
 1041    HA   LYS 136           HA       LYS 136  12.438   9.549   0.202
 1042   1HB   LYS 136          2HB       LYS 136  10.436  10.716  -0.824
 1043   2HB   LYS 136          1HB       LYS 136  11.295  12.231  -0.579
 1044   1HG   LYS 136          2HG       LYS 136  13.146  11.304  -1.977
 1045   2HG   LYS 136          1HG       LYS 136  12.102   9.923  -2.331
 1046   1HD   LYS 136          2HD       LYS 136  10.509  11.294  -3.426
 1047   2HD   LYS 136          1HD       LYS 136  11.266  12.772  -2.831
 1048   1HE   LYS 136          2HE       LYS 136  13.260  11.362  -4.219
 1049   2HE   LYS 136          1HE       LYS 136  11.812  11.281  -5.220
 1050   1HZ   LYS 136          1HZ       LYS 136  12.596  13.862  -4.053
 1051   2HZ   LYS 136          2HZ       LYS 136  11.762  13.535  -5.497
 1052   3HZ   LYS 136          3HZ       LYS 136  13.436  13.283  -5.409
 1053    H    GLY 137           H        GLY 137  14.552   9.997  -0.152
 1054   1HA   GLY 137          2HA       GLY 137  16.568  11.125  -0.030
 1055   2HA   GLY 137          1HA       GLY 137  15.717  12.520   0.612
 1056    H    VAL 138           H        VAL 138  14.824   9.901   2.438
 1057    HA   VAL 138           HA       VAL 138  16.517  10.844   4.609
 1058    HB   VAL 138           HB       VAL 138  14.073   9.079   4.531
 1059   1HG1  VAL 138          1HG1      VAL 138  16.123   9.001   6.494
 1060   2HG1  VAL 138          2HG1      VAL 138  14.563   8.177   6.496
 1061   3HG1  VAL 138          3HG1      VAL 138  14.712   9.787   7.202
 1062   1HG2  VAL 138          1HG2      VAL 138  13.750  11.199   6.306
 1063   2HG2  VAL 138          2HG2      VAL 138  13.058  11.044   4.691
 1064   3HG2  VAL 138          3HG2      VAL 138  14.591  11.885   4.915
 1065    HA   PRO 139           HA       PRO 139  18.986   7.113   4.483
 1066   1HB   PRO 139          2HB       PRO 139  20.721   7.779   6.399
 1067   2HB   PRO 139          1HB       PRO 139  20.722   8.614   4.843
 1068   1HG   PRO 139          2HG       PRO 139  19.667   9.517   7.477
 1069   2HG   PRO 139          1HG       PRO 139  20.448  10.459   6.196
 1070   1HD   PRO 139          2HD       PRO 139  17.687  10.256   6.660
 1071   2HD   PRO 139          1HD       PRO 139  18.458  10.898   5.199
 1072    H    LEU 140           H        LEU 140  20.102   5.891   6.599
 1073    HA   LEU 140           HA       LEU 140  18.419   5.721   8.890
 1074   1HB   LEU 140          2HB       LEU 140  17.403   4.283   6.862
 1075   2HB   LEU 140          1HB       LEU 140  18.584   3.123   7.438
 1076    HG   LEU 140           HG       LEU 140  17.459   3.610   9.771
 1077   1HD1  LEU 140          1HD1      LEU 140  15.326   4.410   9.785
 1078   2HD1  LEU 140          2HD1      LEU 140  15.009   3.915   8.122
 1079   3HD1  LEU 140          3HD1      LEU 140  15.980   5.351   8.445
 1080   1HD2  LEU 140          1HD2      LEU 140  17.086   1.679   7.687
 1081   2HD2  LEU 140          2HD2      LEU 140  15.572   1.922   8.559
 1082   3HD2  LEU 140          3HD2      LEU 140  17.030   1.460   9.436
 1083    H    ASP 141           H        ASP 141  20.294   6.058  10.016
 1084    HA   ASP 141           HA       ASP 141  22.394   5.778  10.836
 1085   1HB   ASP 141          2HB       ASP 141  21.490   3.412  11.233
 1086   2HB   ASP 141          1HB       ASP 141  22.341   2.947   9.764
 1087    H    GLY 142           H        GLY 142  24.641   4.596   9.903
 1088   1HA   GLY 142          2HA       GLY 142  25.590   5.925   7.705
 1089   2HA   GLY 142          1HA       GLY 142  26.233   4.383   8.229
 1090    H    ARG 143           H        ARG 143  23.026   4.033   7.285
 1091    HA   ARG 143           HA       ARG 143  23.730   3.606   4.459
 1092   1HB   ARG 143          2HB       ARG 143  23.610   1.453   5.816
 1093   2HB   ARG 143          1HB       ARG 143  21.885   1.762   5.966
 1094   1HG   ARG 143          2HG       ARG 143  21.596   1.627   3.585
 1095   2HG   ARG 143          1HG       ARG 143  23.340   1.496   3.344
 1096   1HD   ARG 143          2HD       ARG 143  21.821  -0.641   3.334
 1097   2HD   ARG 143          1HD       ARG 143  23.417  -0.675   4.081
 1098    HE   ARG 143           HE       ARG 143  22.374  -0.542   6.222
 1099   1HH1  ARG 143          1HH1      ARG 143  20.202  -1.147   3.549
 1100   2HH1  ARG 143          2HH1      ARG 143  18.884  -1.649   4.565
 1101   1HH2  ARG 143          1HH2      ARG 143  20.663  -1.167   7.570
 1102   2HH2  ARG 143          2HH2      ARG 143  19.145  -1.666   6.877
 1103    HA   PRO 144           HA       PRO 144  20.035   6.211   4.225
 1104   1HB   PRO 144          2HB       PRO 144  20.359   6.848   1.609
 1105   2HB   PRO 144          1HB       PRO 144  21.243   7.660   2.905
 1106   1HG   PRO 144          2HG       PRO 144  22.144   5.469   1.078
 1107   2HG   PRO 144          1HG       PRO 144  23.025   6.911   1.621
 1108   1HD   PRO 144          2HD       PRO 144  23.407   4.447   2.703
 1109   2HD   PRO 144          1HD       PRO 144  23.609   5.949   3.627
 1110    H    MET 145           H        MET 145  17.981   5.912   3.187
 1111    HA   MET 145           HA       MET 145  17.753   3.256   1.968
 1112   1HB   MET 145          2HB       MET 145  15.406   3.274   2.547
 1113   2HB   MET 145          1HB       MET 145  16.359   3.650   3.969
 1114   1HG   MET 145          2HG       MET 145  15.830   6.137   3.174
 1115   2HG   MET 145          1HG       MET 145  14.433   5.322   2.470
 1116   1HE   MET 145          1HE       MET 145  12.123   5.995   4.928
 1117   2HE   MET 145          2HE       MET 145  12.956   6.598   3.496
 1118   3HE   MET 145          3HE       MET 145  13.254   7.341   5.068
 1119    H    ASP 146           H        ASP 146  15.314   3.610   0.668
 1120    HA   ASP 146           HA       ASP 146  15.818   5.642  -1.345
 1121   1HB   ASP 146          2HB       ASP 146  17.049   3.504  -2.000
 1122   2HB   ASP 146          1HB       ASP 146  15.459   2.776  -2.207
 1123    H    ILE 147           H        ILE 147  13.977   5.668  -2.956
 1124    HA   ILE 147           HA       ILE 147  11.441   4.816  -2.072
 1125    HB   ILE 147           HB       ILE 147  10.885   7.452  -1.629
 1126   1HG1  ILE 147          2HG1      ILE 147  13.618   7.408  -1.338
 1127   2HG1  ILE 147          1HG1      ILE 147  12.543   8.611  -0.645
 1128   1HG2  ILE 147          1HG2      ILE 147  10.027   5.486  -0.418
 1129   2HG2  ILE 147          2HG2      ILE 147  10.434   6.830   0.649
 1130   3HG2  ILE 147          3HG2      ILE 147  11.518   5.444   0.523
 1131   1HD1  ILE 147          1HD1      ILE 147  12.639   7.648   1.470
 1132   2HD1  ILE 147          2HD1      ILE 147  14.290   7.516   0.866
 1133   3HD1  ILE 147          3HD1      ILE 147  13.228   6.108   0.846
 1134    H    GLN 148           H        GLN 148   9.712   6.116  -3.178
 1135    HA   GLN 148           HA       GLN 148  10.389   7.870  -5.277
 1136   1HB   GLN 148          2HB       GLN 148  10.532   5.062  -5.943
 1137   2HB   GLN 148          1HB       GLN 148   9.292   5.871  -6.895
 1138   1HG   GLN 148          2HG       GLN 148  10.788   6.984  -8.114
 1139   2HG   GLN 148          1HG       GLN 148  11.771   7.384  -6.703
 1140   1HE2  GLN 148          1HE2      GLN 148  12.542   4.997  -5.757
 1141   2HE2  GLN 148          2HE2      GLN 148  13.497   4.146  -6.925
 1142    H    LEU 149           H        LEU 149   8.416   8.187  -6.772
 1143    HA   LEU 149           HA       LEU 149   5.919   7.636  -5.462
 1144   1HB   LEU 149          2HB       LEU 149   7.327  10.207  -5.137
 1145   2HB   LEU 149          1HB       LEU 149   5.656  10.349  -5.648
 1146    HG   LEU 149           HG       LEU 149   5.344  10.423  -3.394
 1147   1HD1  LEU 149          1HD1      LEU 149   5.399   7.508  -4.094
 1148   2HD1  LEU 149          2HD1      LEU 149   4.010   8.580  -3.926
 1149   3HD1  LEU 149          3HD1      LEU 149   4.909   8.073  -2.496
 1150   1HD2  LEU 149          1HD2      LEU 149   6.755   9.326  -1.739
 1151   2HD2  LEU 149          2HD2      LEU 149   7.722  10.297  -2.851
 1152   3HD2  LEU 149          3HD2      LEU 149   7.671   8.543  -3.027
 1153    H    VAL 150           H        VAL 150   4.411   7.458  -6.965
 1154    HA   VAL 150           HA       VAL 150   4.791   8.793  -9.562
 1155    HB   VAL 150           HB       VAL 150   3.602   6.053  -9.533
 1156   1HG1  VAL 150          1HG1      VAL 150   4.152   6.016 -11.770
 1157   2HG1  VAL 150          2HG1      VAL 150   5.494   7.143 -11.569
 1158   3HG1  VAL 150          3HG1      VAL 150   3.832   7.731 -11.511
 1159   1HG2  VAL 150          1HG2      VAL 150   6.094   6.396  -8.411
 1160   2HG2  VAL 150          2HG2      VAL 150   6.461   6.004 -10.090
 1161   3HG2  VAL 150          3HG2      VAL 150   5.477   4.905  -9.124
 1162    H    ALA 151           H        ALA 151   2.880   9.388 -10.615
 1163    HA   ALA 151           HA       ALA 151   0.784  10.247 -10.694
 1164   1HB   ALA 151          1HB       ALA 151  -1.021   8.761  -9.558
 1165   2HB   ALA 151          2HB       ALA 151   0.306   7.618  -9.345
 1166   3HB   ALA 151          3HB       ALA 151  -0.153   8.145 -10.964
 1167    H    SER 152           H        SER 152   2.541  11.135  -8.666
 1168    HA   SER 152           HA       SER 152   1.304  11.227  -6.109
 1169   1HB   SER 152          2HB       SER 152   3.125  13.399  -6.446
 1170   2HB   SER 152          1HB       SER 152   3.380  11.881  -5.581
 1171    HG   SER 152           HG       SER 152   4.843  11.652  -7.112
 1172    H    GLN 153           H        GLN 153   1.429  13.424  -8.856
 1173    HA   GLN 153           HA       GLN 153  -0.649  15.075  -7.567
 1174   1HB   GLN 153          2HB       GLN 153   0.383  16.598  -9.643
 1175   2HB   GLN 153          1HB       GLN 153   0.753  16.797  -7.936
 1176   1HG   GLN 153          2HG       GLN 153   2.839  16.707  -8.922
 1177   2HG   GLN 153          1HG       GLN 153   2.600  15.056  -8.351
 1178   1HE2  GLN 153          1HE2      GLN 153   3.644  16.850 -10.871
 1179   2HE2  GLN 153          2HE2      GLN 153   3.457  15.704 -12.150
 1180    H    ILE 154           H        ILE 154  -0.430  12.649  -9.501
 1181    HA   ILE 154           HA       ILE 154  -1.026  11.967 -11.610
 1182    HB   ILE 154           HB       ILE 154  -3.566  12.250 -11.927
 1183   1HG1  ILE 154          2HG1      ILE 154  -3.801  12.751  -9.033
 1184   2HG1  ILE 154          1HG1      ILE 154  -3.328  14.159  -9.982
 1185   1HG2  ILE 154          1HG2      ILE 154  -1.954  10.520 -10.443
 1186   2HG2  ILE 154          2HG2      ILE 154  -3.582  10.214 -11.055
 1187   3HG2  ILE 154          3HG2      ILE 154  -3.358  10.850  -9.426
 1188   1HD1  ILE 154          1HD1      ILE 154  -5.774  12.461 -10.418
 1189   2HD1  ILE 154          2HD1      ILE 154  -5.297  13.844 -11.404
 1190   3HD1  ILE 154          3HD1      ILE 154  -5.729  14.074  -9.709
 1191    H    ASP 155           H        ASP 155   0.274  14.306 -11.991
 1192    HA   ASP 155           HA       ASP 155  -1.327  15.905 -13.838
 1193   1HB   ASP 155          2HB       ASP 155   0.309  16.902 -12.156
 1194   2HB   ASP 155          1HB       ASP 155   1.597  16.242 -13.156
 1195    H    LEU 156           H        LEU 156   1.213  13.540 -13.767
 1196    HA   LEU 156           HA       LEU 156   2.007  13.793 -16.496
 1197   1HB   LEU 156          2HB       LEU 156   2.403  11.638 -14.431
 1198   2HB   LEU 156          1HB       LEU 156   3.036  11.507 -16.060
 1199    HG   LEU 156           HG       LEU 156   4.897  12.355 -15.103
 1200   1HD1  LEU 156          1HD1      LEU 156   3.501  15.007 -15.109
 1201   2HD1  LEU 156          2HD1      LEU 156   3.882  14.158 -16.608
 1202   3HD1  LEU 156          3HD1      LEU 156   5.177  14.634 -15.510
 1203   1HD2  LEU 156          1HD2      LEU 156   4.931  13.701 -13.057
 1204   2HD2  LEU 156          2HD2      LEU 156   4.031  12.199 -12.844
 1205   3HD2  LEU 156          3HD2      LEU 156   3.168  13.724 -13.051
 1206    H    GLU 157           H        GLU 157  -0.317  11.857 -14.743
 1207    HA   GLU 157           HA       GLU 157  -2.007  10.509 -15.354
 1208   1HB   GLU 157          2HB       GLU 157  -1.689  12.314 -17.667
 1209   2HB   GLU 157          1HB       GLU 157  -2.701  10.886 -17.886
 1210   1HG   GLU 157          2HG       GLU 157  -3.411  11.933 -15.412
 1211   2HG   GLU 157          1HG       GLU 157  -3.253  13.316 -16.486
 1212    H    HIS 158           H        HIS 158  -1.080   8.501 -15.176
 1213    HA   HIS 158           HA       HIS 158  -0.386   7.253 -17.735
 1214   1HB   HIS 158          2HB       HIS 158   1.264   7.376 -15.279
 1215   2HB   HIS 158          1HB       HIS 158   1.160   5.801 -16.059
 1216    HD1  HIS 158           1HD      HIS 158   1.085   8.813 -18.243
 1217    HD2  HIS 158           2HD      HIS 158   3.871   6.058 -16.840
 1218    HE1  HIS 158           1HE      HIS 158   3.148   9.159 -19.641
 1219    HE2  HIS 158           2HE      HIS 158   4.784   7.409 -18.852
  Start of MODEL    4
    1    H    MET   1           H        MET   1 -60.017   3.163 -68.027
    2    HA   MET   1           HA       MET   1 -58.505   4.911 -66.287
    3   1HB   MET   1          2HB       MET   1 -61.085   4.370 -66.267
    4   2HB   MET   1          1HB       MET   1 -60.584   3.010 -65.271
    5   1HG   MET   1          2HG       MET   1 -59.269   5.179 -64.165
    6   2HG   MET   1          1HG       MET   1 -60.860   5.804 -64.591
    7   1HE   MET   1          1HE       MET   1 -59.178   2.787 -62.158
    8   2HE   MET   1          2HE       MET   1 -59.714   3.921 -60.916
    9   3HE   MET   1          3HE       MET   1 -58.734   4.492 -62.266
   10    H    ALA   2           H        ALA   2 -58.822   1.542 -66.983
   11    HA   ALA   2           HA       ALA   2 -57.274  -0.112 -66.824
   12   1HB   ALA   2          1HB       ALA   2 -55.129   0.452 -65.434
   13   2HB   ALA   2          2HB       ALA   2 -55.699   2.110 -65.622
   14   3HB   ALA   2          3HB       ALA   2 -55.361   1.129 -67.047
   15    H    ASP   3           H        ASP   3 -59.406   0.575 -64.879
   16    HA   ASP   3           HA       ASP   3 -58.912  -1.518 -63.022
   17   1HB   ASP   3          2HB       ASP   3 -57.525   0.153 -61.916
   18   2HB   ASP   3          1HB       ASP   3 -58.844   1.319 -61.963
   19    H    LYS   4           H        LYS   4 -60.621   1.492 -62.428
   20    HA   LYS   4           HA       LYS   4 -62.772   1.939 -61.885
   21   1HB   LYS   4          2HB       LYS   4 -62.735   0.665 -64.439
   22   2HB   LYS   4          1HB       LYS   4 -64.207   0.199 -63.592
   23   1HG   LYS   4          2HG       LYS   4 -65.093   2.253 -63.738
   24   2HG   LYS   4          1HG       LYS   4 -63.547   3.053 -63.444
   25   1HD   LYS   4          2HD       LYS   4 -64.047   3.626 -65.642
   26   2HD   LYS   4          1HD       LYS   4 -62.932   2.266 -65.810
   27   1HE   LYS   4          2HE       LYS   4 -65.721   1.443 -65.607
   28   2HE   LYS   4          1HE       LYS   4 -65.414   2.485 -66.996
   29   1HZ   LYS   4          1HZ       LYS   4 -63.544   0.970 -67.566
   30   2HZ   LYS   4          2HZ       LYS   4 -65.077   0.248 -67.668
   31   3HZ   LYS   4          3HZ       LYS   4 -64.071  -0.083 -66.344
   32    H    MET   5           H        MET   5 -61.555  -0.021 -60.284
   33    HA   MET   5           HA       MET   5 -63.941  -1.480 -59.388
   34   1HB   MET   5          2HB       MET   5 -62.613  -3.123 -60.585
   35   2HB   MET   5          1HB       MET   5 -61.170  -2.654 -59.697
   36   1HG   MET   5          2HG       MET   5 -61.961  -3.605 -57.700
   37   2HG   MET   5          1HG       MET   5 -63.600  -3.756 -58.329
   38   1HE   MET   5          1HE       MET   5 -60.014  -6.379 -59.565
   39   2HE   MET   5          2HE       MET   5 -59.978  -5.150 -58.300
   40   3HE   MET   5          3HE       MET   5 -60.114  -4.671 -59.991
   41    H    ASP   6           H        ASP   6 -60.599  -0.574 -58.617
   42    HA   ASP   6           HA       ASP   6 -61.339  -0.289 -55.792
   43   1HB   ASP   6          2HB       ASP   6 -58.826  -0.778 -57.259
   44   2HB   ASP   6          1HB       ASP   6 -58.683   0.366 -55.925
   45    H    MET   7           H        MET   7 -60.343   1.450 -58.629
   46    HA   MET   7           HA       MET   7 -60.496   3.620 -59.239
   47   1HB   MET   7          2HB       MET   7 -62.520   3.340 -57.280
   48   2HB   MET   7          1HB       MET   7 -61.724   4.882 -56.994
   49   1HG   MET   7          2HG       MET   7 -63.559   5.238 -58.469
   50   2HG   MET   7          1HG       MET   7 -62.067   5.445 -59.381
   51   1HE   MET   7          1HE       MET   7 -65.371   4.455 -60.631
   52   2HE   MET   7          2HE       MET   7 -65.294   3.988 -58.931
   53   3HE   MET   7          3HE       MET   7 -65.518   2.758 -60.174
   54    H    SER   8           H        SER   8 -60.340   4.232 -55.749
   55    HA   SER   8           HA       SER   8 -58.035   5.941 -56.174
   56   1HB   SER   8          2HB       SER   8 -58.567   5.771 -53.424
   57   2HB   SER   8          1HB       SER   8 -59.075   7.055 -54.522
   58    HG   SER   8           HG       SER   8 -61.036   6.114 -54.757
   59    H    LEU   9           H        LEU   9 -57.101   3.647 -56.872
   60    HA   LEU   9           HA       LEU   9 -56.386   1.723 -55.004
   61   1HB   LEU   9          2HB       LEU   9 -55.681   2.398 -57.725
   62   2HB   LEU   9          1HB       LEU   9 -54.289   1.794 -56.846
   63    HG   LEU   9           HG       LEU   9 -56.899   0.305 -56.855
   64   1HD1  LEU   9          1HD1      LEU   9 -55.196   0.763 -59.096
   65   2HD1  LEU   9          2HD1      LEU   9 -56.652  -0.227 -58.990
   66   3HD1  LEU   9          3HD1      LEU   9 -55.080  -0.931 -58.614
   67   1HD2  LEU   9          1HD2      LEU   9 -54.258  -1.011 -56.723
   68   2HD2  LEU   9          2HD2      LEU   9 -55.759  -1.383 -55.873
   69   3HD2  LEU   9          3HD2      LEU   9 -54.737  -0.054 -55.322
   70    H    ASP  10           H        ASP  10 -54.582   4.601 -56.042
   71    HA   ASP  10           HA       ASP  10 -52.233   4.148 -54.600
   72   1HB   ASP  10          2HB       ASP  10 -52.478   5.926 -56.296
   73   2HB   ASP  10          1HB       ASP  10 -53.537   6.813 -55.204
   74    H    ASP  11           H        ASP  11 -55.174   5.869 -53.642
   75    HA   ASP  11           HA       ASP  11 -54.390   6.737 -51.119
   76   1HB   ASP  11          2HB       ASP  11 -56.586   7.157 -52.480
   77   2HB   ASP  11          1HB       ASP  11 -57.183   5.751 -51.603
   78    H    ILE  12           H        ILE  12 -55.840   3.682 -52.120
   79    HA   ILE  12           HA       ILE  12 -56.003   2.514 -49.552
   80    HB   ILE  12           HB       ILE  12 -55.690   1.092 -52.191
   81   1HG1  ILE  12          2HG1      ILE  12 -58.328   1.559 -50.848
   82   2HG1  ILE  12          1HG1      ILE  12 -57.619   2.854 -51.806
   83   1HG2  ILE  12          1HG2      ILE  12 -57.293  -0.057 -49.994
   84   2HG2  ILE  12          2HG2      ILE  12 -55.547  -0.002 -49.727
   85   3HG2  ILE  12          3HG2      ILE  12 -56.202  -0.843 -51.136
   86   1HD1  ILE  12          1HD1      ILE  12 -57.984   0.097 -52.915
   87   2HD1  ILE  12          2HD1      ILE  12 -57.751   1.618 -53.779
   88   3HD1  ILE  12          3HD1      ILE  12 -59.274   1.299 -52.950
   89    H    ILE  13           H        ILE  13 -53.623   2.126 -52.170
   90    HA   ILE  13           HA       ILE  13 -51.817   0.437 -50.942
   91    HB   ILE  13           HB       ILE  13 -51.230   2.760 -52.782
   92   1HG1  ILE  13          2HG1      ILE  13 -51.243  -0.173 -53.473
   93   2HG1  ILE  13          1HG1      ILE  13 -52.719   0.788 -53.526
   94   1HG2  ILE  13          1HG2      ILE  13 -49.045   2.109 -52.990
   95   2HG2  ILE  13          2HG2      ILE  13 -49.379   0.445 -52.506
   96   3HG2  ILE  13          3HG2      ILE  13 -49.322   1.724 -51.291
   97   1HD1  ILE  13          1HD1      ILE  13 -50.296   1.718 -54.992
   98   2HD1  ILE  13          2HD1      ILE  13 -51.999   2.033 -55.320
   99   3HD1  ILE  13          3HD1      ILE  13 -51.311   0.448 -55.673
  100    H    LYS  14           H        LYS  14 -51.875   3.983 -50.781
  101    HA   LYS  14           HA       LYS  14 -49.728   4.364 -49.041
  102   1HB   LYS  14          2HB       LYS  14 -52.304   5.929 -49.230
  103   2HB   LYS  14          1HB       LYS  14 -50.838   6.491 -48.439
  104   1HG   LYS  14          2HG       LYS  14 -51.032   5.798 -51.361
  105   2HG   LYS  14          1HG       LYS  14 -51.198   7.427 -50.706
  106   1HD   LYS  14          2HD       LYS  14 -48.912   7.078 -49.659
  107   2HD   LYS  14          1HD       LYS  14 -48.778   5.642 -50.679
  108   1HE   LYS  14          2HE       LYS  14 -47.850   7.974 -51.481
  109   2HE   LYS  14          1HE       LYS  14 -48.620   6.865 -52.612
  110   1HZ   LYS  14          1HZ       LYS  14 -49.347   9.279 -52.670
  111   2HZ   LYS  14          2HZ       LYS  14 -50.156   8.974 -51.215
  112   3HZ   LYS  14          3HZ       LYS  14 -50.578   8.114 -52.619
  113    H    LEU  15           H        LEU  15 -53.178   3.980 -48.293
  114    HA   LEU  15           HA       LEU  15 -52.934   4.102 -45.492
  115   1HB   LEU  15          2HB       LEU  15 -54.996   3.773 -47.375
  116   2HB   LEU  15          1HB       LEU  15 -55.090   2.378 -46.319
  117    HG   LEU  15           HG       LEU  15 -54.800   4.938 -44.909
  118   1HD1  LEU  15          1HD1      LEU  15 -57.415   4.350 -46.272
  119   2HD1  LEU  15          2HD1      LEU  15 -56.240   5.503 -46.902
  120   3HD1  LEU  15          3HD1      LEU  15 -56.974   5.769 -45.321
  121   1HD2  LEU  15          1HD2      LEU  15 -55.270   2.633 -43.951
  122   2HD2  LEU  15          2HD2      LEU  15 -56.896   2.805 -44.612
  123   3HD2  LEU  15          3HD2      LEU  15 -56.312   3.947 -43.402
  124    H    ASN  16           H        ASN  16 -52.589   1.506 -47.789
  125    HA   ASN  16           HA       ASN  16 -52.682  -0.673 -46.032
  126   1HB   ASN  16          2HB       ASN  16 -51.765  -0.186 -48.780
  127   2HB   ASN  16          1HB       ASN  16 -50.918  -1.494 -47.954
  128   1HD2  ASN  16          1HD2      ASN  16 -54.145  -0.253 -48.635
  129   2HD2  ASN  16          2HD2      ASN  16 -54.911  -1.813 -48.736
  130    H    ARG  17           H        ARG  17 -50.013   1.345 -47.142
  131    HA   ARG  17           HA       ARG  17 -47.974  -0.011 -45.699
  132   1HB   ARG  17          2HB       ARG  17 -48.119   2.795 -46.803
  133   2HB   ARG  17          1HB       ARG  17 -46.668   2.091 -46.106
  134   1HG   ARG  17          2HG       ARG  17 -46.228   0.869 -47.940
  135   2HG   ARG  17          1HG       ARG  17 -47.932   0.516 -48.240
  136   1HD   ARG  17          2HD       ARG  17 -46.590   2.051 -49.880
  137   2HD   ARG  17          1HD       ARG  17 -48.258   2.440 -49.457
  138    HE   ARG  17           HE       ARG  17 -46.802   3.802 -47.608
  139   1HH1  ARG  17          1HH1      ARG  17 -46.679   3.644 -51.113
  140   2HH1  ARG  17          2HH1      ARG  17 -46.166   5.299 -51.290
  141   1HH2  ARG  17          1HH2      ARG  17 -46.135   5.966 -47.840
  142   2HH2  ARG  17          2HH2      ARG  17 -45.872   6.625 -49.429
  143    H    ASN  18           H        ASN  18 -50.256   2.489 -44.919
  144    HA   ASN  18           HA       ASN  18 -48.990   3.397 -42.524
  145   1HB   ASN  18          2HB       ASN  18 -50.977   4.382 -44.067
  146   2HB   ASN  18          1HB       ASN  18 -51.933   3.642 -42.788
  147   1HD2  ASN  18          1HD2      ASN  18 -51.941   6.345 -43.264
  148   2HD2  ASN  18          2HD2      ASN  18 -51.210   7.165 -41.924
  149    H    GLN  19           H        GLN  19 -50.943   0.707 -43.353
  150    HA   GLN  19           HA       GLN  19 -51.594   0.134 -40.557
  151   1HB   GLN  19          2HB       GLN  19 -52.481  -1.164 -43.138
  152   2HB   GLN  19          1HB       GLN  19 -52.956  -1.722 -41.541
  153   1HG   GLN  19          2HG       GLN  19 -53.514   1.050 -41.691
  154   2HG   GLN  19          1HG       GLN  19 -54.144   0.283 -43.149
  155   1HE2  GLN  19          1HE2      GLN  19 -56.230  -0.034 -42.875
  156   2HE2  GLN  19          2HE2      GLN  19 -56.979  -0.710 -41.464
  157    H    ARG  20           H        ARG  20 -49.813  -1.117 -43.309
  158    HA   ARG  20           HA       ARG  20 -49.098  -3.575 -42.016
  159   1HB   ARG  20          2HB       ARG  20 -48.808  -2.370 -44.652
  160   2HB   ARG  20          1HB       ARG  20 -47.366  -3.243 -44.152
  161   1HG   ARG  20          2HG       ARG  20 -48.525  -4.909 -45.184
  162   2HG   ARG  20          1HG       ARG  20 -49.093  -5.109 -43.527
  163   1HD   ARG  20          2HD       ARG  20 -51.158  -4.126 -43.989
  164   2HD   ARG  20          1HD       ARG  20 -50.566  -3.351 -45.457
  165    HE   ARG  20           HE       ARG  20 -51.059  -5.256 -46.623
  166   1HH1  ARG  20          1HH1      ARG  20 -51.125  -5.978 -43.202
  167   2HH1  ARG  20          2HH1      ARG  20 -51.584  -7.636 -43.429
  168   1HH2  ARG  20          1HH2      ARG  20 -51.707  -7.408 -46.930
  169   2HH2  ARG  20          2HH2      ARG  20 -51.945  -8.449 -45.555
  170    H    ARG  21           H        ARG  21 -47.437  -3.963 -40.754
  171    HA   ARG  21           HA       ARG  21 -45.473  -3.822 -39.649
  172   1HB   ARG  21          2HB       ARG  21 -44.868  -2.756 -42.314
  173   2HB   ARG  21          1HB       ARG  21 -43.760  -2.214 -41.061
  174   1HG   ARG  21          2HG       ARG  21 -42.664  -4.111 -41.441
  175   2HG   ARG  21          1HG       ARG  21 -43.968  -4.898 -40.549
  176   1HD   ARG  21          2HD       ARG  21 -44.962  -4.598 -43.126
  177   2HD   ARG  21          1HD       ARG  21 -43.278  -5.063 -43.357
  178    HE   ARG  21           HE       ARG  21 -44.064  -6.861 -41.554
  179   1HH1  ARG  21          1HH1      ARG  21 -45.608  -5.771 -44.510
  180   2HH1  ARG  21          2HH1      ARG  21 -46.388  -7.297 -44.813
  181   1HH2  ARG  21          1HH2      ARG  21 -45.103  -8.849 -41.929
  182   2HH2  ARG  21          2HH2      ARG  21 -46.091  -9.059 -43.346
  183    H    VAL  22           H        VAL  22 -46.938  -2.464 -38.234
  184    HA   VAL  22           HA       VAL  22 -45.744   0.210 -37.917
  185    HB   VAL  22           HB       VAL  22 -47.794   0.790 -36.599
  186   1HG1  VAL  22          1HG1      VAL  22 -49.185   1.216 -38.536
  187   2HG1  VAL  22          2HG1      VAL  22 -48.300   0.007 -39.466
  188   3HG1  VAL  22          3HG1      VAL  22 -47.488   1.480 -38.935
  189   1HG2  VAL  22          1HG2      VAL  22 -49.232  -0.800 -36.020
  190   2HG2  VAL  22          2HG2      VAL  22 -48.339  -1.988 -36.972
  191   3HG2  VAL  22          3HG2      VAL  22 -49.627  -1.045 -37.722
  192    H    ASN  23           H        ASN  23 -45.894   0.941 -35.533
  193    HA   ASN  23           HA       ASN  23 -44.699  -1.170 -33.919
  194   1HB   ASN  23          2HB       ASN  23 -43.920   1.357 -34.167
  195   2HB   ASN  23          1HB       ASN  23 -45.084   1.600 -32.867
  196   1HD2  ASN  23          1HD2      ASN  23 -42.171  -0.100 -33.814
  197   2HD2  ASN  23          2HD2      ASN  23 -41.599  -0.410 -32.204
  198    H    ARG  24           H        ARG  24 -46.951  -2.148 -34.038
  199    HA   ARG  24           HA       ARG  24 -48.287  -1.638 -31.534
  200   1HB   ARG  24          2HB       ARG  24 -49.309  -0.523 -33.969
  201   2HB   ARG  24          1HB       ARG  24 -50.406  -1.783 -33.418
  202   1HG   ARG  24          2HG       ARG  24 -51.002  -0.642 -31.543
  203   2HG   ARG  24          1HG       ARG  24 -49.449   0.188 -31.420
  204   1HD   ARG  24          2HD       ARG  24 -51.042   1.833 -32.017
  205   2HD   ARG  24          1HD       ARG  24 -50.112   1.485 -33.475
  206    HE   ARG  24           HE       ARG  24 -52.829   0.458 -32.939
  207   1HH1  ARG  24          1HH1      ARG  24 -50.323   1.542 -35.145
  208   2HH1  ARG  24          2HH1      ARG  24 -51.308   1.329 -36.565
  209   1HH2  ARG  24          1HH2      ARG  24 -54.123   0.178 -34.800
  210   2HH2  ARG  24          2HH2      ARG  24 -53.462   0.546 -36.369
  211    H    GLY  25           H        GLY  25 -49.883  -3.311 -31.052
  212   1HA   GLY  25          2HA       GLY  25 -50.953  -5.384 -31.575
  213   2HA   GLY  25          1HA       GLY  25 -49.714  -5.680 -32.786
  214    H    GLY  26           H        GLY  26 -48.479  -4.438 -29.887
  215   1HA   GLY  26          2HA       GLY  26 -47.888  -5.696 -27.906
  216   2HA   GLY  26          1HA       GLY  26 -47.903  -7.157 -28.888
  217    H    GLY  27           H        GLY  27 -45.800  -6.634 -27.273
  218   1HA   GLY  27          2HA       GLY  27 -43.666  -6.190 -29.254
  219   2HA   GLY  27          1HA       GLY  27 -43.555  -5.473 -27.647
  220    HA   PRO  28           HA       PRO  28 -43.586 -10.190 -26.912
  221   1HB   PRO  28          2HB       PRO  28 -43.478 -11.894 -28.971
  222   2HB   PRO  28          1HB       PRO  28 -44.986 -11.076 -28.524
  223   1HG   PRO  28          2HG       PRO  28 -43.035 -10.377 -30.692
  224   2HG   PRO  28          1HG       PRO  28 -44.805 -10.473 -30.772
  225   1HD   PRO  28          2HD       PRO  28 -43.445  -8.131 -30.444
  226   2HD   PRO  28          1HD       PRO  28 -45.084  -8.401 -29.812
  227    H    ARG  29           H        ARG  29 -41.276  -8.413 -28.102
  228    HA   ARG  29           HA       ARG  29 -39.212 -10.467 -28.312
  229   1HB   ARG  29          2HB       ARG  29 -38.976  -7.452 -28.471
  230   2HB   ARG  29          1HB       ARG  29 -37.683  -8.601 -28.788
  231   1HG   ARG  29          2HG       ARG  29 -40.235  -8.383 -30.373
  232   2HG   ARG  29          1HG       ARG  29 -38.678  -7.702 -30.843
  233   1HD   ARG  29          2HD       ARG  29 -38.107  -9.638 -31.767
  234   2HD   ARG  29          1HD       ARG  29 -38.280 -10.438 -30.205
  235    HE   ARG  29           HE       ARG  29 -40.549 -10.067 -32.065
  236   1HH1  ARG  29          1HH1      ARG  29 -38.611 -12.081 -29.939
  237   2HH1  ARG  29          2HH1      ARG  29 -39.673 -13.456 -30.071
  238   1HH2  ARG  29          1HH2      ARG  29 -41.941 -11.874 -32.232
  239   2HH2  ARG  29          2HH2      ARG  29 -41.575 -13.329 -31.354
  240    H    ARG  30           H        ARG  30 -39.529  -7.420 -26.486
  241    HA   ARG  30           HA       ARG  30 -39.124  -8.782 -23.983
  242   1HB   ARG  30          2HB       ARG  30 -36.861  -7.674 -25.343
  243   2HB   ARG  30          1HB       ARG  30 -37.185  -6.701 -23.915
  244   1HG   ARG  30          2HG       ARG  30 -37.124  -9.669 -23.662
  245   2HG   ARG  30          1HG       ARG  30 -35.606  -8.780 -23.794
  246   1HD   ARG  30          2HD       ARG  30 -37.129  -7.368 -21.925
  247   2HD   ARG  30          1HD       ARG  30 -37.382  -9.068 -21.536
  248    HE   ARG  30           HE       ARG  30 -34.624  -8.228 -21.950
  249   1HH1  ARG  30          1HH1      ARG  30 -37.182  -8.966 -19.659
  250   2HH1  ARG  30          2HH1      ARG  30 -36.093  -9.151 -18.317
  251   1HH2  ARG  30          1HH2      ARG  30 -33.200  -8.451 -20.176
  252   2HH2  ARG  30          2HH2      ARG  30 -33.835  -8.853 -18.606
  253    H    ASN  31           H        ASN  31 -41.302  -7.797 -24.027
  254    HA   ASN  31           HA       ASN  31 -41.178  -5.003 -23.092
  255   1HB   ASN  31          2HB       ASN  31 -42.244  -5.022 -25.279
  256   2HB   ASN  31          1HB       ASN  31 -43.346  -6.294 -24.767
  257   1HD2  ASN  31          1HD2      ASN  31 -45.301  -5.476 -24.622
  258   2HD2  ASN  31          2HD2      ASN  31 -45.725  -3.970 -23.877
  259    H    ARG  32           H        ARG  32 -40.887  -6.056 -21.010
  260    HA   ARG  32           HA       ARG  32 -43.489  -6.540 -19.766
  261   1HB   ARG  32          2HB       ARG  32 -41.065  -8.290 -19.271
  262   2HB   ARG  32          1HB       ARG  32 -42.584  -8.380 -18.397
  263   1HG   ARG  32          2HG       ARG  32 -42.339  -8.865 -21.354
  264   2HG   ARG  32          1HG       ARG  32 -42.233 -10.138 -20.138
  265   1HD   ARG  32          2HD       ARG  32 -44.579  -8.417 -20.864
  266   2HD   ARG  32          1HD       ARG  32 -44.461 -10.174 -20.863
  267    HE   ARG  32           HE       ARG  32 -44.131  -9.647 -18.270
  268   1HH1  ARG  32          1HH1      ARG  32 -46.436  -8.423 -20.596
  269   2HH1  ARG  32          2HH1      ARG  32 -47.692  -8.156 -19.421
  270   1HH2  ARG  32          1HH2      ARG  32 -45.784  -9.304 -16.701
  271   2HH2  ARG  32          2HH2      ARG  32 -47.335  -8.688 -17.212
  272    HA   PRO  33           HA       PRO  33 -40.566  -3.671 -17.510
  273   1HB   PRO  33          2HB       PRO  33 -42.024  -1.418 -17.602
  274   2HB   PRO  33          1HB       PRO  33 -41.010  -1.920 -18.960
  275   1HG   PRO  33          2HG       PRO  33 -43.965  -2.202 -18.597
  276   2HG   PRO  33          1HG       PRO  33 -43.055  -1.735 -20.045
  277   1HD   PRO  33          2HD       PRO  33 -44.037  -4.260 -19.593
  278   2HD   PRO  33          1HD       PRO  33 -42.640  -3.908 -20.627
  279    H    ALA  34           H        ALA  34 -43.165  -5.339 -16.883
  280    HA   ALA  34           HA       ALA  34 -43.751  -4.029 -14.322
  281   1HB   ALA  34          1HB       ALA  34 -46.014  -5.468 -14.884
  282   2HB   ALA  34          2HB       ALA  34 -45.538  -4.863 -16.472
  283   3HB   ALA  34          3HB       ALA  34 -45.813  -3.734 -15.143
  284    H    ILE  35           H        ILE  35 -41.771  -5.970 -14.777
  285    HA   ILE  35           HA       ILE  35 -42.889  -8.335 -13.423
  286    HB   ILE  35           HB       ILE  35 -41.819  -8.909 -15.533
  287   1HG1  ILE  35          2HG1      ILE  35 -39.818 -10.286 -14.522
  288   2HG1  ILE  35          1HG1      ILE  35 -40.461  -9.708 -12.987
  289   1HG2  ILE  35          1HG2      ILE  35 -39.803  -8.152 -16.258
  290   2HG2  ILE  35          2HG2      ILE  35 -39.140  -8.021 -14.629
  291   3HG2  ILE  35          3HG2      ILE  35 -40.259  -6.793 -15.227
  292   1HD1  ILE  35          1HD1      ILE  35 -41.279 -11.947 -13.657
  293   2HD1  ILE  35          2HD1      ILE  35 -42.075 -11.196 -15.039
  294   3HD1  ILE  35          3HD1      ILE  35 -42.562 -10.765 -13.399
  295    H    ALA  36           H        ALA  36 -40.559  -5.791 -13.400
  296    HA   ALA  36           HA       ALA  36 -39.873  -6.435 -10.623
  297   1HB   ALA  36          1HB       ALA  36 -37.975  -6.715 -12.254
  298   2HB   ALA  36          2HB       ALA  36 -37.678  -5.561 -10.953
  299   3HB   ALA  36          3HB       ALA  36 -38.085  -4.983 -12.569
  300    H    ARG  37           H        ARG  37 -39.052  -4.326  -9.536
  301    HA   ARG  37           HA       ARG  37 -40.722  -2.067 -10.384
  302   1HB   ARG  37          2HB       ARG  37 -41.749  -1.812  -8.281
  303   2HB   ARG  37          1HB       ARG  37 -41.857  -3.532  -8.630
  304   1HG   ARG  37          2HG       ARG  37 -39.578  -2.482  -7.008
  305   2HG   ARG  37          1HG       ARG  37 -41.159  -2.731  -6.264
  306   1HD   ARG  37          2HD       ARG  37 -40.836  -5.063  -7.616
  307   2HD   ARG  37          1HD       ARG  37 -39.169  -4.687  -7.186
  308    HE   ARG  37           HE       ARG  37 -40.074  -4.465  -4.830
  309   1HH1  ARG  37          1HH1      ARG  37 -41.485  -6.584  -7.235
  310   2HH1  ARG  37          2HH1      ARG  37 -42.174  -7.670  -6.064
  311   1HH2  ARG  37          1HH2      ARG  37 -40.947  -5.908  -3.283
  312   2HH2  ARG  37          2HH2      ARG  37 -41.866  -7.284  -3.812
  313    H    GLY  38           H        GLY  38 -40.151  -0.030  -9.325
  314   1HA   GLY  38          2HA       GLY  38 -38.463   1.044  -7.836
  315   2HA   GLY  38          1HA       GLY  38 -37.283  -0.007  -8.607
  316    H    GLY  39           H        GLY  39 -37.187   2.836  -8.482
  317   1HA   GLY  39          2HA       GLY  39 -37.234   3.399 -11.378
  318   2HA   GLY  39          1HA       GLY  39 -37.720   4.610 -10.199
  319    H    ARG  40           H        ARG  40 -34.993   2.471 -10.991
  320    HA   ARG  40           HA       ARG  40 -33.187   4.625 -10.114
  321   1HB   ARG  40          2HB       ARG  40 -31.723   2.422  -9.519
  322   2HB   ARG  40          1HB       ARG  40 -32.697   3.303  -8.351
  323   1HG   ARG  40          2HG       ARG  40 -33.961   1.522  -7.991
  324   2HG   ARG  40          1HG       ARG  40 -34.328   1.381  -9.711
  325   1HD   ARG  40          2HD       ARG  40 -31.655   0.471  -8.803
  326   2HD   ARG  40          1HD       ARG  40 -33.042  -0.520  -8.356
  327    HE   ARG  40           HE       ARG  40 -31.998  -0.056 -11.041
  328   1HH1  ARG  40          1HH1      ARG  40 -34.529  -1.426  -9.030
  329   2HH1  ARG  40          2HH1      ARG  40 -35.114  -2.483 -10.283
  330   1HH2  ARG  40          1HH2      ARG  40 -32.773  -1.470 -12.676
  331   2HH2  ARG  40          2HH2      ARG  40 -34.096  -2.540 -12.323
  332    H    ASN  41           H        ASN  41 -31.683   5.146 -11.531
  333    HA   ASN  41           HA       ASN  41 -31.314   3.545 -13.923
  334   1HB   ASN  41          2HB       ASN  41 -31.446   6.023 -14.042
  335   2HB   ASN  41          1HB       ASN  41 -29.957   6.120 -13.107
  336   1HD2  ASN  41          1HD2      ASN  41 -31.347   4.957 -16.121
  337   2HD2  ASN  41          2HD2      ASN  41 -29.870   5.016 -17.029
  338    H    ARG  42           H        ARG  42 -28.844   5.154 -11.968
  339    HA   ARG  42           HA       ARG  42 -27.579   2.814 -11.082
  340   1HB   ARG  42          2HB       ARG  42 -26.938   2.278 -13.272
  341   2HB   ARG  42          1HB       ARG  42 -26.584   3.949 -13.680
  342   1HG   ARG  42          2HG       ARG  42 -24.737   3.689 -11.839
  343   2HG   ARG  42          1HG       ARG  42 -24.949   1.967 -12.162
  344   1HD   ARG  42          2HD       ARG  42 -23.256   2.536 -13.628
  345   2HD   ARG  42          1HD       ARG  42 -24.689   2.659 -14.647
  346    HE   ARG  42           HE       ARG  42 -24.347   4.917 -14.829
  347   1HH1  ARG  42          1HH1      ARG  42 -22.357   3.675 -12.217
  348   2HH1  ARG  42          2HH1      ARG  42 -21.499   5.167 -11.986
  349   1HH2  ARG  42          1HH2      ARG  42 -23.197   6.868 -14.550
  350   2HH2  ARG  42          2HH2      ARG  42 -21.969   6.983 -13.325
  351    HA   PRO  43           HA       PRO  43 -24.700   6.629 -10.221
  352   1HB   PRO  43          2HB       PRO  43 -26.237   8.904 -11.286
  353   2HB   PRO  43          1HB       PRO  43 -24.515   8.546 -11.438
  354   1HG   PRO  43          2HG       PRO  43 -26.194   8.321 -13.519
  355   2HG   PRO  43          1HG       PRO  43 -24.817   7.224 -13.301
  356   1HD   PRO  43          2HD       PRO  43 -27.719   6.766 -12.728
  357   2HD   PRO  43          1HD       PRO  43 -26.520   5.663 -13.436
  358    H    ALA  44           H        ALA  44 -28.139   7.402 -10.502
  359    HA   ALA  44           HA       ALA  44 -28.171   8.353  -7.739
  360   1HB   ALA  44          1HB       ALA  44 -29.792   8.851 -10.141
  361   2HB   ALA  44          2HB       ALA  44 -29.402   9.917  -8.791
  362   3HB   ALA  44          3HB       ALA  44 -30.700   8.734  -8.633
  363    HA   PRO  45           HA       PRO  45 -29.838   4.411  -6.324
  364   1HB   PRO  45          2HB       PRO  45 -30.773   6.230  -4.155
  365   2HB   PRO  45          1HB       PRO  45 -29.904   4.693  -4.034
  366   1HG   PRO  45          2HG       PRO  45 -28.634   6.981  -3.611
  367   2HG   PRO  45          1HG       PRO  45 -27.851   5.676  -4.525
  368   1HD   PRO  45          2HD       PRO  45 -29.125   8.192  -5.524
  369   2HD   PRO  45          1HD       PRO  45 -27.645   7.381  -6.077
  370    H    TYR  46           H        TYR  46 -31.575   7.464  -6.345
  371    HA   TYR  46           HA       TYR  46 -33.964   6.112  -7.313
  372   1HB   TYR  46          2HB       TYR  46 -33.848   6.701  -4.674
  373   2HB   TYR  46          1HB       TYR  46 -34.463   8.229  -5.286
  374    HD1  TYR  46           1HD      TYR  46 -35.717   6.158  -7.618
  375    HD2  TYR  46           2HD      TYR  46 -36.155   6.877  -3.447
  376    HE1  TYR  46           1HE      TYR  46 -37.984   5.211  -7.698
  377    HE2  TYR  46           2HE      TYR  46 -38.423   5.930  -3.517
  378    HH   TYR  46           HH       TYR  46 -40.247   5.666  -5.361
  379    H    SER  47           H        SER  47 -35.211   8.941  -6.669
  380    HA   SER  47           HA       SER  47 -34.766  10.093  -9.203
  381   1HB   SER  47          2HB       SER  47 -35.711  12.079  -7.413
  382   2HB   SER  47          1HB       SER  47 -36.655  11.115  -8.554
  383    HG   SER  47           HG       SER  47 -37.338   9.887  -6.970
  384    H    ARG  48           H        ARG  48 -33.367  10.636  -6.032
  385    HA   ARG  48           HA       ARG  48 -31.252  12.234  -7.256
  386   1HB   ARG  48          2HB       ARG  48 -32.689  13.954  -6.457
  387   2HB   ARG  48          1HB       ARG  48 -33.010  13.094  -4.959
  388   1HG   ARG  48          2HG       ARG  48 -31.394  14.236  -3.977
  389   2HG   ARG  48          1HG       ARG  48 -30.223  13.527  -5.089
  390   1HD   ARG  48          2HD       ARG  48 -29.925  15.793  -5.438
  391   2HD   ARG  48          1HD       ARG  48 -31.046  15.357  -6.727
  392    HE   ARG  48           HE       ARG  48 -32.718  16.566  -5.679
  393   1HH1  ARG  48          1HH1      ARG  48 -29.865  16.420  -3.637
  394   2HH1  ARG  48          2HH1      ARG  48 -30.419  17.678  -2.573
  395   1HH2  ARG  48          1HH2      ARG  48 -33.449  18.200  -4.248
  396   2HH2  ARG  48          2HH2      ARG  48 -32.435  18.684  -2.915
  397    HA   PRO  49           HA       PRO  49 -28.821   9.501  -4.649
  398   1HB   PRO  49          2HB       PRO  49 -26.698  11.489  -5.151
  399   2HB   PRO  49          1HB       PRO  49 -26.719   9.759  -5.499
  400   1HG   PRO  49          2HG       PRO  49 -26.903  11.593  -7.447
  401   2HG   PRO  49          1HG       PRO  49 -27.762  10.046  -7.532
  402   1HD   PRO  49          2HD       PRO  49 -28.812  12.760  -6.854
  403   2HD   PRO  49          1HD       PRO  49 -29.568  11.455  -7.790
  404    H    LYS  50           H        LYS  50 -28.208   9.548  -2.518
  405    HA   LYS  50           HA       LYS  50 -28.439  12.146  -1.174
  406   1HB   LYS  50          2HB       LYS  50 -28.733  10.669   0.916
  407   2HB   LYS  50          1HB       LYS  50 -30.074  10.783  -0.211
  408   1HG   LYS  50          2HG       LYS  50 -29.090   8.625  -1.237
  409   2HG   LYS  50          1HG       LYS  50 -28.226   8.491   0.296
  410   1HD   LYS  50          2HD       LYS  50 -31.201   8.913   0.170
  411   2HD   LYS  50          1HD       LYS  50 -30.481   7.302   0.111
  412   1HE   LYS  50          2HE       LYS  50 -30.405   7.305   2.334
  413   2HE   LYS  50          1HE       LYS  50 -29.247   8.634   2.256
  414   1HZ   LYS  50          1HZ       LYS  50 -30.919  10.206   2.537
  415   2HZ   LYS  50          2HZ       LYS  50 -31.351   8.974   3.618
  416   3HZ   LYS  50          3HZ       LYS  50 -32.159   9.122   2.134
  417    HA   PRO  51           HA       PRO  51 -24.094  11.869  -0.339
  418   1HB   PRO  51          2HB       PRO  51 -23.943  13.828   1.526
  419   2HB   PRO  51          1HB       PRO  51 -24.144  14.164  -0.197
  420   1HG   PRO  51          2HG       PRO  51 -26.201  14.118   1.978
  421   2HG   PRO  51          1HG       PRO  51 -26.000  15.278   0.651
  422   1HD   PRO  51          2HD       PRO  51 -27.832  13.278   0.591
  423   2HD   PRO  51          1HD       PRO  51 -27.047  13.908  -0.872
  424    H    LEU  52           H        LEU  52 -26.569  11.095   1.791
  425    HA   LEU  52           HA       LEU  52 -24.686   9.772   3.605
  426   1HB   LEU  52          2HB       LEU  52 -26.564  10.255   5.368
  427   2HB   LEU  52          1HB       LEU  52 -25.345  11.465   5.010
  428    HG   LEU  52           HG       LEU  52 -27.507  11.858   3.209
  429   1HD1  LEU  52          1HD1      LEU  52 -29.217  12.487   4.992
  430   2HD1  LEU  52          2HD1      LEU  52 -28.307  11.428   6.071
  431   3HD1  LEU  52          3HD1      LEU  52 -29.043  10.774   4.607
  432   1HD2  LEU  52          1HD2      LEU  52 -27.604  14.050   4.330
  433   2HD2  LEU  52          2HD2      LEU  52 -25.956  13.578   3.917
  434   3HD2  LEU  52          3HD2      LEU  52 -26.521  13.440   5.582
  435    HA   PRO  53           HA       PRO  53 -28.023   7.006   1.813
  436   1HB   PRO  53          2HB       PRO  53 -26.297   5.042   0.973
  437   2HB   PRO  53          1HB       PRO  53 -26.875   6.365  -0.044
  438   1HG   PRO  53          2HG       PRO  53 -24.265   6.033   1.334
  439   2HG   PRO  53          1HG       PRO  53 -24.631   6.807  -0.215
  440   1HD   PRO  53          2HD       PRO  53 -24.129   8.174   2.108
  441   2HD   PRO  53          1HD       PRO  53 -25.094   8.821   0.767
  442    H    ASP  54           H        ASP  54 -25.005   5.725   3.241
  443    HA   ASP  54           HA       ASP  54 -24.607   4.277   4.943
  444   1HB   ASP  54          2HB       ASP  54 -25.903   6.268   6.066
  445   2HB   ASP  54          1HB       ASP  54 -27.179   5.069   6.260
  446    H    LYS  55           H        LYS  55 -25.999   3.249   2.704
  447    HA   LYS  55           HA       LYS  55 -27.816   1.288   3.922
  448   1HB   LYS  55          2HB       LYS  55 -28.201   2.878   1.696
  449   2HB   LYS  55          1HB       LYS  55 -27.720   1.337   0.999
  450   1HG   LYS  55          2HG       LYS  55 -29.863   1.485   3.085
  451   2HG   LYS  55          1HG       LYS  55 -30.217   1.786   1.383
  452   1HD   LYS  55          2HD       LYS  55 -28.675  -0.561   1.455
  453   2HD   LYS  55          1HD       LYS  55 -29.857  -0.715   2.756
  454   1HE   LYS  55          2HE       LYS  55 -31.277   0.327   0.591
  455   2HE   LYS  55          1HE       LYS  55 -30.225  -0.908  -0.098
  456   1HZ   LYS  55          1HZ       LYS  55 -31.087  -2.482   1.556
  457   2HZ   LYS  55          2HZ       LYS  55 -32.320  -1.867   0.561
  458   3HZ   LYS  55          3HZ       LYS  55 -32.143  -1.285   2.142
  459    H    TRP  56           H        TRP  56 -26.609  -0.363   4.552
  460    HA   TRP  56           HA       TRP  56 -24.380  -1.380   3.147
  461   1HB   TRP  56          2HB       TRP  56 -25.238  -3.453   4.764
  462   2HB   TRP  56          1HB       TRP  56 -24.068  -2.216   5.201
  463    HD1  TRP  56           HD       TRP  56 -24.607  -1.566   7.615
  464    HE1  TRP  56           1HE      TRP  56 -26.722  -0.923   8.939
  465    HE3  TRP  56           3HE      TRP  56 -28.049  -2.340   3.964
  466    HZ2  TRP  56           2HZ      TRP  56 -29.516  -0.773   8.468
  467    HZ3  TRP  56           3HZ      TRP  56 -30.439  -1.935   4.464
  468    HH2  TRP  56           HH       TRP  56 -31.149  -1.162   6.671
  469    H    GLN  57           H        GLN  57 -25.791  -1.294   1.105
  470    HA   GLN  57           HA       GLN  57 -27.337  -3.700   0.626
  471   1HB   GLN  57          2HB       GLN  57 -28.022  -1.620  -0.452
  472   2HB   GLN  57          1HB       GLN  57 -26.443  -1.461  -1.207
  473   1HG   GLN  57          2HG       GLN  57 -27.766  -2.263  -2.919
  474   2HG   GLN  57          1HG       GLN  57 -26.980  -3.720  -2.311
  475   1HE2  GLN  57          1HE2      GLN  57 -28.490  -5.209  -2.826
  476   2HE2  GLN  57          2HE2      GLN  57 -30.105  -5.217  -2.190
  477    H    HIS  58           H        HIS  58 -24.275  -2.281  -0.373
  478    HA   HIS  58           HA       HIS  58 -22.903  -4.738  -0.546
  479   1HB   HIS  58          2HB       HIS  58 -24.225  -3.776  -2.994
  480   2HB   HIS  58          1HB       HIS  58 -22.499  -4.067  -3.187
  481    HD1  HIS  58           1HD      HIS  58 -24.919  -5.767  -4.428
  482    HD2  HIS  58           2HD      HIS  58 -22.550  -6.800  -1.167
  483    HE1  HIS  58           1HE      HIS  58 -25.068  -8.273  -4.243
  484    HE2  HIS  58           2HE      HIS  58 -23.729  -8.865  -2.191
  485    H    ASP  59           H        ASP  59 -20.972  -3.865  -2.514
  486    HA   ASP  59           HA       ASP  59 -19.715  -1.765  -0.954
  487   1HB   ASP  59          2HB       ASP  59 -18.777  -3.913  -2.576
  488   2HB   ASP  59          1HB       ASP  59 -18.175  -2.411  -3.271
  489    H    LEU  60           H        LEU  60 -20.879  -2.303  -4.239
  490    HA   LEU  60           HA       LEU  60 -21.637  -0.916  -5.860
  491   1HB   LEU  60          2HB       LEU  60 -21.931   0.830  -3.446
  492   2HB   LEU  60          1HB       LEU  60 -22.245   1.486  -5.042
  493    HG   LEU  60           HG       LEU  60 -23.666  -0.950  -4.887
  494   1HD1  LEU  60          1HD1      LEU  60 -23.277  -0.481  -2.362
  495   2HD1  LEU  60          2HD1      LEU  60 -24.889  -0.919  -2.930
  496   3HD1  LEU  60          3HD1      LEU  60 -24.500   0.769  -2.591
  497   1HD2  LEU  60          1HD2      LEU  60 -24.522   1.936  -4.784
  498   2HD2  LEU  60          2HD2      LEU  60 -25.624   0.580  -5.023
  499   3HD2  LEU  60          3HD2      LEU  60 -24.366   0.916  -6.214
  500    H    PHE  61           H        PHE  61 -20.103   1.735  -4.111
  501    HA   PHE  61           HA       PHE  61 -18.386   2.334  -6.351
  502   1HB   PHE  61          2HB       PHE  61 -19.488   3.917  -4.501
  503   2HB   PHE  61          1HB       PHE  61 -17.967   3.594  -3.677
  504    HD1  PHE  61           1HD      PHE  61 -16.217   5.023  -4.052
  505    HD2  PHE  61           2HD      PHE  61 -19.210   4.604  -7.048
  506    HE1  PHE  61           1HE      PHE  61 -15.120   6.772  -5.389
  507    HE2  PHE  61           2HE      PHE  61 -18.117   6.352  -8.389
  508    HZ   PHE  61           HZ       PHE  61 -16.069   7.438  -7.560
  509    H    ASP  62           H        ASP  62 -18.328   0.068  -4.063
  510    HA   ASP  62           HA       ASP  62 -16.813  -1.459  -3.378
  511   1HB   ASP  62          2HB       ASP  62 -15.569  -0.297  -5.694
  512   2HB   ASP  62          1HB       ASP  62 -14.349  -0.658  -4.483
  513    H    SER  63           H        SER  63 -13.981  -0.963  -2.979
  514    HA   SER  63           HA       SER  63 -14.194   0.818  -0.647
  515   1HB   SER  63          2HB       SER  63 -11.865  -0.920  -0.652
  516   2HB   SER  63          1HB       SER  63 -13.129  -0.747   0.566
  517    HG   SER  63           HG       SER  63 -14.416  -2.053  -1.080
  518    H    GLY  64           H        GLY  64 -13.878   2.362  -2.602
  519   1HA   GLY  64          2HA       GLY  64 -12.468   4.055  -3.320
  520   2HA   GLY  64          1HA       GLY  64 -11.126   3.234  -2.536
  521    H    CYS  65           H        CYS  65 -12.832   1.094  -4.456
  522    HA   CYS  65           HA       CYS  65 -10.795   1.285  -6.541
  523   1HB   CYS  65          2HB       CYS  65 -12.575  -0.970  -6.832
  524   2HB   CYS  65          1HB       CYS  65 -10.833  -0.952  -6.579
  525    HG   CYS  65           HG       CYS  65 -12.903  -2.242  -4.634
  526    H    GLY  66           H        GLY  66 -12.959  -0.405  -8.130
  527   1HA   GLY  66          2HA       GLY  66 -14.500   0.072  -9.783
  528   2HA   GLY  66          1HA       GLY  66 -14.800   1.619  -8.997
  529    H    GLY  67           H        GLY  67 -13.078   3.269  -9.265
  530   1HA   GLY  67          2HA       GLY  67 -11.947   3.182 -11.971
  531   2HA   GLY  67          1HA       GLY  67 -12.128   4.620 -10.969
  532    H    GLY  68           H        GLY  68 -10.318   1.638 -11.373
  533   1HA   GLY  68          2HA       GLY  68  -7.793   2.412 -11.011
  534   2HA   GLY  68          1HA       GLY  68  -8.377   2.404  -9.350
  535    H    GLU  69           H        GLU  69  -6.655   0.656 -11.394
  536    HA   GLU  69           HA       GLU  69  -7.882  -1.935 -10.753
  537   1HB   GLU  69          2HB       GLU  69  -6.577  -0.884 -13.054
  538   2HB   GLU  69          1HB       GLU  69  -5.600  -2.212 -12.439
  539   1HG   GLU  69          2HG       GLU  69  -6.974  -3.404 -13.767
  540   2HG   GLU  69          1HG       GLU  69  -7.977  -3.384 -12.319
  541    H    GLY  70           H        GLY  70  -5.875   0.032  -9.254
  542   1HA   GLY  70          2HA       GLY  70  -4.519  -0.491  -7.418
  543   2HA   GLY  70          1HA       GLY  70  -4.410  -2.149  -7.996
  544    H    VAL  71           H        VAL  71  -3.864  -0.376 -10.643
  545    HA   VAL  71           HA       VAL  71  -0.988  -0.611 -10.321
  546    HB   VAL  71           HB       VAL  71  -1.907  -1.843 -12.197
  547   1HG1  VAL  71          1HG1      VAL  71  -3.436  -1.084 -13.634
  548   2HG1  VAL  71          2HG1      VAL  71  -2.613   0.461 -13.843
  549   3HG1  VAL  71          3HG1      VAL  71  -3.687   0.213 -12.466
  550   1HG2  VAL  71          1HG2      VAL  71   0.171   0.066 -12.366
  551   2HG2  VAL  71          2HG2      VAL  71  -0.663   0.042 -13.919
  552   3HG2  VAL  71          3HG2      VAL  71  -0.004  -1.452 -13.251
  553    H    GLU  72           H        GLU  72  -3.476   1.654 -11.197
  554    HA   GLU  72           HA       GLU  72  -1.511   3.842 -11.135
  555   1HB   GLU  72          2HB       GLU  72  -4.029   4.892 -11.818
  556   2HB   GLU  72          1HB       GLU  72  -2.656   4.647 -12.888
  557   1HG   GLU  72          2HG       GLU  72  -4.403   3.574 -13.971
  558   2HG   GLU  72          1HG       GLU  72  -3.547   2.259 -13.166
  559    H    THR  73           H        THR  73  -4.945   3.909 -10.438
  560    HA   THR  73           HA       THR  73  -6.116   4.717  -8.644
  561    HB   THR  73           HB       THR  73  -4.652   2.808  -6.917
  562    HG1  THR  73           1HG      THR  73  -5.351   2.253  -9.505
  563   1HG2  THR  73          1HG2      THR  73  -7.559   2.797  -7.673
  564   2HG2  THR  73          2HG2      THR  73  -6.930   3.956  -6.501
  565   3HG2  THR  73          3HG2      THR  73  -6.797   2.225  -6.188
  566    H    GLY  74           H        GLY  74  -4.479   6.706  -8.808
  567   1HA   GLY  74          2HA       GLY  74  -4.138   8.500  -7.379
  568   2HA   GLY  74          1HA       GLY  74  -4.249   7.408  -6.013
  569    H    ALA  75           H        ALA  75  -2.373   6.403  -5.228
  570    HA   ALA  75           HA       ALA  75   0.026   7.919  -6.025
  571   1HB   ALA  75          1HB       ALA  75  -1.306   8.453  -3.839
  572   2HB   ALA  75          2HB       ALA  75   0.459   8.441  -3.836
  573   3HB   ALA  75          3HB       ALA  75  -0.433   7.049  -3.216
  574    H    LYS  76           H        LYS  76   1.545   6.625  -6.814
  575    HA   LYS  76           HA       LYS  76   1.858   3.926  -5.717
  576   1HB   LYS  76          2HB       LYS  76   1.878   3.644  -7.981
  577   2HB   LYS  76          1HB       LYS  76   2.496   5.259  -8.286
  578   1HG   LYS  76          2HG       LYS  76   4.735   4.502  -7.585
  579   2HG   LYS  76          1HG       LYS  76   4.091   2.871  -7.379
  580   1HD   LYS  76          2HD       LYS  76   3.950   4.407  -9.966
  581   2HD   LYS  76          1HD       LYS  76   5.256   3.288  -9.564
  582   1HE   LYS  76          2HE       LYS  76   2.391   2.429  -9.414
  583   2HE   LYS  76          1HE       LYS  76   3.254   2.427 -10.951
  584   1HZ   LYS  76          1HZ       LYS  76   3.391   0.278  -9.906
  585   2HZ   LYS  76          2HZ       LYS  76   4.043   0.955  -8.493
  586   3HZ   LYS  76          3HZ       LYS  76   4.932   0.987  -9.940
  587    H    LEU  77           H        LEU  77   3.314   3.573  -4.225
  588    HA   LEU  77           HA       LEU  77   5.642   5.361  -3.950
  589   1HB   LEU  77          2HB       LEU  77   4.320   5.397  -1.989
  590   2HB   LEU  77          1HB       LEU  77   4.001   3.686  -2.063
  591    HG   LEU  77           HG       LEU  77   5.406   4.390  -0.147
  592   1HD1  LEU  77          1HD1      LEU  77   6.828   2.565  -0.124
  593   2HD1  LEU  77          2HD1      LEU  77   7.028   2.577  -1.877
  594   3HD1  LEU  77          3HD1      LEU  77   5.490   2.086  -1.169
  595   1HD2  LEU  77          1HD2      LEU  77   7.530   4.939  -2.211
  596   2HD2  LEU  77          2HD2      LEU  77   7.715   5.023  -0.459
  597   3HD2  LEU  77          3HD2      LEU  77   6.662   6.168  -1.291
  598    H    LEU  78           H        LEU  78   7.617   4.458  -4.561
  599    HA   LEU  78           HA       LEU  78   7.821   1.566  -4.051
  600   1HB   LEU  78          2HB       LEU  78   9.815   1.591  -5.566
  601   2HB   LEU  78          1HB       LEU  78   8.264   1.846  -6.335
  602    HG   LEU  78           HG       LEU  78   8.993   4.410  -6.004
  603   1HD1  LEU  78          1HD1      LEU  78  11.612   3.092  -6.647
  604   2HD1  LEU  78          2HD1      LEU  78  11.181   3.470  -4.979
  605   3HD1  LEU  78          3HD1      LEU  78  11.292   4.762  -6.176
  606   1HD2  LEU  78          1HD2      LEU  78   9.432   2.399  -8.148
  607   2HD2  LEU  78          2HD2      LEU  78  10.114   4.012  -8.355
  608   3HD2  LEU  78          3HD2      LEU  78   8.378   3.812  -8.123
  609    H    VAL  79           H        VAL  79  10.200   0.929  -3.548
  610    HA   VAL  79           HA       VAL  79  11.454   2.615  -1.612
  611    HB   VAL  79           HB       VAL  79  10.908   0.794   0.240
  612   1HG1  VAL  79          1HG1      VAL  79   9.561   3.322  -0.462
  613   2HG1  VAL  79          2HG1      VAL  79  10.436   2.865   0.999
  614   3HG1  VAL  79          3HG1      VAL  79   8.778   2.311   0.754
  615   1HG2  VAL  79          1HG2      VAL  79   8.157   0.787  -0.405
  616   2HG2  VAL  79          2HG2      VAL  79   9.248  -0.587  -0.225
  617   3HG2  VAL  79          3HG2      VAL  79   9.045   0.179  -1.801
  618    H    SER  80           H        SER  80  13.463   1.974  -2.353
  619    HA   SER  80           HA       SER  80  13.993  -0.916  -2.142
  620   1HB   SER  80          2HB       SER  80  15.567   0.499  -4.179
  621   2HB   SER  80          1HB       SER  80  14.772  -1.079  -4.246
  622    HG   SER  80           HG       SER  80  13.218   1.266  -4.239
  623    H    ASN  81           H        ASN  81  15.446  -1.329  -0.663
  624    HA   ASN  81           HA       ASN  81  17.731   0.391  -0.199
  625   1HB   ASN  81          2HB       ASN  81  17.311  -0.789   1.746
  626   2HB   ASN  81          1HB       ASN  81  16.714  -2.201   0.884
  627   1HD2  ASN  81          1HD2      ASN  81  18.017  -3.902   0.670
  628   2HD2  ASN  81          2HD2      ASN  81  19.708  -3.919   1.049
  629    H    LEU  82           H        LEU  82  16.763  -2.309  -2.106
  630    HA   LEU  82           HA       LEU  82  19.379  -2.327  -3.441
  631   1HB   LEU  82          2HB       LEU  82  18.225  -4.452  -2.123
  632   2HB   LEU  82          1HB       LEU  82  17.757  -4.732  -3.788
  633    HG   LEU  82           HG       LEU  82  19.852  -5.891  -3.108
  634   1HD1  LEU  82          1HD1      LEU  82  19.334  -4.365  -5.452
  635   2HD1  LEU  82          2HD1      LEU  82  20.249  -5.863  -5.285
  636   3HD1  LEU  82          3HD1      LEU  82  21.064  -4.310  -5.111
  637   1HD2  LEU  82          1HD2      LEU  82  21.704  -3.798  -3.357
  638   2HD2  LEU  82          2HD2      LEU  82  21.368  -4.783  -1.933
  639   3HD2  LEU  82          3HD2      LEU  82  20.506  -3.265  -2.177
  640    H    ASP  83           H        ASP  83  16.635  -4.180  -4.569
  641    HA   ASP  83           HA       ASP  83  15.914  -2.175  -6.518
  642   1HB   ASP  83          2HB       ASP  83  16.687  -3.191  -8.450
  643   2HB   ASP  83          1HB       ASP  83  18.016  -3.439  -7.325
  644    H    PHE  84           H        PHE  84  15.295  -5.371  -5.115
  645    HA   PHE  84           HA       PHE  84  12.546  -4.983  -5.231
  646   1HB   PHE  84          2HB       PHE  84  11.736  -6.383  -6.943
  647   2HB   PHE  84          1HB       PHE  84  12.994  -5.423  -7.694
  648    HD1  PHE  84           1HD      PHE  84  11.613  -8.360  -8.163
  649    HD2  PHE  84           2HD      PHE  84  15.410  -6.870  -6.959
  650    HE1  PHE  84           1HE      PHE  84  12.678 -10.414  -8.992
  651    HE2  PHE  84           2HE      PHE  84  16.480  -8.921  -7.791
  652    HZ   PHE  84           HZ       PHE  84  15.028 -10.706  -8.890
  653    H    GLY  85           H        GLY  85  12.401  -5.727  -3.131
  654   1HA   GLY  85          2HA       GLY  85  11.879  -8.400  -2.731
  655   2HA   GLY  85          1HA       GLY  85  13.585  -8.236  -2.405
  656    H    VAL  86           H        VAL  86  10.842  -6.080  -1.384
  657    HA   VAL  86           HA       VAL  86  11.659  -6.656   1.395
  658    HB   VAL  86           HB       VAL  86  10.914  -4.252   0.291
  659   1HG1  VAL  86          1HG1      VAL  86   8.760  -3.659   1.408
  660   2HG1  VAL  86          2HG1      VAL  86   8.498  -5.381   1.684
  661   3HG1  VAL  86          3HG1      VAL  86   8.603  -4.759   0.038
  662   1HG2  VAL  86          1HG2      VAL  86  10.388  -3.757   2.871
  663   2HG2  VAL  86          2HG2      VAL  86  12.018  -3.985   2.239
  664   3HG2  VAL  86          3HG2      VAL  86  11.182  -5.324   3.024
  665    H    SER  87           H        SER  87  10.220  -7.747   2.876
  666    HA   SER  87           HA       SER  87   8.499  -9.561   1.830
  667   1HB   SER  87          2HB       SER  87   7.947  -8.607   4.575
  668   2HB   SER  87          1HB       SER  87   8.263 -10.242   3.990
  669    HG   SER  87           HG       SER  87   9.932  -9.107   5.348
  670    H    ASP  88           H        ASP  88   6.282  -9.829   1.920
  671    HA   ASP  88           HA       ASP  88   4.765  -7.788   0.802
  672   1HB   ASP  88          2HB       ASP  88   4.341 -10.413   1.118
  673   2HB   ASP  88          1HB       ASP  88   3.332  -9.828   2.437
  674    H    ALA  89           H        ALA  89   5.210  -8.739   4.129
  675    HA   ALA  89           HA       ALA  89   3.333  -6.697   5.012
  676   1HB   ALA  89          1HB       ALA  89   4.631  -9.031   6.334
  677   2HB   ALA  89          2HB       ALA  89   2.921  -8.629   6.182
  678   3HB   ALA  89          3HB       ALA  89   3.941  -7.728   7.302
  679    H    ASP  90           H        ASP  90   6.720  -6.702   4.350
  680    HA   ASP  90           HA       ASP  90   7.560  -5.550   6.832
  681   1HB   ASP  90          2HB       ASP  90   8.954  -6.670   4.888
  682   2HB   ASP  90          1HB       ASP  90   9.057  -5.008   4.308
  683    H    ILE  91           H        ILE  91   7.612  -3.931   3.631
  684    HA   ILE  91           HA       ILE  91   7.370  -1.360   4.709
  685    HB   ILE  91           HB       ILE  91   8.163  -1.991   2.380
  686   1HG1  ILE  91          2HG1      ILE  91   7.276   0.131   1.372
  687   2HG1  ILE  91          1HG1      ILE  91   6.197   0.276   2.757
  688   1HG2  ILE  91          1HG2      ILE  91   6.759  -2.979   0.984
  689   2HG2  ILE  91          2HG2      ILE  91   5.750  -1.534   0.991
  690   3HG2  ILE  91          3HG2      ILE  91   5.450  -2.825   2.155
  691   1HD1  ILE  91          1HD1      ILE  91   7.877   1.571   3.516
  692   2HD1  ILE  91          2HD1      ILE  91   9.101   0.743   2.554
  693   3HD1  ILE  91          3HD1      ILE  91   8.516   0.017   4.050
  694    H    GLN  92           H        GLN  92   4.999  -3.768   4.208
  695    HA   GLN  92           HA       GLN  92   2.729  -2.087   3.867
  696   1HB   GLN  92          2HB       GLN  92   2.593  -4.406   3.215
  697   2HB   GLN  92          1HB       GLN  92   2.987  -4.934   4.844
  698   1HG   GLN  92          2HG       GLN  92   0.684  -3.251   4.938
  699   2HG   GLN  92          1HG       GLN  92   0.447  -4.502   3.718
  700   1HE2  GLN  92          1HE2      GLN  92  -0.148  -3.817   6.803
  701   2HE2  GLN  92          2HE2      GLN  92  -0.141  -5.403   7.494
  702    H    GLU  93           H        GLU  93   4.150  -3.752   6.667
  703    HA   GLU  93           HA       GLU  93   2.287  -2.677   8.527
  704   1HB   GLU  93          2HB       GLU  93   4.950  -4.046   8.812
  705   2HB   GLU  93          1HB       GLU  93   4.079  -3.422  10.207
  706   1HG   GLU  93          2HG       GLU  93   2.295  -4.969   8.610
  707   2HG   GLU  93          1HG       GLU  93   3.761  -5.900   8.914
  708    H    LEU  94           H        LEU  94   5.347  -1.593   7.208
  709    HA   LEU  94           HA       LEU  94   5.904   0.413   9.106
  710   1HB   LEU  94          2HB       LEU  94   6.702  -0.156   6.298
  711   2HB   LEU  94          1HB       LEU  94   6.970   1.471   6.894
  712    HG   LEU  94           HG       LEU  94   7.964  -0.867   8.479
  713   1HD1  LEU  94          1HD1      LEU  94   8.673  -1.059   6.048
  714   2HD1  LEU  94          2HD1      LEU  94   9.962  -1.009   7.251
  715   3HD1  LEU  94          3HD1      LEU  94   9.582   0.430   6.307
  716   1HD2  LEU  94          1HD2      LEU  94   9.470   0.681   9.386
  717   2HD2  LEU  94          2HD2      LEU  94   7.946   1.559   9.274
  718   3HD2  LEU  94          3HD2      LEU  94   9.211   1.836   8.078
  719    H    PHE  95           H        PHE  95   4.703   0.962   5.791
  720    HA   PHE  95           HA       PHE  95   3.612   3.445   6.220
  721   1HB   PHE  95          2HB       PHE  95   3.316   1.348   4.201
  722   2HB   PHE  95          1HB       PHE  95   1.951   2.455   4.305
  723    HD1  PHE  95           1HD      PHE  95   2.586   4.988   4.386
  724    HD2  PHE  95           2HD      PHE  95   5.103   1.910   2.873
  725    HE1  PHE  95           1HE      PHE  95   3.831   6.654   3.077
  726    HE2  PHE  95           2HE      PHE  95   6.354   3.572   1.560
  727    HZ   PHE  95           HZ       PHE  95   5.711   5.925   1.631
  728    H    ALA  96           H        ALA  96   2.308   0.456   7.358
  729    HA   ALA  96           HA       ALA  96  -0.363   1.449   7.740
  730   1HB   ALA  96          1HB       ALA  96   0.275  -0.997   7.692
  731   2HB   ALA  96          2HB       ALA  96  -0.758  -0.512   9.038
  732   3HB   ALA  96          3HB       ALA  96   0.969  -0.764   9.297
  733    H    GLU  97           H        GLU  97   2.462   0.992   9.789
  734    HA   GLU  97           HA       GLU  97   1.660   2.411  12.050
  735   1HB   GLU  97          2HB       GLU  97   4.186   1.595  10.811
  736   2HB   GLU  97          1HB       GLU  97   4.326   3.069  11.757
  737   1HG   GLU  97          2HG       GLU  97   2.826   1.066  13.180
  738   2HG   GLU  97          1HG       GLU  97   4.403   0.452  12.684
  739    H    PHE  98           H        PHE  98   3.151   3.523   9.055
  740    HA   PHE  98           HA       PHE  98   3.179   6.269   9.500
  741   1HB   PHE  98          2HB       PHE  98   3.698   4.500   7.359
  742   2HB   PHE  98          1HB       PHE  98   2.603   5.733   6.747
  743    HD1  PHE  98           1HD      PHE  98   3.737   7.845   8.786
  744    HD2  PHE  98           2HD      PHE  98   5.489   5.258   5.898
  745    HE1  PHE  98           1HE      PHE  98   5.626   9.397   8.549
  746    HE2  PHE  98           2HE      PHE  98   7.386   6.808   5.656
  747    HZ   PHE  98           HZ       PHE  98   7.457   8.870   6.928
  748    H    GLY  99           H        GLY  99   0.434   4.522   9.673
  749   1HA   GLY  99          2HA       GLY  99  -1.570   5.970   9.917
  750   2HA   GLY  99          1HA       GLY  99  -1.161   6.629   8.345
  751    H    THR 100           H        THR 100  -1.674   5.475   6.485
  752    HA   THR 100           HA       THR 100  -3.338   3.097   6.868
  753    HB   THR 100           HB       THR 100  -4.853   4.490   5.069
  754    HG1  THR 100           1HG      THR 100  -3.346   6.337   5.998
  755   1HG2  THR 100          1HG2      THR 100  -6.144   3.501   6.647
  756   2HG2  THR 100          2HG2      THR 100  -6.121   5.106   7.377
  757   3HG2  THR 100          3HG2      THR 100  -5.009   3.863   7.949
  758    H    LEU 101           H        LEU 101  -2.649   1.627   5.491
  759    HA   LEU 101           HA       LEU 101  -1.619   2.513   2.877
  760   1HB   LEU 101          2HB       LEU 101  -0.411   0.926   4.783
  761   2HB   LEU 101          1HB       LEU 101  -1.047  -0.242   3.640
  762    HG   LEU 101           HG       LEU 101   1.004   1.899   3.179
  763   1HD1  LEU 101          1HD1      LEU 101   1.590  -0.410   3.969
  764   2HD1  LEU 101          2HD1      LEU 101   2.368   0.109   2.471
  765   3HD1  LEU 101          3HD1      LEU 101   1.000  -1.003   2.416
  766   1HD2  LEU 101          1HD2      LEU 101   0.369   2.217   1.080
  767   2HD2  LEU 101          2HD2      LEU 101  -1.037   1.187   1.345
  768   3HD2  LEU 101          3HD2      LEU 101   0.475   0.483   0.776
  769    H    LYS 102           H        LYS 102  -3.059   2.275   1.343
  770    HA   LYS 102           HA       LYS 102  -5.273   0.528   1.433
  771   1HB   LYS 102          2HB       LYS 102  -4.167   2.452  -0.444
  772   2HB   LYS 102          1HB       LYS 102  -4.837   1.049  -1.265
  773   1HG   LYS 102          2HG       LYS 102  -6.276   2.821   0.696
  774   2HG   LYS 102          1HG       LYS 102  -6.501   2.788  -1.053
  775   1HD   LYS 102          2HD       LYS 102  -7.630   0.788  -1.007
  776   2HD   LYS 102          1HD       LYS 102  -6.841   0.255   0.480
  777   1HE   LYS 102          2HE       LYS 102  -8.985   0.710   1.207
  778   2HE   LYS 102          1HE       LYS 102  -8.145   2.217   1.569
  779   1HZ   LYS 102          1HZ       LYS 102 -10.444   2.061   0.214
  780   2HZ   LYS 102          2HZ       LYS 102  -9.333   2.074  -1.069
  781   3HZ   LYS 102          3HZ       LYS 102  -9.341   3.343   0.059
  782    H    LYS 103           H        LYS 103  -2.577   0.363  -0.935
  783    HA   LYS 103           HA       LYS 103  -2.606  -2.553  -0.584
  784   1HB   LYS 103          2HB       LYS 103  -3.579  -2.610  -2.632
  785   2HB   LYS 103          1HB       LYS 103  -3.107  -0.960  -3.005
  786   1HG   LYS 103          2HG       LYS 103  -1.451  -1.665  -4.294
  787   2HG   LYS 103          1HG       LYS 103  -0.801  -2.673  -2.998
  788   1HD   LYS 103          2HD       LYS 103  -3.229  -3.659  -4.385
  789   2HD   LYS 103          1HD       LYS 103  -1.719  -3.684  -5.297
  790   1HE   LYS 103          2HE       LYS 103  -0.691  -4.874  -3.318
  791   2HE   LYS 103          1HE       LYS 103  -2.324  -5.042  -2.679
  792   1HZ   LYS 103          1HZ       LYS 103  -1.516  -6.995  -3.951
  793   2HZ   LYS 103          2HZ       LYS 103  -1.487  -6.031  -5.350
  794   3HZ   LYS 103          3HZ       LYS 103  -2.959  -6.334  -4.558
  795    H    ALA 104           H        ALA 104  -0.575  -3.521  -0.590
  796    HA   ALA 104           HA       ALA 104   1.665  -1.814  -1.434
  797   1HB   ALA 104          1HB       ALA 104   2.652  -3.451   0.643
  798   2HB   ALA 104          2HB       ALA 104   1.182  -2.683   1.245
  799   3HB   ALA 104          3HB       ALA 104   2.503  -1.690   0.616
  800    H    ALA 105           H        ALA 105   2.522  -2.757  -3.127
  801    HA   ALA 105           HA       ALA 105   2.446  -5.686  -3.334
  802   1HB   ALA 105          1HB       ALA 105   2.359  -5.480  -5.625
  803   2HB   ALA 105          2HB       ALA 105   3.169  -3.911  -5.616
  804   3HB   ALA 105          3HB       ALA 105   1.479  -4.035  -5.124
  805    H    VAL 106           H        VAL 106   4.251  -6.526  -2.553
  806    HA   VAL 106           HA       VAL 106   6.750  -5.064  -2.851
  807    HB   VAL 106           HB       VAL 106   7.635  -6.538  -1.162
  808   1HG1  VAL 106          1HG1      VAL 106   6.392  -4.719  -0.258
  809   2HG1  VAL 106          2HG1      VAL 106   5.938  -6.152   0.667
  810   3HG1  VAL 106          3HG1      VAL 106   4.854  -5.527  -0.575
  811   1HG2  VAL 106          1HG2      VAL 106   6.965  -8.660  -1.297
  812   2HG2  VAL 106          2HG2      VAL 106   5.410  -8.230  -2.013
  813   3HG2  VAL 106          3HG2      VAL 106   5.627  -8.154  -0.264
  814    H    ASP 107           H        ASP 107   8.708  -6.391  -3.132
  815    HA   ASP 107           HA       ASP 107   8.327  -8.466  -5.185
  816   1HB   ASP 107          2HB       ASP 107   9.887  -5.955  -5.263
  817   2HB   ASP 107          1HB       ASP 107  10.773  -7.387  -5.779
  818    H    TYR 108           H        TYR 108  10.411  -9.836  -5.289
  819    HA   TYR 108           HA       TYR 108  11.987  -9.737  -2.810
  820   1HB   TYR 108          2HB       TYR 108  10.764 -12.297  -3.898
  821   2HB   TYR 108          1HB       TYR 108  11.883 -12.190  -2.547
  822    HD1  TYR 108           1HD      TYR 108   8.708 -12.959  -3.165
  823    HD2  TYR 108           2HD      TYR 108  10.853 -10.100  -0.850
  824    HE1  TYR 108           1HE      TYR 108   6.799 -12.773  -1.634
  825    HE2  TYR 108           2HE      TYR 108   8.938  -9.896   0.671
  826    HH   TYR 108           HH       TYR 108   5.867 -11.269  -0.039
  827    H    ASP 109           H        ASP 109  14.085 -11.078  -3.071
  828    HA   ASP 109           HA       ASP 109  14.986 -10.426  -5.777
  829   1HB   ASP 109          2HB       ASP 109  16.380  -9.415  -4.137
  830   2HB   ASP 109          1HB       ASP 109  16.435 -10.884  -3.169
  831    H    ARG 110           H        ARG 110  16.276 -11.955  -6.942
  832    HA   ARG 110           HA       ARG 110  15.099 -14.526  -6.961
  833   1HB   ARG 110          2HB       ARG 110  17.600 -13.554  -8.350
  834   2HB   ARG 110          1HB       ARG 110  16.739 -15.041  -8.723
  835   1HG   ARG 110          2HG       ARG 110  15.350 -13.969 -10.070
  836   2HG   ARG 110          1HG       ARG 110  14.941 -12.803  -8.808
  837   1HD   ARG 110          2HD       ARG 110  15.955 -11.861 -10.930
  838   2HD   ARG 110          1HD       ARG 110  16.706 -11.370  -9.414
  839    HE   ARG 110           HE       ARG 110  17.981 -13.669 -10.530
  840   1HH1  ARG 110          1HH1      ARG 110  17.762 -10.179 -10.792
  841   2HH1  ARG 110          2HH1      ARG 110  19.351  -9.999 -11.468
  842   1HH2  ARG 110          1HH2      ARG 110  20.068 -13.437 -11.442
  843   2HH2  ARG 110          2HH2      ARG 110  20.648 -11.854 -11.863
  844    H    SER 111           H        SER 111  17.695 -13.278  -5.113
  845    HA   SER 111           HA       SER 111  18.674 -16.005  -4.615
  846   1HB   SER 111          2HB       SER 111  20.673 -14.181  -3.842
  847   2HB   SER 111          1HB       SER 111  20.694 -15.258  -5.240
  848    HG   SER 111           HG       SER 111  19.619 -12.617  -5.169
  849    H    GLY 112           H        GLY 112  17.118 -13.317  -3.292
  850   1HA   GLY 112          2HA       GLY 112  16.991 -14.426  -0.711
  851   2HA   GLY 112          1HA       GLY 112  18.232 -13.188  -0.726
  852    H    ARG 113           H        ARG 113  14.797 -13.762  -1.352
  853    HA   ARG 113           HA       ARG 113  13.731 -11.259  -1.202
  854   1HB   ARG 113          2HB       ARG 113  11.763 -12.230  -0.338
  855   2HB   ARG 113          1HB       ARG 113  12.530 -13.504  -1.274
  856   1HG   ARG 113          2HG       ARG 113  13.575 -14.006   1.157
  857   2HG   ARG 113          1HG       ARG 113  12.014 -13.322   1.616
  858   1HD   ARG 113          2HD       ARG 113  11.477 -15.546   1.405
  859   2HD   ARG 113          1HD       ARG 113  11.098 -14.949  -0.212
  860    HE   ARG 113           HE       ARG 113  13.359 -15.798  -0.859
  861   1HH1  ARG 113          1HH1      ARG 113  11.616 -17.169   1.858
  862   2HH1  ARG 113          2HH1      ARG 113  12.436 -18.704   1.764
  863   1HH2  ARG 113          1HH2      ARG 113  14.445 -17.819  -0.962
  864   2HH2  ARG 113          2HH2      ARG 113  14.024 -19.069   0.173
  865    H    SER 114           H        SER 114  12.987  -9.900   0.482
  866    HA   SER 114           HA       SER 114  12.860  -8.927   2.530
  867   1HB   SER 114          2HB       SER 114  14.774 -11.039   3.569
  868   2HB   SER 114          1HB       SER 114  13.884  -9.864   4.538
  869    HG   SER 114           HG       SER 114  11.966 -10.868   3.944
  870    H    LEU 115           H        LEU 115  14.695  -8.716   0.321
  871    HA   LEU 115           HA       LEU 115  17.091  -7.516   1.392
  872   1HB   LEU 115          2HB       LEU 115  17.885  -8.316  -0.518
  873   2HB   LEU 115          1HB       LEU 115  16.274  -8.803  -1.001
  874    HG   LEU 115           HG       LEU 115  17.443  -6.078  -1.585
  875   1HD1  LEU 115          1HD1      LEU 115  17.259  -8.507  -3.365
  876   2HD1  LEU 115          2HD1      LEU 115  18.744  -7.897  -2.629
  877   3HD1  LEU 115          3HD1      LEU 115  17.880  -6.916  -3.814
  878   1HD2  LEU 115          1HD2      LEU 115  15.048  -6.051  -1.667
  879   2HD2  LEU 115          2HD2      LEU 115  15.001  -7.569  -2.580
  880   3HD2  LEU 115          3HD2      LEU 115  15.647  -6.090  -3.327
  881    H    GLY 116           H        GLY 116  14.009  -6.421   1.188
  882   1HA   GLY 116          2HA       GLY 116  13.245  -4.321   1.675
  883   2HA   GLY 116          1HA       GLY 116  14.884  -3.731   1.527
  884    H    THR 117           H        THR 117  12.197  -4.870  -0.578
  885    HA   THR 117           HA       THR 117  12.176  -2.276  -1.857
  886    HB   THR 117           HB       THR 117  12.615  -4.597  -3.711
  887    HG1  THR 117           1HG      THR 117  14.454  -3.226  -2.220
  888   1HG2  THR 117          1HG2      THR 117  12.672  -1.604  -4.036
  889   2HG2  THR 117          2HG2      THR 117  11.509  -2.737  -4.726
  890   3HG2  THR 117          3HG2      THR 117  13.184  -2.749  -5.275
  891    H    ALA 118           H        ALA 118  10.241  -1.762  -2.926
  892    HA   ALA 118           HA       ALA 118   8.231  -3.673  -3.501
  893   1HB   ALA 118          1HB       ALA 118   7.699  -2.061  -1.013
  894   2HB   ALA 118          2HB       ALA 118   8.133  -3.771  -1.024
  895   3HB   ALA 118          3HB       ALA 118   6.628  -3.239  -1.779
  896    H    ASP 119           H        ASP 119   6.135  -2.658  -3.988
  897    HA   ASP 119           HA       ASP 119   6.215   0.239  -4.442
  898   1HB   ASP 119          2HB       ASP 119   6.523  -0.263  -6.643
  899   2HB   ASP 119          1HB       ASP 119   5.975  -1.920  -6.446
  900    H    VAL 120           H        VAL 120   4.621   1.011  -3.164
  901    HA   VAL 120           HA       VAL 120   2.245  -0.679  -2.730
  902    HB   VAL 120           HB       VAL 120   2.040   0.125  -0.554
  903   1HG1  VAL 120          1HG1      VAL 120   4.843  -0.360  -1.371
  904   2HG1  VAL 120          2HG1      VAL 120   3.831  -1.228  -0.217
  905   3HG1  VAL 120          3HG1      VAL 120   4.586   0.297   0.246
  906   1HG2  VAL 120          1HG2      VAL 120   3.445   2.103   0.247
  907   2HG2  VAL 120          2HG2      VAL 120   2.078   2.455  -0.814
  908   3HG2  VAL 120          3HG2      VAL 120   3.720   2.434  -1.466
  909    H    HIS 121           H        HIS 121   0.179   0.548  -2.306
  910    HA   HIS 121           HA       HIS 121   0.091   3.019  -3.904
  911   1HB   HIS 121          2HB       HIS 121  -1.179   0.411  -4.381
  912   2HB   HIS 121          1HB       HIS 121  -2.277   1.786  -4.486
  913    HD1  HIS 121           1HD      HIS 121   0.418   0.048  -6.308
  914    HD2  HIS 121           2HD      HIS 121  -1.555   3.713  -6.483
  915    HE1  HIS 121           1HE      HIS 121   0.952   0.996  -8.570
  916    HE2  HIS 121           2HE      HIS 121  -0.433   3.095  -8.732
  917    H    PHE 122           H        PHE 122  -0.826   4.621  -2.759
  918    HA   PHE 122           HA       PHE 122  -3.040   3.906  -0.959
  919   1HB   PHE 122          2HB       PHE 122  -2.185   6.711  -0.915
  920   2HB   PHE 122          1HB       PHE 122  -2.452   5.594   0.418
  921    HD1  PHE 122           1HD      PHE 122  -0.631   4.056   1.115
  922    HD2  PHE 122           2HD      PHE 122  -0.016   7.179  -1.707
  923    HE1  PHE 122           1HE      PHE 122   1.794   3.893   1.472
  924    HE2  PHE 122           2HE      PHE 122   2.412   7.023  -1.352
  925    HZ   PHE 122           HZ       PHE 122   3.316   5.402   0.263
  926    H    GLU 123           H        GLU 123  -5.014   5.086  -1.142
  927    HA   GLU 123           HA       GLU 123  -5.763   5.378  -3.874
  928   1HB   GLU 123          2HB       GLU 123  -7.973   6.185  -2.681
  929   2HB   GLU 123          1HB       GLU 123  -7.495   4.492  -2.667
  930   1HG   GLU 123          2HG       GLU 123  -6.998   4.500  -0.454
  931   2HG   GLU 123          1HG       GLU 123  -6.529   6.198  -0.451
  932    H    ARG 124           H        ARG 124  -4.649   7.586  -1.509
  933    HA   ARG 124           HA       ARG 124  -5.609   9.849  -3.128
  934   1HB   ARG 124          2HB       ARG 124  -4.700   9.961  -0.258
  935   2HB   ARG 124          1HB       ARG 124  -5.496  11.231  -1.175
  936   1HG   ARG 124          2HG       ARG 124  -7.567  10.103  -1.137
  937   2HG   ARG 124          1HG       ARG 124  -6.822   8.604  -0.577
  938   1HD   ARG 124          2HD       ARG 124  -6.343  10.903   1.171
  939   2HD   ARG 124          1HD       ARG 124  -8.041  10.460   1.022
  940    HE   ARG 124           HE       ARG 124  -7.621   8.487   2.142
  941   1HH1  ARG 124          1HH1      ARG 124  -4.613  10.158   1.463
  942   2HH1  ARG 124          2HH1      ARG 124  -3.647   9.070   2.429
  943   1HH2  ARG 124          1HH2      ARG 124  -6.345   7.099   3.462
  944   2HH2  ARG 124          2HH2      ARG 124  -4.628   7.359   3.560
  945    H    ARG 125           H        ARG 125  -4.155  11.297  -3.908
  946    HA   ARG 125           HA       ARG 125  -1.469  10.411  -4.166
  947   1HB   ARG 125          2HB       ARG 125  -2.741  13.034  -4.954
  948   2HB   ARG 125          1HB       ARG 125  -1.162  12.469  -5.483
  949   1HG   ARG 125          2HG       ARG 125  -2.033  10.955  -6.939
  950   2HG   ARG 125          1HG       ARG 125  -3.498  10.711  -5.983
  951   1HD   ARG 125          2HD       ARG 125  -3.429  13.418  -6.855
  952   2HD   ARG 125          1HD       ARG 125  -3.122  12.378  -8.246
  953    HE   ARG 125           HE       ARG 125  -5.393  11.720  -6.529
  954   1HH1  ARG 125          1HH1      ARG 125  -4.211  13.097  -9.519
  955   2HH1  ARG 125          2HH1      ARG 125  -5.740  12.986 -10.334
  956   1HH2  ARG 125          1HH2      ARG 125  -7.422  11.577  -7.586
  957   2HH2  ARG 125          2HH2      ARG 125  -7.570  12.119  -9.237
  958    H    ALA 126           H        ALA 126  -3.030  12.790  -2.106
  959    HA   ALA 126           HA       ALA 126  -0.791  14.306  -1.392
  960   1HB   ALA 126          1HB       ALA 126  -3.393  13.736  -0.057
  961   2HB   ALA 126          2HB       ALA 126  -2.761  15.255  -0.697
  962   3HB   ALA 126          3HB       ALA 126  -2.130  14.605   0.817
  963    H    ASP 127           H        ASP 127  -1.998  11.283  -0.049
  964    HA   ASP 127           HA       ASP 127  -0.250  11.007   2.105
  965   1HB   ASP 127          2HB       ASP 127  -2.080   9.327   0.752
  966   2HB   ASP 127          1HB       ASP 127  -0.555   8.450   0.827
  967    H    ALA 128           H        ALA 128   0.300  10.585  -1.312
  968    HA   ALA 128           HA       ALA 128   2.910   9.385  -0.957
  969   1HB   ALA 128          1HB       ALA 128   1.910   8.635  -2.910
  970   2HB   ALA 128          2HB       ALA 128   3.014   9.880  -3.494
  971   3HB   ALA 128          3HB       ALA 128   1.294  10.234  -3.328
  972    H    LEU 129           H        LEU 129   1.503  12.518  -1.553
  973    HA   LEU 129           HA       LEU 129   3.888  13.902  -2.187
  974   1HB   LEU 129          2HB       LEU 129   1.778  14.931  -2.672
  975   2HB   LEU 129          1HB       LEU 129   1.277  14.826  -0.995
  976    HG   LEU 129           HG       LEU 129   3.703  16.335  -1.137
  977   1HD1  LEU 129          1HD1      LEU 129   1.545  17.139  -3.068
  978   2HD1  LEU 129          2HD1      LEU 129   3.264  16.905  -3.384
  979   3HD1  LEU 129          3HD1      LEU 129   2.725  18.277  -2.415
  980   1HD2  LEU 129          1HD2      LEU 129   2.106  18.112  -0.246
  981   2HD2  LEU 129          2HD2      LEU 129   2.268  16.625   0.692
  982   3HD2  LEU 129          3HD2      LEU 129   0.859  16.869  -0.341
  983    H    LYS 130           H        LYS 130   2.131  13.406   0.855
  984    HA   LYS 130           HA       LYS 130   3.931  14.748   2.540
  985   1HB   LYS 130          2HB       LYS 130   2.173  14.245   3.859
  986   2HB   LYS 130          1HB       LYS 130   1.692  12.900   2.836
  987   1HG   LYS 130          2HG       LYS 130   2.357  11.496   4.408
  988   2HG   LYS 130          1HG       LYS 130   4.016  12.079   4.219
  989   1HD   LYS 130          2HD       LYS 130   3.865  12.800   6.325
  990   2HD   LYS 130          1HD       LYS 130   2.775  14.050   5.720
  991   1HE   LYS 130          2HE       LYS 130   1.203  11.757   6.001
  992   2HE   LYS 130          1HE       LYS 130   2.222  11.806   7.440
  993   1HZ   LYS 130          1HZ       LYS 130   0.033  13.027   7.554
  994   2HZ   LYS 130          2HZ       LYS 130   0.706  14.167   6.499
  995   3HZ   LYS 130          3HZ       LYS 130   1.405  13.907   8.023
  996    H    ALA 131           H        ALA 131   3.811  11.460   1.326
  997    HA   ALA 131           HA       ALA 131   6.013  10.501   2.854
  998   1HB   ALA 131          1HB       ALA 131   5.892   8.532   1.531
  999   2HB   ALA 131          2HB       ALA 131   5.004   9.373   0.260
 1000   3HB   ALA 131          3HB       ALA 131   4.241   9.079   1.823
 1001    H    MET 132           H        MET 132   5.765  12.076  -0.318
 1002    HA   MET 132           HA       MET 132   8.485  11.637  -1.009
 1003   1HB   MET 132          2HB       MET 132   7.971  12.710  -2.931
 1004   2HB   MET 132          1HB       MET 132   6.314  12.532  -2.373
 1005   1HG   MET 132          2HG       MET 132   6.208  14.761  -1.642
 1006   2HG   MET 132          1HG       MET 132   7.956  14.960  -1.728
 1007   1HE   MET 132          1HE       MET 132   4.611  14.722  -3.611
 1008   2HE   MET 132          2HE       MET 132   5.429  13.393  -4.436
 1009   3HE   MET 132          3HE       MET 132   5.059  14.879  -5.310
 1010    H    LYS 133           H        LYS 133   6.863  13.868   1.090
 1011    HA   LYS 133           HA       LYS 133   9.187  15.591   1.303
 1012   1HB   LYS 133          2HB       LYS 133   6.430  15.569   2.389
 1013   2HB   LYS 133          1HB       LYS 133   7.659  16.339   3.386
 1014   1HG   LYS 133          2HG       LYS 133   7.233  18.164   2.188
 1015   2HG   LYS 133          1HG       LYS 133   8.174  17.385   0.913
 1016   1HD   LYS 133          2HD       LYS 133   6.371  17.073  -0.367
 1017   2HD   LYS 133          1HD       LYS 133   5.407  16.487   0.991
 1018   1HE   LYS 133          2HE       LYS 133   6.002  19.391   0.440
 1019   2HE   LYS 133          1HE       LYS 133   4.526  18.566  -0.056
 1020   1HZ   LYS 133          1HZ       LYS 133   3.937  19.560   1.923
 1021   2HZ   LYS 133          2HZ       LYS 133   5.435  19.262   2.663
 1022   3HZ   LYS 133          3HZ       LYS 133   4.334  17.991   2.434
 1023    H    GLN 134           H        GLN 134   7.715  12.933   3.027
 1024    HA   GLN 134           HA       GLN 134   9.537  13.243   5.281
 1025   1HB   GLN 134          2HB       GLN 134   6.932  12.070   4.863
 1026   2HB   GLN 134          1HB       GLN 134   8.011  10.920   5.641
 1027   1HG   GLN 134          2HG       GLN 134   7.099  11.972   7.453
 1028   2HG   GLN 134          1HG       GLN 134   8.559  12.929   7.208
 1029   1HE2  GLN 134          1HE2      GLN 134   8.063  14.695   5.394
 1030   2HE2  GLN 134          2HE2      GLN 134   6.694  15.687   5.764
 1031    H    TYR 135           H        TYR 135   8.514  10.484   3.252
 1032    HA   TYR 135           HA       TYR 135  10.691   8.884   4.154
 1033   1HB   TYR 135          2HB       TYR 135   8.296   8.471   2.682
 1034   2HB   TYR 135          1HB       TYR 135   9.629   7.821   1.733
 1035    HD1  TYR 135           1HD      TYR 135  11.005   7.473   4.747
 1036    HD2  TYR 135           2HD      TYR 135   7.635   5.961   2.637
 1037    HE1  TYR 135           1HE      TYR 135  11.036   5.455   6.151
 1038    HE2  TYR 135           2HE      TYR 135   7.657   3.942   4.035
 1039    HH   TYR 135           HH       TYR 135   8.513   3.333   6.395
 1040    H    LYS 136           H        LYS 136  10.173  10.846   1.264
 1041    HA   LYS 136           HA       LYS 136  12.502   9.915  -0.081
 1042   1HB   LYS 136          2HB       LYS 136  10.484  11.936  -0.527
 1043   2HB   LYS 136          1HB       LYS 136  12.086  12.570  -0.882
 1044   1HG   LYS 136          2HG       LYS 136  12.078  10.065  -2.057
 1045   2HG   LYS 136          1HG       LYS 136  10.461  10.702  -2.371
 1046   1HD   LYS 136          2HD       LYS 136  12.137  12.855  -2.862
 1047   2HD   LYS 136          1HD       LYS 136  13.018  11.470  -3.515
 1048   1HE   LYS 136          2HE       LYS 136  10.721  10.859  -4.573
 1049   2HE   LYS 136          1HE       LYS 136  10.341  12.556  -4.288
 1050   1HZ   LYS 136          1HZ       LYS 136  12.394  13.105  -5.553
 1051   2HZ   LYS 136          2HZ       LYS 136  11.198  12.344  -6.479
 1052   3HZ   LYS 136          3HZ       LYS 136  12.547  11.462  -5.950
 1053    H    GLY 137           H        GLY 137  14.588  10.754  -0.117
 1054   1HA   GLY 137          2HA       GLY 137  16.414  11.877   0.749
 1055   2HA   GLY 137          1HA       GLY 137  15.314  12.887   1.681
 1056    H    VAL 138           H        VAL 138  14.437   9.753   2.248
 1057    HA   VAL 138           HA       VAL 138  15.836   9.766   4.803
 1058    HB   VAL 138           HB       VAL 138  13.250   8.963   3.994
 1059   1HG1  VAL 138          1HG1      VAL 138  13.088   6.706   4.996
 1060   2HG1  VAL 138          2HG1      VAL 138  14.850   6.636   5.047
 1061   3HG1  VAL 138          3HG1      VAL 138  14.015   6.740   3.495
 1062   1HG2  VAL 138          1HG2      VAL 138  12.976   9.704   6.058
 1063   2HG2  VAL 138          2HG2      VAL 138  14.708   9.589   6.366
 1064   3HG2  VAL 138          3HG2      VAL 138  13.664   8.199   6.667
 1065    HA   PRO 139           HA       PRO 139  18.613   6.609   3.409
 1066   1HB   PRO 139          2HB       PRO 139  19.944   6.228   5.700
 1067   2HB   PRO 139          1HB       PRO 139  20.093   7.732   4.786
 1068   1HG   PRO 139          2HG       PRO 139  18.546   7.166   7.265
 1069   2HG   PRO 139          1HG       PRO 139  19.411   8.637   6.790
 1070   1HD   PRO 139          2HD       PRO 139  16.655   8.208   6.570
 1071   2HD   PRO 139          1HD       PRO 139  17.578   9.483   5.753
 1072    H    LEU 140           H        LEU 140  19.433   4.455   4.250
 1073    HA   LEU 140           HA       LEU 140  17.617   2.984   5.960
 1074   1HB   LEU 140          2HB       LEU 140  17.189   2.912   3.209
 1075   2HB   LEU 140          1HB       LEU 140  18.108   1.455   3.533
 1076    HG   LEU 140           HG       LEU 140  15.495   2.221   4.840
 1077   1HD1  LEU 140          1HD1      LEU 140  14.724   0.141   3.624
 1078   2HD1  LEU 140          2HD1      LEU 140  16.214   0.253   2.686
 1079   3HD1  LEU 140          3HD1      LEU 140  15.033   1.561   2.626
 1080   1HD2  LEU 140          1HD2      LEU 140  17.476   0.645   5.907
 1081   2HD2  LEU 140          2HD2      LEU 140  16.427  -0.527   5.110
 1082   3HD2  LEU 140          3HD2      LEU 140  15.764   0.570   6.321
 1083    H    ASP 141           H        ASP 141  19.293   2.681   7.322
 1084    HA   ASP 141           HA       ASP 141  21.235   1.897   8.196
 1085   1HB   ASP 141          2HB       ASP 141  19.998  -0.218   7.514
 1086   2HB   ASP 141          1HB       ASP 141  21.062  -0.277   6.113
 1087    H    GLY 142           H        GLY 142  22.579   3.666   7.520
 1088   1HA   GLY 142          2HA       GLY 142  24.841   3.943   6.931
 1089   2HA   GLY 142          1HA       GLY 142  24.671   2.660   5.742
 1090    H    ARG 143           H        ARG 143  22.770   3.327   4.083
 1091    HA   ARG 143           HA       ARG 143  23.576   6.001   3.119
 1092   1HB   ARG 143          2HB       ARG 143  23.630   5.147   0.860
 1093   2HB   ARG 143          1HB       ARG 143  24.671   4.158   1.873
 1094   1HG   ARG 143          2HG       ARG 143  23.553   2.325   1.328
 1095   2HG   ARG 143          1HG       ARG 143  22.021   3.056   1.813
 1096   1HD   ARG 143          2HD       ARG 143  21.416   3.273  -0.312
 1097   2HD   ARG 143          1HD       ARG 143  22.866   4.216  -0.653
 1098    HE   ARG 143           HE       ARG 143  23.344   1.383  -0.561
 1099   1HH1  ARG 143          1HH1      ARG 143  22.287   4.043  -2.591
 1100   2HH1  ARG 143          2HH1      ARG 143  22.727   3.253  -4.073
 1101   1HH2  ARG 143          1HH2      ARG 143  23.922   0.345  -2.522
 1102   2HH2  ARG 143          2HH2      ARG 143  23.656   1.155  -4.037
 1103    HA   PRO 144           HA       PRO 144  19.250   6.978   2.452
 1104   1HB   PRO 144          2HB       PRO 144  19.496   8.305   0.042
 1105   2HB   PRO 144          1HB       PRO 144  19.767   9.046   1.622
 1106   1HG   PRO 144          2HG       PRO 144  21.754   7.963  -0.332
 1107   2HG   PRO 144          1HG       PRO 144  21.844   9.425   0.668
 1108   1HD   PRO 144          2HD       PRO 144  23.171   7.188   1.326
 1109   2HD   PRO 144          1HD       PRO 144  22.451   8.238   2.567
 1110    H    MET 145           H        MET 145  17.527   6.079   1.308
 1111    HA   MET 145           HA       MET 145  18.375   3.885  -0.443
 1112   1HB   MET 145          2HB       MET 145  16.419   2.707   0.192
 1113   2HB   MET 145          1HB       MET 145  17.084   3.396   1.662
 1114   1HG   MET 145          2HG       MET 145  15.281   4.674   2.030
 1115   2HG   MET 145          1HG       MET 145  15.080   5.068   0.324
 1116   1HE   MET 145          1HE       MET 145  12.985   4.684   2.444
 1117   2HE   MET 145          2HE       MET 145  13.218   3.110   3.204
 1118   3HE   MET 145          3HE       MET 145  11.852   3.372   2.118
 1119    H    ASP 146           H        ASP 146  16.094   3.240  -1.686
 1120    HA   ASP 146           HA       ASP 146  15.703   5.513  -3.528
 1121   1HB   ASP 146          2HB       ASP 146  16.543   3.230  -4.391
 1122   2HB   ASP 146          1HB       ASP 146  14.891   2.671  -4.123
 1123    H    ILE 147           H        ILE 147  14.049   6.644  -2.864
 1124    HA   ILE 147           HA       ILE 147  11.516   5.246  -2.326
 1125    HB   ILE 147           HB       ILE 147  11.679   7.847  -1.022
 1126   1HG1  ILE 147          2HG1      ILE 147  13.098   6.519   0.881
 1127   2HG1  ILE 147          1HG1      ILE 147  13.876   5.914  -0.577
 1128   1HG2  ILE 147          1HG2      ILE 147  10.308   6.848   0.450
 1129   2HG2  ILE 147          2HG2      ILE 147  11.325   5.410   0.575
 1130   3HG2  ILE 147          3HG2      ILE 147  10.208   5.587  -0.780
 1131   1HD1  ILE 147          1HD1      ILE 147  13.657   8.757   0.356
 1132   2HD1  ILE 147          2HD1      ILE 147  14.189   8.309  -1.265
 1133   3HD1  ILE 147          3HD1      ILE 147  15.113   7.785   0.143
 1134    H    GLN 148           H        GLN 148  10.089   5.755  -3.840
 1135    HA   GLN 148           HA       GLN 148  10.121   8.475  -4.937
 1136   1HB   GLN 148          2HB       GLN 148  10.326   5.944  -6.567
 1137   2HB   GLN 148          1HB       GLN 148   9.767   7.466  -7.248
 1138   1HG   GLN 148          2HG       GLN 148  11.887   8.512  -6.722
 1139   2HG   GLN 148          1HG       GLN 148  12.450   7.027  -5.957
 1140   1HE2  GLN 148          1HE2      GLN 148  13.688   5.789  -7.157
 1141   2HE2  GLN 148          2HE2      GLN 148  13.703   5.742  -8.891
 1142    H    LEU 149           H        LEU 149   8.141   9.283  -5.254
 1143    HA   LEU 149           HA       LEU 149   5.917   7.390  -5.021
 1144   1HB   LEU 149          2HB       LEU 149   6.267  10.044  -3.654
 1145   2HB   LEU 149          1HB       LEU 149   4.725   9.209  -3.757
 1146    HG   LEU 149           HG       LEU 149   6.567   7.311  -2.812
 1147   1HD1  LEU 149          1HD1      LEU 149   7.969   9.359  -2.309
 1148   2HD1  LEU 149          2HD1      LEU 149   7.636   8.269  -0.962
 1149   3HD1  LEU 149          3HD1      LEU 149   6.739   9.779  -1.117
 1150   1HD2  LEU 149          1HD2      LEU 149   5.084   7.102  -1.050
 1151   2HD2  LEU 149          2HD2      LEU 149   4.078   7.761  -2.341
 1152   3HD2  LEU 149          3HD2      LEU 149   4.673   8.817  -1.059
 1153    H    VAL 150           H        VAL 150   4.839   7.350  -6.734
 1154    HA   VAL 150           HA       VAL 150   4.741   9.690  -8.508
 1155    HB   VAL 150           HB       VAL 150   4.283   6.749  -9.066
 1156   1HG1  VAL 150          1HG1      VAL 150   4.440   7.979 -11.507
 1157   2HG1  VAL 150          2HG1      VAL 150   3.494   9.134 -10.569
 1158   3HG1  VAL 150          3HG1      VAL 150   2.948   7.463 -10.723
 1159   1HG2  VAL 150          1HG2      VAL 150   6.644   7.998  -8.827
 1160   2HG2  VAL 150          2HG2      VAL 150   6.309   8.324 -10.527
 1161   3HG2  VAL 150          3HG2      VAL 150   6.364   6.661  -9.944
 1162    H    ALA 151           H        ALA 151   3.022  10.864  -8.111
 1163    HA   ALA 151           HA       ALA 151   0.440   9.538  -7.620
 1164   1HB   ALA 151          1HB       ALA 151   0.224  11.719  -6.029
 1165   2HB   ALA 151          2HB       ALA 151   1.932  11.329  -5.824
 1166   3HB   ALA 151          3HB       ALA 151   0.702  10.121  -5.457
 1167    H    SER 152           H        SER 152   1.170  10.436 -10.032
 1168    HA   SER 152           HA       SER 152  -0.800  12.316 -10.721
 1169   1HB   SER 152          2HB       SER 152   1.047  13.949 -11.716
 1170   2HB   SER 152          1HB       SER 152   0.460  14.153 -10.065
 1171    HG   SER 152           HG       SER 152   2.302  13.295  -9.282
 1172    H    GLN 153           H        GLN 153   2.483  11.463 -11.758
 1173    HA   GLN 153           HA       GLN 153   1.612  10.895 -14.453
 1174   1HB   GLN 153          2HB       GLN 153   4.018  11.651 -13.261
 1175   2HB   GLN 153          1HB       GLN 153   4.285   9.994 -13.785
 1176   1HG   GLN 153          2HG       GLN 153   4.020  10.514 -16.016
 1177   2HG   GLN 153          1HG       GLN 153   3.084  11.968 -15.672
 1178   1HE2  GLN 153          1HE2      GLN 153   5.670  11.293 -17.187
 1179   2HE2  GLN 153          2HE2      GLN 153   6.776  12.502 -16.640
 1180    H    ILE 154           H        ILE 154   0.351   9.269 -12.547
 1181    HA   ILE 154           HA       ILE 154   1.625   6.676 -12.524
 1182    HB   ILE 154           HB       ILE 154  -1.022   6.227 -11.855
 1183   1HG1  ILE 154          2HG1      ILE 154  -0.786   8.337 -10.005
 1184   2HG1  ILE 154          1HG1      ILE 154  -0.488   9.052 -11.587
 1185   1HG2  ILE 154          1HG2      ILE 154   0.582   6.987  -9.562
 1186   2HG2  ILE 154          2HG2      ILE 154   1.473   5.981 -10.705
 1187   3HG2  ILE 154          3HG2      ILE 154  -0.051   5.408 -10.030
 1188   1HD1  ILE 154          1HD1      ILE 154  -2.612   8.050 -12.376
 1189   2HD1  ILE 154          2HD1      ILE 154  -2.815   9.225 -11.076
 1190   3HD1  ILE 154          3HD1      ILE 154  -2.915   7.498 -10.728
 1191    H    ASP 155           H        ASP 155   0.287   8.395 -14.828
 1192    HA   ASP 155           HA       ASP 155  -1.560   6.674 -16.109
 1193   1HB   ASP 155          2HB       ASP 155  -1.382   9.122 -16.494
 1194   2HB   ASP 155          1HB       ASP 155   0.167   8.857 -17.287
 1195    H    LEU 156           H        LEU 156   1.890   6.843 -16.020
 1196    HA   LEU 156           HA       LEU 156   2.550   5.542 -18.416
 1197   1HB   LEU 156          2HB       LEU 156   3.877   5.851 -15.756
 1198   2HB   LEU 156          1HB       LEU 156   4.575   4.759 -16.936
 1199    HG   LEU 156           HG       LEU 156   5.747   6.778 -17.185
 1200   1HD1  LEU 156          1HD1      LEU 156   4.621   5.707 -19.286
 1201   2HD1  LEU 156          2HD1      LEU 156   5.477   7.243 -19.411
 1202   3HD1  LEU 156          3HD1      LEU 156   3.716   7.221 -19.317
 1203   1HD2  LEU 156          1HD2      LEU 156   3.680   8.668 -17.782
 1204   2HD2  LEU 156          2HD2      LEU 156   4.938   8.738 -16.548
 1205   3HD2  LEU 156          3HD2      LEU 156   3.403   7.943 -16.197
 1206    H    GLU 157           H        GLU 157   1.647   4.346 -15.257
 1207    HA   GLU 157           HA       GLU 157   2.231   1.609 -15.893
 1208   1HB   GLU 157          2HB       GLU 157   0.687   2.638 -13.525
 1209   2HB   GLU 157          1HB       GLU 157   1.614   1.146 -13.652
 1210   1HG   GLU 157          2HG       GLU 157   3.086   3.665 -14.087
 1211   2HG   GLU 157          1HG       GLU 157   2.528   3.342 -12.451
 1212    H    HIS 158           H        HIS 158   0.816   1.646 -17.811
 1213    HA   HIS 158           HA       HIS 158  -1.297  -0.101 -17.261
 1214   1HB   HIS 158          2HB       HIS 158  -3.220   1.099 -18.144
 1215   2HB   HIS 158          1HB       HIS 158  -2.580   1.950 -16.752
 1216    HD1  HIS 158           1HD      HIS 158  -0.912   2.505 -20.061
 1217    HD2  HIS 158           2HD      HIS 158  -3.791   4.300 -17.666
 1218    HE1  HIS 158           1HE      HIS 158  -1.281   4.791 -21.040
 1219    HE2  HIS 158           2HE      HIS 158  -2.795   5.944 -19.389
  Start of MODEL    5
    1    H    MET   1           H        MET   1-117.601 -49.107 -32.595
    2    HA   MET   1           HA       MET   1-118.929 -46.831 -31.312
    3   1HB   MET   1          2HB       MET   1-116.436 -46.895 -32.066
    4   2HB   MET   1          1HB       MET   1-117.089 -46.624 -33.676
    5   1HG   MET   1          2HG       MET   1-117.962 -44.529 -33.090
    6   2HG   MET   1          1HG       MET   1-117.776 -44.843 -31.365
    7   1HE   MET   1          1HE       MET   1-115.363 -44.257 -34.727
    8   2HE   MET   1          2HE       MET   1-115.053 -42.658 -34.053
    9   3HE   MET   1          3HE       MET   1-116.712 -43.208 -34.289
   10    H    ALA   2           H        ALA   2-118.730 -48.580 -34.348
   11    HA   ALA   2           HA       ALA   2-120.172 -48.820 -36.085
   12   1HB   ALA   2          1HB       ALA   2-121.997 -47.725 -34.002
   13   2HB   ALA   2          2HB       ALA   2-122.030 -49.284 -34.827
   14   3HB   ALA   2          3HB       ALA   2-122.568 -47.830 -35.668
   15    H    ASP   3           H        ASP   3-118.504 -46.430 -35.643
   16    HA   ASP   3           HA       ASP   3-119.864 -44.595 -37.504
   17   1HB   ASP   3          2HB       ASP   3-119.366 -43.720 -35.161
   18   2HB   ASP   3          1HB       ASP   3-117.662 -43.845 -35.572
   19    H    LYS   4           H        LYS   4-116.535 -44.764 -36.412
   20    HA   LYS   4           HA       LYS   4-114.551 -45.059 -37.443
   21   1HB   LYS   4          2HB       LYS   4-116.229 -47.030 -38.982
   22   2HB   LYS   4          1HB       LYS   4-114.476 -46.943 -39.100
   23   1HG   LYS   4          2HG       LYS   4-116.171 -47.778 -36.778
   24   2HG   LYS   4          1HG       LYS   4-114.859 -48.652 -37.571
   25   1HD   LYS   4          2HD       LYS   4-113.276 -46.934 -36.713
   26   2HD   LYS   4          1HD       LYS   4-114.614 -46.205 -35.821
   27   1HE   LYS   4          2HE       LYS   4-113.228 -47.706 -34.428
   28   2HE   LYS   4          1HE       LYS   4-114.910 -48.221 -34.531
   29   1HZ   LYS   4          1HZ       LYS   4-114.304 -50.142 -35.419
   30   2HZ   LYS   4          2HZ       LYS   4-112.692 -49.739 -35.071
   31   3HZ   LYS   4          3HZ       LYS   4-113.337 -49.389 -36.595
   32    H    MET   5           H        MET   5-116.345 -42.958 -38.558
   33    HA   MET   5           HA       MET   5-115.724 -42.885 -41.372
   34   1HB   MET   5          2HB       MET   5-117.554 -41.583 -39.765
   35   2HB   MET   5          1HB       MET   5-116.384 -40.321 -40.129
   36   1HG   MET   5          2HG       MET   5-116.787 -41.497 -42.573
   37   2HG   MET   5          1HG       MET   5-118.384 -41.572 -41.831
   38   1HE   MET   5          1HE       MET   5-116.773 -38.796 -44.343
   39   2HE   MET   5          2HE       MET   5-118.528 -38.965 -44.412
   40   3HE   MET   5          3HE       MET   5-117.507 -40.400 -44.329
   41    H    ASP   6           H        ASP   6-114.094 -42.225 -38.514
   42    HA   ASP   6           HA       ASP   6-112.265 -40.256 -39.593
   43   1HB   ASP   6          2HB       ASP   6-111.021 -41.039 -37.356
   44   2HB   ASP   6          1HB       ASP   6-112.351 -39.888 -37.331
   45    H    MET   7           H        MET   7-112.360 -43.672 -38.850
   46    HA   MET   7           HA       MET   7-111.282 -45.447 -39.779
   47   1HB   MET   7          2HB       MET   7-110.997 -43.570 -41.762
   48   2HB   MET   7          1HB       MET   7-109.328 -43.991 -41.410
   49   1HG   MET   7          2HG       MET   7-109.505 -45.982 -42.385
   50   2HG   MET   7          1HG       MET   7-111.068 -46.311 -41.637
   51   1HE   MET   7          1HE       MET   7-113.021 -44.866 -42.156
   52   2HE   MET   7          2HE       MET   7-113.563 -45.962 -43.428
   53   3HE   MET   7          3HE       MET   7-113.453 -44.229 -43.743
   54    H    SER   8           H        SER   8-108.764 -42.932 -39.734
   55    HA   SER   8           HA       SER   8-106.940 -44.738 -38.412
   56   1HB   SER   8          2HB       SER   8-106.122 -41.935 -38.646
   57   2HB   SER   8          1HB       SER   8-105.344 -43.391 -39.271
   58    HG   SER   8           HG       SER   8-106.652 -43.329 -41.059
   59    H    LEU   9           H        LEU   9-108.958 -44.518 -36.714
   60    HA   LEU   9           HA       LEU   9-109.156 -42.406 -34.946
   61   1HB   LEU   9          2HB       LEU   9-109.965 -45.155 -35.042
   62   2HB   LEU   9          1HB       LEU   9-109.400 -44.780 -33.427
   63    HG   LEU   9           HG       LEU   9-111.332 -42.904 -34.698
   64   1HD1  LEU   9          1HD1      LEU   9-112.025 -45.628 -33.621
   65   2HD1  LEU   9          2HD1      LEU   9-112.377 -44.978 -35.223
   66   3HD1  LEU   9          3HD1      LEU   9-113.190 -44.317 -33.804
   67   1HD2  LEU   9          1HD2      LEU   9-111.775 -43.764 -31.966
   68   2HD2  LEU   9          2HD2      LEU   9-111.523 -42.142 -32.613
   69   3HD2  LEU   9          3HD2      LEU   9-110.138 -43.157 -32.211
   70    H    ASP  10           H        ASP  10-107.084 -45.272 -34.638
   71    HA   ASP  10           HA       ASP  10-105.844 -44.616 -32.235
   72   1HB   ASP  10          2HB       ASP  10-105.557 -46.821 -33.071
   73   2HB   ASP  10          1HB       ASP  10-104.913 -46.238 -34.602
   74    H    ASP  11           H        ASP  11-104.917 -43.833 -35.551
   75    HA   ASP  11           HA       ASP  11-102.479 -42.570 -34.994
   76   1HB   ASP  11          2HB       ASP  11-103.168 -43.264 -37.260
   77   2HB   ASP  11          1HB       ASP  11-104.401 -42.008 -37.263
   78    H    ILE  12           H        ILE  12-105.759 -41.251 -35.316
   79    HA   ILE  12           HA       ILE  12-105.088 -38.553 -34.926
   80    HB   ILE  12           HB       ILE  12-107.662 -39.923 -34.146
   81   1HG1  ILE  12          2HG1      ILE  12-107.259 -38.336 -36.662
   82   2HG1  ILE  12          1HG1      ILE  12-106.763 -40.025 -36.609
   83   1HG2  ILE  12          1HG2      ILE  12-108.517 -37.917 -33.623
   84   2HG2  ILE  12          2HG2      ILE  12-107.749 -37.127 -35.001
   85   3HG2  ILE  12          3HG2      ILE  12-106.835 -37.383 -33.508
   86   1HD1  ILE  12          1HD1      ILE  12-109.472 -39.506 -35.623
   87   2HD1  ILE  12          2HD1      ILE  12-108.869 -40.771 -36.694
   88   3HD1  ILE  12          3HD1      ILE  12-109.216 -39.164 -37.333
   89    H    ILE  13           H        ILE  13-106.331 -40.942 -32.592
   90    HA   ILE  13           HA       ILE  13-106.203 -39.378 -30.301
   91    HB   ILE  13           HB       ILE  13-105.661 -42.342 -30.542
   92   1HG1  ILE  13          2HG1      ILE  13-108.206 -41.014 -29.630
   93   2HG1  ILE  13          1HG1      ILE  13-107.904 -41.369 -31.328
   94   1HG2  ILE  13          1HG2      ILE  13-104.834 -41.267 -28.423
   95   2HG2  ILE  13          2HG2      ILE  13-106.039 -42.538 -28.203
   96   3HG2  ILE  13          3HG2      ILE  13-106.510 -40.845 -28.072
   97   1HD1  ILE  13          1HD1      ILE  13-107.451 -43.618 -29.517
   98   2HD1  ILE  13          2HD1      ILE  13-108.298 -43.551 -31.065
   99   3HD1  ILE  13          3HD1      ILE  13-109.118 -43.045 -29.586
  100    H    LYS  14           H        LYS  14-103.710 -41.534 -31.623
  101    HA   LYS  14           HA       LYS  14-101.708 -41.052 -29.755
  102   1HB   LYS  14          2HB       LYS  14-101.730 -41.888 -32.621
  103   2HB   LYS  14          1HB       LYS  14-100.192 -41.515 -31.856
  104   1HG   LYS  14          2HG       LYS  14-102.115 -43.725 -31.248
  105   2HG   LYS  14          1HG       LYS  14-100.387 -43.811 -31.592
  106   1HD   LYS  14          2HD       LYS  14-101.283 -42.336 -29.162
  107   2HD   LYS  14          1HD       LYS  14-101.319 -44.099 -29.139
  108   1HE   LYS  14          2HE       LYS  14 -98.853 -42.807 -30.153
  109   2HE   LYS  14          1HE       LYS  14 -99.169 -42.690 -28.422
  110   1HZ   LYS  14          1HZ       LYS  14 -98.033 -44.646 -28.512
  111   2HZ   LYS  14          2HZ       LYS  14 -98.595 -45.053 -30.057
  112   3HZ   LYS  14          3HZ       LYS  14 -99.604 -45.245 -28.708
  113    H    LEU  15           H        LEU  15-102.390 -39.371 -32.804
  114    HA   LEU  15           HA       LEU  15-100.248 -37.535 -32.595
  115   1HB   LEU  15          2HB       LEU  15-102.024 -38.179 -34.539
  116   2HB   LEU  15          1HB       LEU  15-102.684 -36.646 -33.997
  117    HG   LEU  15           HG       LEU  15 -99.950 -36.172 -34.281
  118   1HD1  LEU  15          1HD1      LEU  15-100.774 -37.308 -36.886
  119   2HD1  LEU  15          2HD1      LEU  15-100.255 -38.440 -35.638
  120   3HD1  LEU  15          3HD1      LEU  15 -99.170 -37.155 -36.168
  121   1HD2  LEU  15          1HD2      LEU  15-101.140 -34.394 -34.957
  122   2HD2  LEU  15          2HD2      LEU  15-102.474 -35.384 -35.551
  123   3HD2  LEU  15          3HD2      LEU  15-101.038 -35.152 -36.548
  124    H    ASN  16           H        ASN  16-103.527 -37.556 -31.403
  125    HA   ASN  16           HA       ASN  16-103.855 -34.867 -30.778
  126   1HB   ASN  16          2HB       ASN  16-105.101 -37.395 -29.982
  127   2HB   ASN  16          1HB       ASN  16-105.178 -36.153 -28.734
  128   1HD2  ASN  16          1HD2      ASN  16-105.902 -36.859 -32.087
  129   2HD2  ASN  16          2HD2      ASN  16-107.211 -35.718 -32.234
  130    H    ARG  17           H        ARG  17-102.545 -37.512 -28.804
  131    HA   ARG  17           HA       ARG  17-101.862 -35.685 -26.669
  132   1HB   ARG  17          2HB       ARG  17-101.104 -37.640 -25.460
  133   2HB   ARG  17          1HB       ARG  17-102.679 -37.955 -26.170
  134   1HG   ARG  17          2HG       ARG  17-100.646 -38.781 -27.995
  135   2HG   ARG  17          1HG       ARG  17-100.327 -39.476 -26.405
  136   1HD   ARG  17          2HD       ARG  17-102.770 -39.784 -28.132
  137   2HD   ARG  17          1HD       ARG  17-101.700 -41.038 -27.512
  138    HE   ARG  17           HE       ARG  17-103.929 -39.810 -26.160
  139   1HH1  ARG  17          1HH1      ARG  17-100.900 -41.523 -25.737
  140   2HH1  ARG  17          2HH1      ARG  17-101.352 -42.202 -24.204
  141   1HH2  ARG  17          1HH2      ARG  17-104.530 -40.721 -24.139
  142   2HH2  ARG  17          2HH2      ARG  17-103.399 -41.744 -23.295
  143    H    ASN  18           H        ASN  18-100.282 -37.071 -29.427
  144    HA   ASN  18           HA       ASN  18 -97.615 -36.655 -28.436
  145   1HB   ASN  18          2HB       ASN  18 -97.032 -37.939 -30.171
  146   2HB   ASN  18          1HB       ASN  18 -98.738 -38.065 -30.578
  147   1HD2  ASN  18          1HD2      ASN  18 -95.693 -36.953 -31.552
  148   2HD2  ASN  18          2HD2      ASN  18 -96.194 -36.115 -32.984
  149    H    GLN  19           H        GLN  19 -99.991 -34.750 -30.048
  150    HA   GLN  19           HA       GLN  19 -98.330 -32.740 -31.119
  151   1HB   GLN  19          2HB       GLN  19-101.204 -32.924 -30.332
  152   2HB   GLN  19          1HB       GLN  19-100.523 -31.334 -30.654
  153   1HG   GLN  19          2HG       GLN  19 -99.937 -33.385 -32.671
  154   2HG   GLN  19          1HG       GLN  19-101.635 -32.928 -32.521
  155   1HE2  GLN  19          1HE2      GLN  19 -98.446 -31.884 -33.400
  156   2HE2  GLN  19          2HE2      GLN  19 -98.925 -30.392 -34.143
  157    H    ARG  20           H        ARG  20 -99.382 -33.434 -27.901
  158    HA   ARG  20           HA       ARG  20 -98.336 -30.865 -26.950
  159   1HB   ARG  20          2HB       ARG  20-100.597 -32.372 -26.219
  160   2HB   ARG  20          1HB       ARG  20 -99.477 -32.498 -24.868
  161   1HG   ARG  20          2HG       ARG  20-100.936 -30.633 -24.509
  162   2HG   ARG  20          1HG       ARG  20 -99.308 -30.032 -24.831
  163   1HD   ARG  20          2HD       ARG  20 -99.875 -29.232 -26.924
  164   2HD   ARG  20          1HD       ARG  20-101.246 -30.328 -27.084
  165    HE   ARG  20           HE       ARG  20-101.189 -27.768 -25.685
  166   1HH1  ARG  20          1HH1      ARG  20-102.965 -30.652 -26.584
  167   2HH1  ARG  20          2HH1      ARG  20-104.505 -30.019 -26.075
  168   1HH2  ARG  20          1HH2      ARG  20-103.223 -26.917 -25.037
  169   2HH2  ARG  20          2HH2      ARG  20-104.653 -27.897 -25.209
  170    H    ARG  21           H        ARG  21 -96.846 -33.372 -27.817
  171    HA   ARG  21           HA       ARG  21 -95.529 -34.205 -25.369
  172   1HB   ARG  21          2HB       ARG  21 -95.917 -35.367 -27.881
  173   2HB   ARG  21          1HB       ARG  21 -94.196 -35.010 -27.818
  174   1HG   ARG  21          2HG       ARG  21 -94.406 -37.188 -26.996
  175   2HG   ARG  21          1HG       ARG  21 -94.188 -36.178 -25.567
  176   1HD   ARG  21          2HD       ARG  21 -96.975 -36.368 -26.202
  177   2HD   ARG  21          1HD       ARG  21 -96.275 -37.985 -26.111
  178    HE   ARG  21           HE       ARG  21 -95.350 -37.129 -23.872
  179   1HH1  ARG  21          1HH1      ARG  21 -98.437 -36.196 -25.251
  180   2HH1  ARG  21          2HH1      ARG  21 -99.182 -35.890 -23.708
  181   1HH2  ARG  21          1HH2      ARG  21 -96.321 -36.721 -21.843
  182   2HH2  ARG  21          2HH2      ARG  21 -97.979 -36.200 -21.778
  183    H    VAL  22           H        VAL  22 -95.278 -31.556 -25.571
  184    HA   VAL  22           HA       VAL  22 -92.447 -31.164 -25.774
  185    HB   VAL  22           HB       VAL  22 -92.867 -30.809 -28.095
  186   1HG1  VAL  22          1HG1      VAL  22 -94.556 -29.299 -28.971
  187   2HG1  VAL  22          2HG1      VAL  22 -95.091 -28.919 -27.335
  188   3HG1  VAL  22          3HG1      VAL  22 -95.303 -30.548 -27.974
  189   1HG2  VAL  22          1HG2      VAL  22 -91.376 -29.165 -27.757
  190   2HG2  VAL  22          2HG2      VAL  22 -92.277 -28.488 -26.400
  191   3HG2  VAL  22          3HG2      VAL  22 -92.749 -28.096 -28.055
  192    H    ASN  23           H        ASN  23 -91.914 -29.874 -24.151
  193    HA   ASN  23           HA       ASN  23 -93.920 -28.397 -22.714
  194   1HB   ASN  23          2HB       ASN  23 -92.035 -29.519 -21.562
  195   2HB   ASN  23          1HB       ASN  23 -90.914 -28.413 -22.350
  196   1HD2  ASN  23          1HD2      ASN  23 -93.833 -28.397 -20.336
  197   2HD2  ASN  23          2HD2      ASN  23 -93.362 -27.025 -19.383
  198    H    ARG  24           H        ARG  24 -94.579 -26.420 -23.221
  199    HA   ARG  24           HA       ARG  24 -92.651 -24.573 -24.451
  200   1HB   ARG  24          2HB       ARG  24 -94.324 -25.693 -26.089
  201   2HB   ARG  24          1HB       ARG  24 -95.516 -24.634 -25.352
  202   1HG   ARG  24          2HG       ARG  24 -94.481 -22.707 -26.153
  203   2HG   ARG  24          1HG       ARG  24 -92.961 -23.547 -26.473
  204   1HD   ARG  24          2HD       ARG  24 -93.757 -24.529 -28.405
  205   2HD   ARG  24          1HD       ARG  24 -95.442 -24.385 -27.907
  206    HE   ARG  24           HE       ARG  24 -93.768 -22.192 -28.938
  207   1HH1  ARG  24          1HH1      ARG  24 -96.920 -23.590 -28.281
  208   2HH1  ARG  24          2HH1      ARG  24 -97.781 -22.316 -29.103
  209   1HH2  ARG  24          1HH2      ARG  24 -94.914 -20.540 -30.026
  210   2HH2  ARG  24          2HH2      ARG  24 -96.651 -20.613 -30.100
  211    H    GLY  25           H        GLY  25 -92.622 -23.956 -22.119
  212   1HA   GLY  25          2HA       GLY  25 -94.950 -22.531 -21.138
  213   2HA   GLY  25          1HA       GLY  25 -93.387 -22.665 -20.338
  214    H    GLY  26           H        GLY  26 -91.779 -21.755 -22.464
  215   1HA   GLY  26          2HA       GLY  26 -92.631 -19.307 -23.563
  216   2HA   GLY  26          1HA       GLY  26 -91.806 -18.994 -22.041
  217    H    GLY  27           H        GLY  27 -90.760 -17.955 -24.315
  218   1HA   GLY  27          2HA       GLY  27 -88.269 -19.494 -24.544
  219   2HA   GLY  27          1HA       GLY  27 -89.115 -19.067 -26.024
  220    HA   PRO  28           HA       PRO  28 -87.450 -14.954 -24.197
  221   1HB   PRO  28          2HB       PRO  28 -85.791 -15.049 -22.085
  222   2HB   PRO  28          1HB       PRO  28 -87.548 -15.050 -21.889
  223   1HG   PRO  28          2HG       PRO  28 -85.620 -17.328 -21.744
  224   2HG   PRO  28          1HG       PRO  28 -87.043 -16.997 -20.742
  225   1HD   PRO  28          2HD       PRO  28 -86.992 -18.779 -22.844
  226   2HD   PRO  28          1HD       PRO  28 -88.460 -17.997 -22.225
  227    H    ARG  29           H        ARG  29 -85.579 -13.855 -24.845
  228    HA   ARG  29           HA       ARG  29 -83.592 -15.551 -26.133
  229   1HB   ARG  29          2HB       ARG  29 -84.819 -13.212 -26.887
  230   2HB   ARG  29          1HB       ARG  29 -83.252 -12.642 -26.333
  231   1HG   ARG  29          2HG       ARG  29 -83.410 -13.154 -28.776
  232   2HG   ARG  29          1HG       ARG  29 -82.104 -13.972 -27.918
  233   1HD   ARG  29          2HD       ARG  29 -84.545 -15.534 -27.904
  234   2HD   ARG  29          1HD       ARG  29 -84.026 -15.148 -29.544
  235    HE   ARG  29           HE       ARG  29 -82.632 -16.816 -27.605
  236   1HH1  ARG  29          1HH1      ARG  29 -82.579 -15.199 -30.713
  237   2HH1  ARG  29          2HH1      ARG  29 -81.215 -16.105 -31.301
  238   1HH2  ARG  29          1HH2      ARG  29 -80.867 -18.019 -28.379
  239   2HH2  ARG  29          2HH2      ARG  29 -80.261 -17.744 -29.982
  240    H    ARG  30           H        ARG  30 -81.546 -15.791 -25.491
  241    HA   ARG  30           HA       ARG  30 -80.761 -15.250 -22.881
  242   1HB   ARG  30          2HB       ARG  30 -79.717 -17.009 -24.158
  243   2HB   ARG  30          1HB       ARG  30 -79.099 -15.853 -25.330
  244   1HG   ARG  30          2HG       ARG  30 -78.035 -14.918 -22.995
  245   2HG   ARG  30          1HG       ARG  30 -78.024 -16.664 -22.740
  246   1HD   ARG  30          2HD       ARG  30 -75.937 -15.903 -23.755
  247   2HD   ARG  30          1HD       ARG  30 -76.824 -16.974 -24.840
  248    HE   ARG  30           HE       ARG  30 -77.633 -14.768 -25.867
  249   1HH1  ARG  30          1HH1      ARG  30 -74.465 -15.228 -24.440
  250   2HH1  ARG  30          2HH1      ARG  30 -73.695 -14.055 -25.471
  251   1HH2  ARG  30          1HH2      ARG  30 -76.639 -13.235 -27.205
  252   2HH2  ARG  30          2HH2      ARG  30 -74.933 -12.912 -27.047
  253    H    ASN  31           H        ASN  31 -79.764 -13.638 -21.875
  254    HA   ASN  31           HA       ASN  31 -79.666 -11.041 -22.847
  255   1HB   ASN  31          2HB       ASN  31 -79.588 -11.160 -20.534
  256   2HB   ASN  31          1HB       ASN  31 -78.405 -12.462 -20.536
  257   1HD2  ASN  31          1HD2      ASN  31 -76.355 -11.969 -20.154
  258   2HD2  ASN  31          2HD2      ASN  31 -75.695 -10.369 -20.134
  259    H    ARG  32           H        ARG  32 -78.388 -10.050 -24.232
  260    HA   ARG  32           HA       ARG  32 -75.855 -11.323 -24.984
  261   1HB   ARG  32          2HB       ARG  32 -76.990 -11.088 -26.969
  262   2HB   ARG  32          1HB       ARG  32 -77.869  -9.668 -26.425
  263   1HG   ARG  32          2HG       ARG  32 -75.140  -8.953 -26.582
  264   2HG   ARG  32          1HG       ARG  32 -75.551  -9.819 -28.063
  265   1HD   ARG  32          2HD       ARG  32 -75.897  -7.284 -28.032
  266   2HD   ARG  32          1HD       ARG  32 -77.213  -8.284 -28.641
  267    HE   ARG  32           HE       ARG  32 -77.160  -7.140 -25.915
  268   1HH1  ARG  32          1HH1      ARG  32 -78.881  -8.022 -28.847
  269   2HH1  ARG  32          2HH1      ARG  32 -80.415  -7.433 -28.269
  270   1HH2  ARG  32          1HH2      ARG  32 -79.156  -6.395 -25.156
  271   2HH2  ARG  32          2HH2      ARG  32 -80.581  -6.544 -26.151
  272    HA   PRO  33           HA       PRO  33 -73.785  -7.995 -22.853
  273   1HB   PRO  33          2HB       PRO  33 -71.390  -8.883 -24.295
  274   2HB   PRO  33          1HB       PRO  33 -71.718  -8.891 -22.560
  275   1HG   PRO  33          2HG       PRO  33 -71.593 -11.159 -24.015
  276   2HG   PRO  33          1HG       PRO  33 -72.668 -10.984 -22.614
  277   1HD   PRO  33          2HD       PRO  33 -73.313 -10.815 -25.533
  278   2HD   PRO  33          1HD       PRO  33 -74.233 -11.576 -24.216
  279    H    ALA  34           H        ALA  34 -74.526  -6.143 -23.833
  280    HA   ALA  34           HA       ALA  34 -73.650  -5.461 -26.523
  281   1HB   ALA  34          1HB       ALA  34 -75.899  -4.836 -24.964
  282   2HB   ALA  34          2HB       ALA  34 -75.527  -4.273 -26.593
  283   3HB   ALA  34          3HB       ALA  34 -75.027  -3.321 -25.195
  284    H    ILE  35           H        ILE  35 -71.444  -5.680 -25.197
  285    HA   ILE  35           HA       ILE  35 -69.481  -4.677 -24.760
  286    HB   ILE  35           HB       ILE  35 -70.873  -2.047 -25.299
  287   1HG1  ILE  35          2HG1      ILE  35 -68.939  -3.026 -27.262
  288   2HG1  ILE  35          1HG1      ILE  35 -70.332  -4.090 -27.096
  289   1HG2  ILE  35          1HG2      ILE  35 -68.059  -2.053 -25.803
  290   2HG2  ILE  35          2HG2      ILE  35 -68.361  -2.630 -24.162
  291   3HG2  ILE  35          3HG2      ILE  35 -68.982  -1.058 -24.676
  292   1HD1  ILE  35          1HD1      ILE  35 -70.388  -1.155 -27.755
  293   2HD1  ILE  35          2HD1      ILE  35 -71.810  -2.170 -27.517
  294   3HD1  ILE  35          3HD1      ILE  35 -70.709  -2.493 -28.857
  295    H    ALA  36           H        ALA  36 -69.507  -5.372 -22.708
  296    HA   ALA  36           HA       ALA  36 -70.909  -4.202 -20.572
  297   1HB   ALA  36          1HB       ALA  36 -68.283  -5.600 -20.208
  298   2HB   ALA  36          2HB       ALA  36 -69.739  -6.483 -20.672
  299   3HB   ALA  36          3HB       ALA  36 -69.698  -5.588 -19.152
  300    H    ARG  37           H        ARG  37 -70.753  -2.140 -20.262
  301    HA   ARG  37           HA       ARG  37 -68.818  -0.335 -20.770
  302   1HB   ARG  37          2HB       ARG  37 -69.772   1.069 -18.959
  303   2HB   ARG  37          1HB       ARG  37 -70.984   0.364 -20.015
  304   1HG   ARG  37          2HG       ARG  37 -70.297  -1.073 -17.505
  305   2HG   ARG  37          1HG       ARG  37 -71.275   0.391 -17.402
  306   1HD   ARG  37          2HD       ARG  37 -72.626  -0.779 -19.332
  307   2HD   ARG  37          1HD       ARG  37 -71.900  -2.240 -18.656
  308    HE   ARG  37           HE       ARG  37 -72.892  -1.276 -16.455
  309   1HH1  ARG  37          1HH1      ARG  37 -74.356  -1.099 -19.628
  310   2HH1  ARG  37          2HH1      ARG  37 -75.985  -1.113 -19.026
  311   1HH2  ARG  37          1HH2      ARG  37 -75.023  -1.291 -15.652
  312   2HH2  ARG  37          2HH2      ARG  37 -76.364  -1.219 -16.755
  313    H    GLY  38           H        GLY  38 -66.741  -0.524 -20.380
  314   1HA   GLY  38          2HA       GLY  38 -65.878  -0.497 -17.587
  315   2HA   GLY  38          1HA       GLY  38 -65.187  -1.721 -18.647
  316    H    GLY  39           H        GLY  39 -66.066   1.416 -19.821
  317   1HA   GLY  39          2HA       GLY  39 -63.315   2.364 -19.729
  318   2HA   GLY  39          1HA       GLY  39 -63.989   2.055 -21.322
  319    H    ARG  40           H        ARG  40 -65.017   3.648 -22.297
  320    HA   ARG  40           HA       ARG  40 -65.921   5.680 -22.721
  321   1HB   ARG  40          2HB       ARG  40 -67.130   5.084 -20.030
  322   2HB   ARG  40          1HB       ARG  40 -67.484   6.581 -20.878
  323   1HG   ARG  40          2HG       ARG  40 -69.158   5.454 -21.818
  324   2HG   ARG  40          1HG       ARG  40 -67.915   4.696 -22.814
  325   1HD   ARG  40          2HD       ARG  40 -68.027   2.730 -21.702
  326   2HD   ARG  40          1HD       ARG  40 -68.369   3.500 -20.154
  327    HE   ARG  40           HE       ARG  40 -70.672   3.668 -20.797
  328   1HH1  ARG  40          1HH1      ARG  40 -68.688   1.731 -22.962
  329   2HH1  ARG  40          2HH1      ARG  40 -70.048   0.850 -23.601
  330   1HH2  ARG  40          1HH2      ARG  40 -72.440   2.484 -21.644
  331   2HH2  ARG  40          2HH2      ARG  40 -72.160   1.270 -22.860
  332    H    ASN  41           H        ASN  41 -63.309   5.676 -21.884
  333    HA   ASN  41           HA       ASN  41 -61.627   7.003 -21.178
  334   1HB   ASN  41          2HB       ASN  41 -62.993   8.794 -22.333
  335   2HB   ASN  41          1HB       ASN  41 -63.664   9.196 -20.755
  336   1HD2  ASN  41          1HD2      ASN  41 -62.560  10.537 -19.463
  337   2HD2  ASN  41          2HD2      ASN  41 -60.956  11.115 -19.775
  338    H    ARG  42           H        ARG  42 -61.236   5.773 -19.400
  339    HA   ARG  42           HA       ARG  42 -61.581   7.059 -16.877
  340   1HB   ARG  42          2HB       ARG  42 -63.781   6.051 -17.076
  341   2HB   ARG  42          1HB       ARG  42 -63.058   4.485 -17.415
  342   1HG   ARG  42          2HG       ARG  42 -63.292   4.090 -15.235
  343   2HG   ARG  42          1HG       ARG  42 -61.925   5.186 -15.008
  344   1HD   ARG  42          2HD       ARG  42 -64.785   6.102 -15.133
  345   2HD   ARG  42          1HD       ARG  42 -63.966   5.689 -13.627
  346    HE   ARG  42           HE       ARG  42 -63.459   8.007 -15.328
  347   1HH1  ARG  42          1HH1      ARG  42 -62.691   6.175 -12.448
  348   2HH1  ARG  42          2HH1      ARG  42 -61.688   7.420 -11.759
  349   1HH2  ARG  42          1HH2      ARG  42 -62.154   9.656 -14.433
  350   2HH2  ARG  42          2HH2      ARG  42 -61.392   9.410 -12.884
  351    HA   PRO  43           HA       PRO  43 -58.812   3.071 -16.398
  352   1HB   PRO  43          2HB       PRO  43 -58.794   1.952 -19.125
  353   2HB   PRO  43          1HB       PRO  43 -58.963   1.124 -17.574
  354   1HG   PRO  43          2HG       PRO  43 -61.029   1.391 -19.262
  355   2HG   PRO  43          1HG       PRO  43 -61.244   1.437 -17.503
  356   1HD   PRO  43          2HD       PRO  43 -61.193   3.694 -19.465
  357   2HD   PRO  43          1HD       PRO  43 -62.223   3.459 -18.041
  358    H    ALA  44           H        ALA  44 -59.043   5.167 -19.059
  359    HA   ALA  44           HA       ALA  44 -56.251   5.872 -18.853
  360   1HB   ALA  44          1HB       ALA  44 -56.288   4.097 -20.593
  361   2HB   ALA  44          2HB       ALA  44 -55.777   5.666 -21.216
  362   3HB   ALA  44          3HB       ALA  44 -57.413   5.082 -21.529
  363    HA   PRO  45           HA       PRO  45 -58.302   9.796 -19.349
  364   1HB   PRO  45          2HB       PRO  45 -55.640  10.920 -19.859
  365   2HB   PRO  45          1HB       PRO  45 -56.745  11.225 -18.515
  366   1HG   PRO  45          2HG       PRO  45 -54.457   9.842 -18.196
  367   2HG   PRO  45          1HG       PRO  45 -55.920   9.474 -17.265
  368   1HD   PRO  45          2HD       PRO  45 -54.802   8.079 -19.671
  369   2HD   PRO  45          1HD       PRO  45 -55.508   7.386 -18.196
  370    H    TYR  46           H        TYR  46 -56.438   8.220 -21.689
  371    HA   TYR  46           HA       TYR  46 -57.904   9.302 -23.837
  372   1HB   TYR  46          2HB       TYR  46 -55.776  10.925 -23.155
  373   2HB   TYR  46          1HB       TYR  46 -55.095   9.924 -24.431
  374    HD1  TYR  46           1HD      TYR  46 -57.924   9.601 -25.806
  375    HD2  TYR  46           2HD      TYR  46 -55.618  12.935 -24.515
  376    HE1  TYR  46           1HE      TYR  46 -59.016  11.009 -27.501
  377    HE2  TYR  46           2HE      TYR  46 -56.706  14.348 -26.203
  378    HH   TYR  46           HH       TYR  46 -59.486  13.560 -27.754
  379    H    SER  47           H        SER  47 -55.483   8.770 -25.650
  380    HA   SER  47           HA       SER  47 -55.906   6.128 -26.290
  381   1HB   SER  47          2HB       SER  47 -53.215   6.701 -26.921
  382   2HB   SER  47          1HB       SER  47 -54.622   6.877 -27.973
  383    HG   SER  47           HG       SER  47 -53.620   8.871 -27.835
  384    H    ARG  48           H        ARG  48 -53.289   7.485 -24.304
  385    HA   ARG  48           HA       ARG  48 -53.210   5.048 -22.730
  386   1HB   ARG  48          2HB       ARG  48 -51.554   4.963 -24.755
  387   2HB   ARG  48          1HB       ARG  48 -50.606   6.092 -23.800
  388   1HG   ARG  48          2HG       ARG  48 -49.758   3.924 -23.378
  389   2HG   ARG  48          1HG       ARG  48 -50.649   4.420 -21.939
  390   1HD   ARG  48          2HD       ARG  48 -52.582   3.169 -23.421
  391   2HD   ARG  48          1HD       ARG  48 -51.146   2.216 -23.798
  392    HE   ARG  48           HE       ARG  48 -50.875   2.076 -21.279
  393   1HH1  ARG  48          1HH1      ARG  48 -53.980   2.224 -22.909
  394   2HH1  ARG  48          2HH1      ARG  48 -54.855   1.558 -21.562
  395   1HH2  ARG  48          1HH2      ARG  48 -52.039   1.177 -19.513
  396   2HH2  ARG  48          2HH2      ARG  48 -53.761   0.960 -19.651
  397    HA   PRO  49           HA       PRO  49 -52.575   8.218 -19.641
  398   1HB   PRO  49          2HB       PRO  49 -51.977   6.553 -17.569
  399   2HB   PRO  49          1HB       PRO  49 -53.627   6.832 -18.138
  400   1HG   PRO  49          2HG       PRO  49 -51.776   4.557 -18.731
  401   2HG   PRO  49          1HG       PRO  49 -53.511   4.522 -18.365
  402   1HD   PRO  49          2HD       PRO  49 -52.559   4.316 -20.885
  403   2HD   PRO  49          1HD       PRO  49 -54.104   5.109 -20.514
  404    H    LYS  50           H        LYS  50 -50.829   9.216 -18.650
  405    HA   LYS  50           HA       LYS  50 -48.228   8.623 -19.560
  406   1HB   LYS  50          2HB       LYS  50 -47.557  10.211 -17.636
  407   2HB   LYS  50          1HB       LYS  50 -48.538  10.854 -18.945
  408   1HG   LYS  50          2HG       LYS  50 -50.378   9.935 -17.070
  409   2HG   LYS  50          1HG       LYS  50 -49.101  10.699 -16.123
  410   1HD   LYS  50          2HD       LYS  50 -50.597  11.952 -18.424
  411   2HD   LYS  50          1HD       LYS  50 -50.844  12.306 -16.714
  412   1HE   LYS  50          2HE       LYS  50 -48.080  12.574 -17.722
  413   2HE   LYS  50          1HE       LYS  50 -49.244  13.758 -18.317
  414   1HZ   LYS  50          1HZ       LYS  50 -49.694  14.490 -16.149
  415   2HZ   LYS  50          2HZ       LYS  50 -48.007  14.351 -16.222
  416   3HZ   LYS  50          3HZ       LYS  50 -48.923  13.161 -15.432
  417    HA   PRO  51           HA       PRO  51 -47.537   5.095 -16.945
  418   1HB   PRO  51          2HB       PRO  51 -44.747   5.418 -17.866
  419   2HB   PRO  51          1HB       PRO  51 -45.830   4.030 -18.022
  420   1HG   PRO  51          2HG       PRO  51 -45.211   5.556 -20.131
  421   2HG   PRO  51          1HG       PRO  51 -46.829   4.858 -19.935
  422   1HD   PRO  51          2HD       PRO  51 -45.894   7.653 -19.427
  423   2HD   PRO  51          1HD       PRO  51 -47.415   7.085 -20.151
  424    H    LEU  52           H        LEU  52 -44.970   7.567 -17.059
  425    HA   LEU  52           HA       LEU  52 -43.489   8.300 -15.497
  426   1HB   LEU  52          2HB       LEU  52 -46.151   8.349 -14.186
  427   2HB   LEU  52          1HB       LEU  52 -44.753   8.581 -13.153
  428    HG   LEU  52           HG       LEU  52 -44.208  10.317 -15.186
  429   1HD1  LEU  52          1HD1      LEU  52 -47.160  10.575 -14.684
  430   2HD1  LEU  52          2HD1      LEU  52 -46.490   9.783 -16.111
  431   3HD1  LEU  52          3HD1      LEU  52 -46.159  11.490 -15.812
  432   1HD2  LEU  52          1HD2      LEU  52 -44.162  10.625 -12.682
  433   2HD2  LEU  52          2HD2      LEU  52 -45.872  11.037 -12.787
  434   3HD2  LEU  52          3HD2      LEU  52 -44.674  12.027 -13.620
  435    HA   PRO  53           HA       PRO  53 -42.904   3.968 -13.878
  436   1HB   PRO  53          2HB       PRO  53 -40.351   3.703 -14.781
  437   2HB   PRO  53          1HB       PRO  53 -41.769   3.320 -15.764
  438   1HG   PRO  53          2HG       PRO  53 -40.089   5.799 -15.746
  439   2HG   PRO  53          1HG       PRO  53 -40.725   4.889 -17.131
  440   1HD   PRO  53          2HD       PRO  53 -41.891   7.152 -16.248
  441   2HD   PRO  53          1HD       PRO  53 -42.836   5.806 -16.922
  442    H    ASP  54           H        ASP  54 -41.266   6.964 -13.542
  443    HA   ASP  54           HA       ASP  54 -40.040   7.925 -11.903
  444   1HB   ASP  54          2HB       ASP  54 -41.931   7.060 -10.489
  445   2HB   ASP  54          1HB       ASP  54 -40.939   5.650 -10.129
  446    H    LYS  55           H        LYS  55 -38.093   7.561 -12.925
  447    HA   LYS  55           HA       LYS  55 -36.638   5.113 -12.478
  448   1HB   LYS  55          2HB       LYS  55 -36.019   7.683 -13.917
  449   2HB   LYS  55          1HB       LYS  55 -34.782   6.463 -13.653
  450   1HG   LYS  55          2HG       LYS  55 -37.391   5.799 -14.971
  451   2HG   LYS  55          1HG       LYS  55 -36.019   6.436 -15.879
  452   1HD   LYS  55          2HD       LYS  55 -35.852   3.996 -14.121
  453   2HD   LYS  55          1HD       LYS  55 -36.228   3.924 -15.843
  454   1HE   LYS  55          2HE       LYS  55 -34.089   4.206 -16.420
  455   2HE   LYS  55          1HE       LYS  55 -33.882   5.545 -15.292
  456   1HZ   LYS  55          1HZ       LYS  55 -33.565   2.647 -14.775
  457   2HZ   LYS  55          2HZ       LYS  55 -33.755   3.762 -13.513
  458   3HZ   LYS  55          3HZ       LYS  55 -32.428   3.889 -14.562
  459    H    TRP  56           H        TRP  56 -36.489   5.093 -10.210
  460    HA   TRP  56           HA       TRP  56 -35.388   7.035  -8.564
  461   1HB   TRP  56          2HB       TRP  56 -35.889   4.177  -8.431
  462   2HB   TRP  56          1HB       TRP  56 -34.411   4.609  -7.578
  463    HD1  TRP  56           HD       TRP  56 -38.191   5.078  -7.442
  464    HE1  TRP  56           1HE      TRP  56 -38.830   6.035  -5.134
  465    HE3  TRP  56           3HE      TRP  56 -33.506   6.031  -5.651
  466    HZ2  TRP  56           2HZ      TRP  56 -37.509   7.049  -2.859
  467    HZ3  TRP  56           3HZ      TRP  56 -33.278   6.993  -3.398
  468    HH2  TRP  56           HH       TRP  56 -35.238   7.492  -2.032
  469    H    GLN  57           H        GLN  57 -33.726   4.368 -10.217
  470    HA   GLN  57           HA       GLN  57 -31.147   5.582  -9.757
  471   1HB   GLN  57          2HB       GLN  57 -32.112   2.995 -10.522
  472   2HB   GLN  57          1HB       GLN  57 -30.967   3.555 -11.733
  473   1HG   GLN  57          2HG       GLN  57 -29.472   2.628 -10.338
  474   2HG   GLN  57          1HG       GLN  57 -29.605   4.185  -9.514
  475   1HE2  GLN  57          1HE2      GLN  57 -30.942   4.325  -7.658
  476   2HE2  GLN  57          2HE2      GLN  57 -31.288   2.919  -6.709
  477    H    HIS  58           H        HIS  58 -31.345   7.570 -10.766
  478    HA   HIS  58           HA       HIS  58 -32.177   7.891 -13.464
  479   1HB   HIS  58          2HB       HIS  58 -30.539   9.702 -11.675
  480   2HB   HIS  58          1HB       HIS  58 -31.160  10.166 -13.255
  481    HD1  HIS  58           1HD      HIS  58 -33.841  10.242 -13.454
  482    HD2  HIS  58           2HD      HIS  58 -32.285  10.024  -9.604
  483    HE1  HIS  58           1HE      HIS  58 -35.708  10.945 -11.923
  484    HE2  HIS  58           2HE      HIS  58 -34.810  10.569  -9.602
  485    H    ASP  59           H        ASP  59 -28.956   8.679 -12.201
  486    HA   ASP  59           HA       ASP  59 -27.633   6.910 -14.057
  487   1HB   ASP  59          2HB       ASP  59 -28.235   9.218 -15.215
  488   2HB   ASP  59          1HB       ASP  59 -26.835   9.776 -14.302
  489    H    LEU  60           H        LEU  60 -27.216   6.328 -11.713
  490    HA   LEU  60           HA       LEU  60 -25.033   7.979 -10.660
  491   1HB   LEU  60          2HB       LEU  60 -26.354   6.390  -8.636
  492   2HB   LEU  60          1HB       LEU  60 -25.926   8.089  -8.651
  493    HG   LEU  60           HG       LEU  60 -27.996   8.286 -10.235
  494   1HD1  LEU  60          1HD1      LEU  60 -28.185   5.682 -10.040
  495   2HD1  LEU  60          2HD1      LEU  60 -29.638   6.681 -10.054
  496   3HD1  LEU  60          3HD1      LEU  60 -29.011   6.060  -8.527
  497   1HD2  LEU  60          1HD2      LEU  60 -28.796   9.419  -8.499
  498   2HD2  LEU  60          2HD2      LEU  60 -27.516   8.712  -7.512
  499   3HD2  LEU  60          3HD2      LEU  60 -29.096   7.930  -7.605
  500    H    PHE  61           H        PHE  61 -23.735   6.732  -9.017
  501    HA   PHE  61           HA       PHE  61 -22.187   5.199  -8.547
  502   1HB   PHE  61          2HB       PHE  61 -24.294   3.958  -8.101
  503   2HB   PHE  61          1HB       PHE  61 -24.115   3.199  -9.678
  504    HD1  PHE  61           1HD      PHE  61 -21.487   3.993  -7.182
  505    HD2  PHE  61           2HD      PHE  61 -23.710   0.959  -9.169
  506    HE1  PHE  61           1HE      PHE  61 -20.022   2.283  -6.196
  507    HE2  PHE  61           2HE      PHE  61 -22.250  -0.757  -8.183
  508    HZ   PHE  61           HZ       PHE  61 -20.404  -0.097  -6.694
  509    H    ASP  62           H        ASP  62 -23.468   5.107 -11.765
  510    HA   ASP  62           HA       ASP  62 -22.501   4.967 -13.802
  511   1HB   ASP  62          2HB       ASP  62 -20.122   5.338 -12.085
  512   2HB   ASP  62          1HB       ASP  62 -19.823   4.629 -13.669
  513    H    SER  63           H        SER  63 -20.940   2.738 -11.516
  514    HA   SER  63           HA       SER  63 -20.871   0.479 -11.421
  515   1HB   SER  63          2HB       SER  63 -22.672   0.233 -13.811
  516   2HB   SER  63          1HB       SER  63 -22.568  -0.801 -12.384
  517    HG   SER  63           HG       SER  63 -23.180   1.709 -11.654
  518    H    GLY  64           H        GLY  64 -21.286   0.738 -14.959
  519   1HA   GLY  64          2HA       GLY  64 -18.954  -0.842 -15.446
  520   2HA   GLY  64          1HA       GLY  64 -19.896   0.023 -16.655
  521    H    CYS  65           H        CYS  65 -19.646   2.558 -15.267
  522    HA   CYS  65           HA       CYS  65 -16.910   3.241 -16.026
  523   1HB   CYS  65          2HB       CYS  65 -18.745   5.371 -15.125
  524   2HB   CYS  65          1HB       CYS  65 -17.700   5.309 -16.541
  525    HG   CYS  65           HG       CYS  65 -19.560   3.424 -17.803
  526    H    GLY  66           H        GLY  66 -15.997   5.106 -14.537
  527   1HA   GLY  66          2HA       GLY  66 -15.301   5.780 -12.437
  528   2HA   GLY  66          1HA       GLY  66 -16.652   4.890 -11.747
  529    H    GLY  67           H        GLY  67 -14.417   3.318 -13.887
  530   1HA   GLY  67          2HA       GLY  67 -13.815   1.334 -11.921
  531   2HA   GLY  67          1HA       GLY  67 -13.125   1.444 -13.534
  532    H    GLY  68           H        GLY  68 -12.149   1.159 -10.567
  533   1HA   GLY  68          2HA       GLY  68  -9.576   1.658 -10.676
  534   2HA   GLY  68          1HA       GLY  68 -10.160   3.315 -10.583
  535    H    GLU  69           H        GLU  69  -8.456   2.119  -8.680
  536    HA   GLU  69           HA       GLU  69 -10.178   2.328  -6.319
  537   1HB   GLU  69          2HB       GLU  69  -9.248  -0.123  -7.208
  538   2HB   GLU  69          1HB       GLU  69  -8.098   0.322  -5.953
  539   1HG   GLU  69          2HG       GLU  69  -9.593   0.063  -4.303
  540   2HG   GLU  69          1HG       GLU  69 -10.920   0.723  -5.257
  541    H    GLY  70           H        GLY  70  -7.306   3.087  -7.928
  542   1HA   GLY  70          2HA       GLY  70  -6.101   5.000  -6.915
  543   2HA   GLY  70          1HA       GLY  70  -6.152   4.109  -5.400
  544    H    VAL  71           H        VAL  71  -5.701   1.845  -7.681
  545    HA   VAL  71           HA       VAL  71  -2.880   1.602  -7.171
  546    HB   VAL  71           HB       VAL  71  -3.047  -0.434  -8.594
  547   1HG1  VAL  71          1HG1      VAL  71  -4.587   0.064  -6.146
  548   2HG1  VAL  71          2HG1      VAL  71  -3.410  -1.198  -6.511
  549   3HG1  VAL  71          3HG1      VAL  71  -5.082  -1.368  -7.046
  550   1HG2  VAL  71          1HG2      VAL  71  -4.689  -0.586 -10.082
  551   2HG2  VAL  71          2HG2      VAL  71  -5.443   0.876  -9.434
  552   3HG2  VAL  71          3HG2      VAL  71  -5.851  -0.706  -8.760
  553    H    GLU  72           H        GLU  72  -4.918   2.930  -9.483
  554    HA   GLU  72           HA       GLU  72  -2.693   3.422 -11.344
  555   1HB   GLU  72          2HB       GLU  72  -5.119   4.102 -12.605
  556   2HB   GLU  72          1HB       GLU  72  -4.082   2.733 -12.974
  557   1HG   GLU  72          2HG       GLU  72  -6.325   1.953 -12.655
  558   2HG   GLU  72          1HG       GLU  72  -5.329   1.383 -11.317
  559    H    THR  73           H        THR  73  -5.842   4.925 -10.882
  560    HA   THR  73           HA       THR  73  -4.705   7.548 -10.643
  561    HB   THR  73           HB       THR  73  -7.527   6.504 -10.328
  562    HG1  THR  73           1HG      THR  73  -6.291   8.011 -12.425
  563   1HG2  THR  73          1HG2      THR  73  -8.125   8.941 -10.627
  564   2HG2  THR  73          2HG2      THR  73  -6.436   9.300 -10.262
  565   3HG2  THR  73          3HG2      THR  73  -7.444   8.489  -9.065
  566    H    GLY  74           H        GLY  74  -3.344   7.211  -8.798
  567   1HA   GLY  74          2HA       GLY  74  -4.572   7.903  -6.328
  568   2HA   GLY  74          1HA       GLY  74  -4.085   6.214  -6.327
  569    H    ALA  75           H        ALA  75  -2.396   6.251  -4.940
  570    HA   ALA  75           HA       ALA  75  -0.171   8.052  -5.651
  571   1HB   ALA  75          1HB       ALA  75   0.421   8.162  -3.318
  572   2HB   ALA  75          2HB       ALA  75  -0.865   7.027  -2.904
  573   3HB   ALA  75          3HB       ALA  75  -1.266   8.632  -3.517
  574    H    LYS  76           H        LYS  76   1.415   6.908  -6.573
  575    HA   LYS  76           HA       LYS  76   1.796   4.121  -5.748
  576   1HB   LYS  76          2HB       LYS  76   1.479   4.459  -8.128
  577   2HB   LYS  76          1HB       LYS  76   2.783   5.638  -8.169
  578   1HG   LYS  76          2HG       LYS  76   4.371   3.860  -7.539
  579   2HG   LYS  76          1HG       LYS  76   3.048   2.693  -7.598
  580   1HD   LYS  76          2HD       LYS  76   2.681   3.478  -9.995
  581   2HD   LYS  76          1HD       LYS  76   4.252   4.271  -9.856
  582   1HE   LYS  76          2HE       LYS  76   4.600   2.138 -10.867
  583   2HE   LYS  76          1HE       LYS  76   5.225   2.061  -9.221
  584   1HZ   LYS  76          1HZ       LYS  76   2.477   1.178  -9.841
  585   2HZ   LYS  76          2HZ       LYS  76   3.461   0.755  -8.520
  586   3HZ   LYS  76          3HZ       LYS  76   3.795   0.134 -10.065
  587    H    LEU  77           H        LEU  77   3.409   3.546  -4.534
  588    HA   LEU  77           HA       LEU  77   5.755   5.310  -4.283
  589   1HB   LEU  77          2HB       LEU  77   4.587   5.196  -2.212
  590   2HB   LEU  77          1HB       LEU  77   4.351   3.474  -2.354
  591    HG   LEU  77           HG       LEU  77   5.990   4.295  -0.598
  592   1HD1  LEU  77          1HD1      LEU  77   5.821   1.968  -1.341
  593   2HD1  LEU  77          2HD1      LEU  77   7.451   2.427  -0.847
  594   3HD1  LEU  77          3HD1      LEU  77   7.053   2.291  -2.561
  595   1HD2  LEU  77          1HD2      LEU  77   7.201   5.954  -1.816
  596   2HD2  LEU  77          2HD2      LEU  77   7.660   4.787  -3.056
  597   3HD2  LEU  77          3HD2      LEU  77   8.315   4.645  -1.425
  598    H    LEU  78           H        LEU  78   7.539   4.524  -5.221
  599    HA   LEU  78           HA       LEU  78   7.872   1.599  -5.355
  600   1HB   LEU  78          2HB       LEU  78   9.277   3.788  -6.896
  601   2HB   LEU  78          1HB       LEU  78   9.607   2.074  -7.056
  602    HG   LEU  78           HG       LEU  78   6.840   3.087  -7.563
  603   1HD1  LEU  78          1HD1      LEU  78   8.136   2.915 -10.036
  604   2HD1  LEU  78          2HD1      LEU  78   9.185   3.896  -9.011
  605   3HD1  LEU  78          3HD1      LEU  78   7.500   4.363  -9.255
  606   1HD2  LEU  78          1HD2      LEU  78   7.524   0.632  -7.445
  607   2HD2  LEU  78          2HD2      LEU  78   8.374   0.918  -8.965
  608   3HD2  LEU  78          3HD2      LEU  78   6.628   1.152  -8.874
  609    H    VAL  79           H        VAL  79   8.910   0.956  -3.550
  610    HA   VAL  79           HA       VAL  79  11.217   2.565  -2.698
  611    HB   VAL  79           HB       VAL  79   9.408   2.552  -1.031
  612   1HG1  VAL  79          1HG1      VAL  79   9.363  -0.227  -1.644
  613   2HG1  VAL  79          2HG1      VAL  79   8.244   0.712  -0.654
  614   3HG1  VAL  79          3HG1      VAL  79   9.674  -0.018   0.079
  615   1HG2  VAL  79          1HG2      VAL  79  11.998   1.200  -0.323
  616   2HG2  VAL  79          2HG2      VAL  79  10.820   1.697   0.893
  617   3HG2  VAL  79          3HG2      VAL  79  11.568   2.902  -0.156
  618    H    SER  80           H        SER  80  13.124   1.673  -2.954
  619    HA   SER  80           HA       SER  80  13.314  -1.263  -2.796
  620   1HB   SER  80          2HB       SER  80  15.504   0.307  -4.067
  621   2HB   SER  80          1HB       SER  80  14.874  -1.286  -4.486
  622    HG   SER  80           HG       SER  80  14.018   1.256  -5.293
  623    H    ASN  81           H        ASN  81  13.836  -1.623  -0.722
  624    HA   ASN  81           HA       ASN  81  15.574   0.130   0.750
  625   1HB   ASN  81          2HB       ASN  81  13.762  -1.112   1.865
  626   2HB   ASN  81          1HB       ASN  81  14.536  -2.632   1.437
  627   1HD2  ASN  81          1HD2      ASN  81  16.182   0.278   2.535
  628   2HD2  ASN  81          2HD2      ASN  81  16.765  -0.395   4.020
  629    H    LEU  82           H        LEU  82  15.801  -2.971  -0.838
  630    HA   LEU  82           HA       LEU  82  17.516  -4.235  -1.558
  631   1HB   LEU  82          2HB       LEU  82  18.879  -1.609  -1.194
  632   2HB   LEU  82          1HB       LEU  82  19.863  -3.037  -1.468
  633    HG   LEU  82           HG       LEU  82  17.612  -2.257  -3.309
  634   1HD1  LEU  82          1HD1      LEU  82  19.186  -0.409  -3.234
  635   2HD1  LEU  82          2HD1      LEU  82  19.302  -1.270  -4.770
  636   3HD1  LEU  82          3HD1      LEU  82  20.525  -1.521  -3.524
  637   1HD2  LEU  82          1HD2      LEU  82  18.616  -3.760  -4.842
  638   2HD2  LEU  82          2HD2      LEU  82  18.522  -4.607  -3.296
  639   3HD2  LEU  82          3HD2      LEU  82  20.058  -3.928  -3.840
  640    H    ASP  83           H        ASP  83  20.092  -4.626  -0.682
  641    HA   ASP  83           HA       ASP  83  21.180  -5.902   0.840
  642   1HB   ASP  83          2HB       ASP  83  21.283  -3.874   2.175
  643   2HB   ASP  83          1HB       ASP  83  19.655  -4.146   2.783
  644    H    PHE  84           H        PHE  84  18.581  -5.668   3.140
  645    HA   PHE  84           HA       PHE  84  16.770  -7.532   2.198
  646   1HB   PHE  84          2HB       PHE  84  19.146  -8.823   3.092
  647   2HB   PHE  84          1HB       PHE  84  17.885  -9.153   4.277
  648    HD1  PHE  84           1HD      PHE  84  17.802 -11.510   3.743
  649    HD2  PHE  84           2HD      PHE  84  17.088  -8.563   0.759
  650    HE1  PHE  84           1HE      PHE  84  16.870 -13.238   2.259
  651    HE2  PHE  84           2HE      PHE  84  16.158 -10.278  -0.729
  652    HZ   PHE  84           HZ       PHE  84  16.044 -12.624   0.020
  653    H    GLY  85           H        GLY  85  16.743  -5.117   3.558
  654   1HA   GLY  85          2HA       GLY  85  16.385  -5.525   6.383
  655   2HA   GLY  85          1HA       GLY  85  16.109  -4.032   5.498
  656    H    VAL  86           H        VAL  86  14.070  -3.649   4.561
  657    HA   VAL  86           HA       VAL  86  11.958  -4.884   6.102
  658    HB   VAL  86           HB       VAL  86  10.467  -3.214   4.998
  659   1HG1  VAL  86          1HG1      VAL  86  11.238  -1.361   6.272
  660   2HG1  VAL  86          2HG1      VAL  86  12.903  -1.941   6.223
  661   3HG1  VAL  86          3HG1      VAL  86  11.689  -2.823   7.149
  662   1HG2  VAL  86          1HG2      VAL  86  11.380  -1.448   3.652
  663   2HG2  VAL  86          2HG2      VAL  86  11.801  -2.991   2.910
  664   3HG2  VAL  86          3HG2      VAL  86  13.011  -2.094   3.828
  665    H    SER  87           H        SER  87  10.638  -6.421   5.452
  666    HA   SER  87           HA       SER  87  10.687  -7.251   2.651
  667   1HB   SER  87          2HB       SER  87   9.236  -8.726   4.828
  668   2HB   SER  87          1HB       SER  87   9.987  -9.361   3.365
  669    HG   SER  87           HG       SER  87  11.309  -8.353   5.677
  670    H    ASP  88           H        ASP  88   8.325  -8.452   2.297
  671    HA   ASP  88           HA       ASP  88   6.566  -6.488   1.505
  672   1HB   ASP  88          2HB       ASP  88   6.511  -8.830   0.730
  673   2HB   ASP  88          1HB       ASP  88   5.884  -9.327   2.298
  674    H    ALA  89           H        ALA  89   6.319  -8.492   4.438
  675    HA   ALA  89           HA       ALA  89   3.964  -7.236   5.388
  676   1HB   ALA  89          1HB       ALA  89   5.449  -9.439   6.108
  677   2HB   ALA  89          2HB       ALA  89   4.036  -8.816   6.961
  678   3HB   ALA  89          3HB       ALA  89   5.655  -8.344   7.476
  679    H    ASP  90           H        ASP  90   7.365  -6.588   5.800
  680    HA   ASP  90           HA       ASP  90   7.174  -4.863   8.032
  681   1HB   ASP  90          2HB       ASP  90   9.236  -5.973   6.540
  682   2HB   ASP  90          1HB       ASP  90   9.385  -4.243   6.240
  683    H    ILE  91           H        ILE  91   7.941  -3.993   4.658
  684    HA   ILE  91           HA       ILE  91   7.536  -1.282   4.884
  685    HB   ILE  91           HB       ILE  91   8.521  -2.502   2.916
  686   1HG1  ILE  91          2HG1      ILE  91   7.681  -0.800   1.259
  687   2HG1  ILE  91          1HG1      ILE  91   6.508  -0.296   2.471
  688   1HG2  ILE  91          1HG2      ILE  91   6.932  -4.112   2.323
  689   2HG2  ILE  91          2HG2      ILE  91   6.848  -2.909   1.036
  690   3HG2  ILE  91          3HG2      ILE  91   5.619  -2.936   2.301
  691   1HD1  ILE  91          1HD1      ILE  91   8.963  -0.268   3.784
  692   2HD1  ILE  91          2HD1      ILE  91   8.032   1.121   3.222
  693   3HD1  ILE  91          3HD1      ILE  91   9.277   0.419   2.190
  694    H    GLN  92           H        GLN  92   5.098  -3.780   4.410
  695    HA   GLN  92           HA       GLN  92   2.930  -2.044   3.859
  696   1HB   GLN  92          2HB       GLN  92   2.715  -4.396   3.388
  697   2HB   GLN  92          1HB       GLN  92   3.023  -4.813   5.068
  698   1HG   GLN  92          2HG       GLN  92   0.839  -3.132   5.206
  699   2HG   GLN  92          1HG       GLN  92   0.546  -4.083   3.752
  700   1HE2  GLN  92          1HE2      GLN  92   2.219  -5.054   6.707
  701   2HE2  GLN  92          2HE2      GLN  92   1.109  -6.313   7.132
  702    H    GLU  93           H        GLU  93   4.076  -3.548   6.857
  703    HA   GLU  93           HA       GLU  93   2.223  -2.458   8.632
  704   1HB   GLU  93          2HB       GLU  93   4.917  -3.638   8.800
  705   2HB   GLU  93          1HB       GLU  93   4.503  -2.564  10.127
  706   1HG   GLU  93          2HG       GLU  93   2.288  -4.016  10.109
  707   2HG   GLU  93          1HG       GLU  93   3.383  -5.200   9.395
  708    H    LEU  94           H        LEU  94   5.318  -1.211   7.497
  709    HA   LEU  94           HA       LEU  94   5.471   1.021   9.197
  710   1HB   LEU  94          2HB       LEU  94   6.773   0.160   6.662
  711   2HB   LEU  94          1HB       LEU  94   6.937   1.840   7.124
  712    HG   LEU  94           HG       LEU  94   8.252   1.354   8.969
  713   1HD1  LEU  94          1HD1      LEU  94   8.365  -1.334   9.476
  714   2HD1  LEU  94          2HD1      LEU  94   6.660  -1.085   9.098
  715   3HD1  LEU  94          3HD1      LEU  94   7.422  -0.154  10.388
  716   1HD2  LEU  94          1HD2      LEU  94   8.804  -0.670   6.823
  717   2HD2  LEU  94          2HD2      LEU  94   9.865  -0.461   8.217
  718   3HD2  LEU  94          3HD2      LEU  94   9.594   0.881   7.105
  719    H    PHE  95           H        PHE  95   4.923   1.119   5.702
  720    HA   PHE  95           HA       PHE  95   3.926   3.659   5.566
  721   1HB   PHE  95          2HB       PHE  95   3.894   1.328   3.815
  722   2HB   PHE  95          1HB       PHE  95   2.603   2.484   3.497
  723    HD1  PHE  95           1HD      PHE  95   3.764   5.047   4.010
  724    HD2  PHE  95           2HD      PHE  95   5.537   1.606   2.246
  725    HE1  PHE  95           1HE      PHE  95   5.351   6.485   2.803
  726    HE2  PHE  95           2HE      PHE  95   7.131   3.036   1.039
  727    HZ   PHE  95           HZ       PHE  95   7.030   5.502   1.339
  728    H    ALA  96           H        ALA  96   2.072   0.843   6.586
  729    HA   ALA  96           HA       ALA  96  -0.483   2.100   6.401
  730   1HB   ALA  96          1HB       ALA  96   0.066   0.125   8.561
  731   2HB   ALA  96          2HB       ALA  96   0.194  -0.407   6.885
  732   3HB   ALA  96          3HB       ALA  96  -1.325   0.263   7.484
  733    H    GLU  97           H        GLU  97   1.919   1.843   8.869
  734    HA   GLU  97           HA       GLU  97   0.750   3.488  10.851
  735   1HB   GLU  97          2HB       GLU  97   3.072   2.121  10.747
  736   2HB   GLU  97          1HB       GLU  97   3.680   3.747  10.467
  737   1HG   GLU  97          2HG       GLU  97   2.053   4.186  12.573
  738   2HG   GLU  97          1HG       GLU  97   2.572   2.530  12.897
  739    H    PHE  98           H        PHE  98   2.727   4.252   8.038
  740    HA   PHE  98           HA       PHE  98   2.714   7.062   8.352
  741   1HB   PHE  98          2HB       PHE  98   3.454   5.153   6.211
  742   2HB   PHE  98          1HB       PHE  98   3.142   6.815   5.720
  743    HD1  PHE  98           1HD      PHE  98   4.402   8.660   6.968
  744    HD2  PHE  98           2HD      PHE  98   5.508   4.553   7.087
  745    HE1  PHE  98           1HE      PHE  98   6.667   9.296   7.688
  746    HE2  PHE  98           2HE      PHE  98   7.771   5.180   7.812
  747    HZ   PHE  98           HZ       PHE  98   8.354   7.553   8.109
  748    H    GLY  99           H        GLY  99   0.074   5.195   7.779
  749   1HA   GLY  99          2HA       GLY  99  -1.920   6.738   7.413
  750   2HA   GLY  99          1HA       GLY  99  -1.116   7.163   5.916
  751    H    THR 100           H        THR 100  -2.884   6.571   4.704
  752    HA   THR 100           HA       THR 100  -4.189   4.042   4.978
  753    HB   THR 100           HB       THR 100  -4.674   5.353   2.446
  754    HG1  THR 100           1HG      THR 100  -4.284   7.335   3.153
  755   1HG2  THR 100          1HG2      THR 100  -6.223   3.846   3.691
  756   2HG2  THR 100          2HG2      THR 100  -6.951   5.385   3.234
  757   3HG2  THR 100          3HG2      THR 100  -6.426   5.118   4.895
  758    H    LEU 101           H        LEU 101  -3.037   2.255   4.440
  759    HA   LEU 101           HA       LEU 101  -1.537   2.316   1.922
  760   1HB   LEU 101          2HB       LEU 101  -1.126   1.003   4.440
  761   2HB   LEU 101          1HB       LEU 101  -1.214  -0.192   3.160
  762    HG   LEU 101           HG       LEU 101   0.838   1.891   3.667
  763   1HD1  LEU 101          1HD1      LEU 101   0.674  -0.983   3.051
  764   2HD1  LEU 101          2HD1      LEU 101   1.770  -0.106   4.116
  765   3HD1  LEU 101          3HD1      LEU 101   2.056  -0.119   2.375
  766   1HD2  LEU 101          1HD2      LEU 101  -0.058   1.059   0.919
  767   2HD2  LEU 101          2HD2      LEU 101   1.573   1.653   1.253
  768   3HD2  LEU 101          3HD2      LEU 101   0.177   2.690   1.550
  769    H    LYS 102           H        LYS 102  -3.427   2.346   0.697
  770    HA   LYS 102           HA       LYS 102  -5.496   0.569   0.530
  771   1HB   LYS 102          2HB       LYS 102  -4.289   2.437  -1.219
  772   2HB   LYS 102          1HB       LYS 102  -4.473   0.946  -2.131
  773   1HG   LYS 102          2HG       LYS 102  -6.794   1.909  -0.557
  774   2HG   LYS 102          1HG       LYS 102  -6.371   2.768  -2.039
  775   1HD   LYS 102          2HD       LYS 102  -6.774   0.915  -3.377
  776   2HD   LYS 102          1HD       LYS 102  -6.597  -0.216  -2.035
  777   1HE   LYS 102          2HE       LYS 102  -8.842   1.779  -2.238
  778   2HE   LYS 102          1HE       LYS 102  -8.949   0.134  -2.863
  779   1HZ   LYS 102          1HZ       LYS 102  -8.772  -0.756  -0.719
  780   2HZ   LYS 102          2HZ       LYS 102  -9.851   0.543  -0.554
  781   3HZ   LYS 102          3HZ       LYS 102  -8.244   0.707  -0.043
  782    H    LYS 103           H        LYS 103  -2.374   0.144  -1.157
  783    HA   LYS 103           HA       LYS 103  -2.450  -2.667  -0.449
  784   1HB   LYS 103          2HB       LYS 103  -2.327  -3.551  -2.592
  785   2HB   LYS 103          1HB       LYS 103  -3.511  -2.268  -2.778
  786   1HG   LYS 103          2HG       LYS 103  -2.235  -1.146  -4.225
  787   2HG   LYS 103          1HG       LYS 103  -0.766  -1.409  -3.284
  788   1HD   LYS 103          2HD       LYS 103  -0.378  -2.563  -5.282
  789   2HD   LYS 103          1HD       LYS 103  -0.877  -3.822  -4.152
  790   1HE   LYS 103          2HE       LYS 103  -3.121  -2.609  -5.551
  791   2HE   LYS 103          1HE       LYS 103  -1.955  -3.346  -6.648
  792   1HZ   LYS 103          1HZ       LYS 103  -2.108  -5.384  -5.269
  793   2HZ   LYS 103          2HZ       LYS 103  -3.554  -4.984  -6.052
  794   3HZ   LYS 103          3HZ       LYS 103  -3.374  -4.666  -4.398
  795    H    ALA 104           H        ALA 104  -0.372  -3.698  -0.576
  796    HA   ALA 104           HA       ALA 104   1.912  -2.129  -1.397
  797   1HB   ALA 104          1HB       ALA 104   1.111  -2.056   1.333
  798   2HB   ALA 104          2HB       ALA 104   2.526  -1.319   0.577
  799   3HB   ALA 104          3HB       ALA 104   2.619  -2.962   1.216
  800    H    ALA 105           H        ALA 105   2.845  -3.599  -2.623
  801    HA   ALA 105           HA       ALA 105   3.313  -6.278  -1.477
  802   1HB   ALA 105          1HB       ALA 105   1.734  -5.790  -3.649
  803   2HB   ALA 105          2HB       ALA 105   2.573  -7.309  -3.330
  804   3HB   ALA 105          3HB       ALA 105   3.298  -6.107  -4.398
  805    H    VAL 106           H        VAL 106   5.321  -7.285  -2.201
  806    HA   VAL 106           HA       VAL 106   7.336  -5.260  -2.791
  807    HB   VAL 106           HB       VAL 106   8.960  -7.135  -2.263
  808   1HG1  VAL 106          1HG1      VAL 106   7.021  -6.155  -0.187
  809   2HG1  VAL 106          2HG1      VAL 106   8.545  -5.409  -0.671
  810   3HG1  VAL 106          3HG1      VAL 106   8.550  -6.950   0.187
  811   1HG2  VAL 106          1HG2      VAL 106   6.992  -8.595  -0.694
  812   2HG2  VAL 106          2HG2      VAL 106   8.275  -9.196  -1.746
  813   3HG2  VAL 106          3HG2      VAL 106   6.719  -8.730  -2.431
  814    H    ASP 107           H        ASP 107   9.138  -5.854  -4.164
  815    HA   ASP 107           HA       ASP 107   8.320  -7.440  -6.494
  816   1HB   ASP 107          2HB       ASP 107   8.028  -4.833  -6.651
  817   2HB   ASP 107          1HB       ASP 107   9.778  -4.845  -6.853
  818    H    TYR 108           H        TYR 108  10.115  -8.083  -7.830
  819    HA   TYR 108           HA       TYR 108  12.741  -7.959  -6.556
  820   1HB   TYR 108          2HB       TYR 108  11.268 -10.520  -7.215
  821   2HB   TYR 108          1HB       TYR 108  13.004 -10.450  -6.930
  822    HD1  TYR 108           1HD      TYR 108   9.741 -10.616  -5.411
  823    HD2  TYR 108           2HD      TYR 108  13.827  -9.674  -4.669
  824    HE1  TYR 108           1HE      TYR 108   9.357 -10.866  -2.994
  825    HE2  TYR 108           2HE      TYR 108  13.450  -9.920  -2.252
  826    HH   TYR 108           HH       TYR 108  10.969  -9.694  -0.736
  827    H    ASP 109           H        ASP 109  14.345  -9.251  -8.146
  828    HA   ASP 109           HA       ASP 109  13.948  -7.978 -10.719
  829   1HB   ASP 109          2HB       ASP 109  16.191  -8.729 -11.246
  830   2HB   ASP 109          1HB       ASP 109  16.193  -8.039  -9.626
  831    H    ARG 110           H        ARG 110  14.896  -9.719 -12.587
  832    HA   ARG 110           HA       ARG 110  12.627 -11.231 -13.130
  833   1HB   ARG 110          2HB       ARG 110  15.327 -10.933 -14.284
  834   2HB   ARG 110          1HB       ARG 110  14.493 -12.426 -14.688
  835   1HG   ARG 110          2HG       ARG 110  14.275 -10.156 -16.105
  836   2HG   ARG 110          1HG       ARG 110  13.021 -11.393 -16.037
  837   1HD   ARG 110          2HD       ARG 110  11.882  -9.387 -15.651
  838   2HD   ARG 110          1HD       ARG 110  12.088 -10.086 -14.048
  839    HE   ARG 110           HE       ARG 110  14.166  -8.236 -14.823
  840   1HH1  ARG 110          1HH1      ARG 110  11.063  -8.632 -13.259
  841   2HH1  ARG 110          2HH1      ARG 110  11.175  -7.147 -12.364
  842   1HH2  ARG 110          1HH2      ARG 110  14.340  -6.289 -13.619
  843   2HH2  ARG 110          2HH2      ARG 110  13.034  -5.814 -12.568
  844    H    SER 111           H        SER 111  15.607 -12.131 -11.497
  845    HA   SER 111           HA       SER 111  14.551 -14.859 -11.194
  846   1HB   SER 111          2HB       SER 111  17.370 -14.110 -10.509
  847   2HB   SER 111          1HB       SER 111  16.728 -15.652 -11.076
  848    HG   SER 111           HG       SER 111  17.785 -14.752 -12.792
  849    H    GLY 112           H        GLY 112  14.141 -12.203  -9.636
  850   1HA   GLY 112          2HA       GLY 112  14.147 -11.416  -7.445
  851   2HA   GLY 112          1HA       GLY 112  13.364 -12.966  -7.205
  852    H    ARG 113           H        ARG 113  16.597 -11.454  -7.334
  853    HA   ARG 113           HA       ARG 113  17.677 -13.780  -5.965
  854   1HB   ARG 113          2HB       ARG 113  19.871 -12.791  -6.278
  855   2HB   ARG 113          1HB       ARG 113  18.970 -12.805  -7.783
  856   1HG   ARG 113          2HG       ARG 113  18.360 -10.350  -7.039
  857   2HG   ARG 113          1HG       ARG 113  19.857 -10.515  -6.119
  858   1HD   ARG 113          2HD       ARG 113  20.307  -9.545  -8.298
  859   2HD   ARG 113          1HD       ARG 113  21.034 -11.149  -8.179
  860    HE   ARG 113           HE       ARG 113  18.403 -10.850  -9.447
  861   1HH1  ARG 113          1HH1      ARG 113  21.807 -11.623  -9.714
  862   2HH1  ARG 113          2HH1      ARG 113  21.652 -12.336 -11.287
  863   1HH2  ARG 113          1HH2      ARG 113  18.187 -11.752 -11.492
  864   2HH2  ARG 113          2HH2      ARG 113  19.580 -12.393 -12.321
  865    H    SER 114           H        SER 114  17.420 -10.288  -5.187
  866    HA   SER 114           HA       SER 114  17.112 -10.559  -2.466
  867   1HB   SER 114          2HB       SER 114  19.642  -9.847  -1.903
  868   2HB   SER 114          1HB       SER 114  19.113 -11.528  -1.904
  869    HG   SER 114           HG       SER 114  20.407 -10.140  -4.033
  870    H    LEU 115           H        LEU 115  15.862  -8.682  -3.147
  871    HA   LEU 115           HA       LEU 115  17.523  -6.277  -2.866
  872   1HB   LEU 115          2HB       LEU 115  15.104  -5.617  -4.256
  873   2HB   LEU 115          1HB       LEU 115  16.764  -5.309  -4.713
  874    HG   LEU 115           HG       LEU 115  15.688  -8.039  -5.205
  875   1HD1  LEU 115          1HD1      LEU 115  14.359  -7.479  -6.978
  876   2HD1  LEU 115          2HD1      LEU 115  15.170  -5.936  -7.243
  877   3HD1  LEU 115          3HD1      LEU 115  14.033  -6.115  -5.907
  878   1HD2  LEU 115          1HD2      LEU 115  17.970  -7.655  -5.776
  879   2HD2  LEU 115          2HD2      LEU 115  17.572  -6.156  -6.614
  880   3HD2  LEU 115          3HD2      LEU 115  17.058  -7.705  -7.284
  881    H    GLY 116           H        GLY 116  14.016  -6.792  -3.066
  882   1HA   GLY 116          2HA       GLY 116  12.586  -6.786  -1.119
  883   2HA   GLY 116          1HA       GLY 116  13.812  -5.838  -0.285
  884    H    THR 117           H        THR 117  12.936  -5.239  -3.572
  885    HA   THR 117           HA       THR 117  12.027  -2.597  -3.171
  886    HB   THR 117           HB       THR 117  11.188  -4.198  -5.550
  887    HG1  THR 117           1HG      THR 117  13.539  -3.680  -6.233
  888   1HG2  THR 117          1HG2      THR 117  12.431  -2.041  -6.525
  889   2HG2  THR 117          2HG2      THR 117  11.995  -1.415  -4.935
  890   3HG2  THR 117          3HG2      THR 117  10.741  -2.019  -6.019
  891    H    ALA 118           H        ALA 118   9.824  -1.809  -3.440
  892    HA   ALA 118           HA       ALA 118   7.682  -3.759  -3.506
  893   1HB   ALA 118          1HB       ALA 118   7.489  -1.847  -1.229
  894   2HB   ALA 118          2HB       ALA 118   8.486  -3.290  -1.036
  895   3HB   ALA 118          3HB       ALA 118   6.772  -3.448  -1.431
  896    H    ASP 119           H        ASP 119   5.699  -2.917  -4.007
  897    HA   ASP 119           HA       ASP 119   5.609  -0.059  -4.710
  898   1HB   ASP 119          2HB       ASP 119   5.394  -1.260  -6.760
  899   2HB   ASP 119          1HB       ASP 119   4.328  -2.459  -6.033
  900    H    VAL 120           H        VAL 120   4.590   0.878  -3.025
  901    HA   VAL 120           HA       VAL 120   2.158  -0.457  -2.069
  902    HB   VAL 120           HB       VAL 120   2.374   0.529   0.020
  903   1HG1  VAL 120          1HG1      VAL 120   4.968   0.476   0.507
  904   2HG1  VAL 120          2HG1      VAL 120   5.020  -0.228  -1.110
  905   3HG1  VAL 120          3HG1      VAL 120   4.070  -1.001   0.159
  906   1HG2  VAL 120          1HG2      VAL 120   4.122   2.557  -1.314
  907   2HG2  VAL 120          2HG2      VAL 120   4.004   2.415   0.444
  908   3HG2  VAL 120          3HG2      VAL 120   2.571   2.810  -0.510
  909    H    HIS 121           H        HIS 121   0.252   0.641  -2.053
  910    HA   HIS 121           HA       HIS 121   0.228   3.140  -3.608
  911   1HB   HIS 121          2HB       HIS 121  -1.051   0.528  -4.080
  912   2HB   HIS 121          1HB       HIS 121  -2.134   1.910  -4.236
  913    HD1  HIS 121           1HD      HIS 121   0.682   0.174  -5.941
  914    HD2  HIS 121           2HD      HIS 121  -1.435   3.742  -6.290
  915    HE1  HIS 121           1HE      HIS 121   1.208   1.058  -8.231
  916    HE2  HIS 121           2HE      HIS 121  -0.202   3.136  -8.475
  917    H    PHE 122           H        PHE 122  -0.680   4.751  -2.417
  918    HA   PHE 122           HA       PHE 122  -2.670   4.024  -0.420
  919   1HB   PHE 122          2HB       PHE 122  -1.791   6.844  -0.773
  920   2HB   PHE 122          1HB       PHE 122  -2.122   5.947   0.700
  921    HD1  PHE 122           1HD      PHE 122  -0.396   4.933   1.923
  922    HD2  PHE 122           2HD      PHE 122   0.405   6.496  -1.952
  923    HE1  PHE 122           1HE      PHE 122   2.016   4.684   2.323
  924    HE2  PHE 122           2HE      PHE 122   2.817   6.244  -1.559
  925    HZ   PHE 122           HZ       PHE 122   3.626   5.340   0.580
  926    H    GLU 123           H        GLU 123  -4.521   5.544  -0.158
  927    HA   GLU 123           HA       GLU 123  -6.041   5.557  -2.585
  928   1HB   GLU 123          2HB       GLU 123  -6.530   5.788   0.266
  929   2HB   GLU 123          1HB       GLU 123  -7.480   6.955  -0.639
  930   1HG   GLU 123          2HG       GLU 123  -8.343   5.108  -2.035
  931   2HG   GLU 123          1HG       GLU 123  -7.461   3.970  -1.013
  932    H    ARG 124           H        ARG 124  -4.409   7.927  -0.648
  933    HA   ARG 124           HA       ARG 124  -5.459  10.088  -2.360
  934   1HB   ARG 124          2HB       ARG 124  -3.982  10.706   0.152
  935   2HB   ARG 124          1HB       ARG 124  -5.281  11.592  -0.627
  936   1HG   ARG 124          2HG       ARG 124  -6.918  10.085   0.221
  937   2HG   ARG 124          1HG       ARG 124  -5.673   8.979   0.808
  938   1HD   ARG 124          2HD       ARG 124  -4.854  10.850   2.274
  939   2HD   ARG 124          1HD       ARG 124  -6.295  11.751   1.809
  940    HE   ARG 124           HE       ARG 124  -7.612   9.957   2.842
  941   1HH1  ARG 124          1HH1      ARG 124  -4.203  10.175   3.666
  942   2HH1  ARG 124          2HH1      ARG 124  -4.408   9.450   5.238
  943   1HH2  ARG 124          1HH2      ARG 124  -7.869   8.961   4.886
  944   2HH2  ARG 124          2HH2      ARG 124  -6.483   8.730   5.910
  945    H    ARG 125           H        ARG 125  -4.067  11.338  -3.533
  946    HA   ARG 125           HA       ARG 125  -1.408  10.456  -3.939
  947   1HB   ARG 125          2HB       ARG 125  -1.291  12.063  -5.594
  948   2HB   ARG 125          1HB       ARG 125  -3.032  11.853  -5.475
  949   1HG   ARG 125          2HG       ARG 125  -3.075  13.825  -3.934
  950   2HG   ARG 125          1HG       ARG 125  -1.371  14.077  -4.315
  951   1HD   ARG 125          2HD       ARG 125  -2.861  13.750  -6.738
  952   2HD   ARG 125          1HD       ARG 125  -3.625  14.986  -5.740
  953    HE   ARG 125           HE       ARG 125  -1.152  15.198  -7.138
  954   1HH1  ARG 125          1HH1      ARG 125  -2.837  16.298  -4.261
  955   2HH1  ARG 125          2HH1      ARG 125  -1.872  17.736  -4.102
  956   1HH2  ARG 125          1HH2      ARG 125   0.090  17.100  -6.938
  957   2HH2  ARG 125          2HH2      ARG 125  -0.221  18.190  -5.619
  958    H    ALA 126           H        ALA 126  -2.893  12.722  -1.777
  959    HA   ALA 126           HA       ALA 126  -0.590  14.176  -1.013
  960   1HB   ALA 126          1HB       ALA 126  -2.452  15.242  -0.263
  961   2HB   ALA 126          2HB       ALA 126  -2.037  14.350   1.202
  962   3HB   ALA 126          3HB       ALA 126  -3.293  13.741   0.123
  963    H    ASP 127           H        ASP 127  -1.856  11.068  -0.100
  964    HA   ASP 127           HA       ASP 127  -0.307  10.645   2.221
  965   1HB   ASP 127          2HB       ASP 127  -1.495   8.702   0.231
  966   2HB   ASP 127          1HB       ASP 127  -0.662   8.189   1.695
  967    H    ALA 128           H        ALA 128   0.345  10.284  -1.195
  968    HA   ALA 128           HA       ALA 128   2.949   9.082  -0.768
  969   1HB   ALA 128          1HB       ALA 128   1.242   9.692  -3.078
  970   2HB   ALA 128          2HB       ALA 128   2.357   8.351  -2.812
  971   3HB   ALA 128          3HB       ALA 128   2.968   9.913  -3.362
  972    H    LEU 129           H        LEU 129   1.533  12.182  -1.485
  973    HA   LEU 129           HA       LEU 129   3.834  13.713  -1.905
  974   1HB   LEU 129          2HB       LEU 129   1.432  14.449  -2.143
  975   2HB   LEU 129          1HB       LEU 129   1.371  14.591  -0.397
  976    HG   LEU 129           HG       LEU 129   3.592  16.069  -1.595
  977   1HD1  LEU 129          1HD1      LEU 129   1.613  17.846  -2.150
  978   2HD1  LEU 129          2HD1      LEU 129   0.888  16.333  -2.693
  979   3HD1  LEU 129          3HD1      LEU 129   2.439  16.853  -3.351
  980   1HD2  LEU 129          1HD2      LEU 129   2.973  17.699  -0.017
  981   2HD2  LEU 129          2HD2      LEU 129   2.671  16.153   0.780
  982   3HD2  LEU 129          3HD2      LEU 129   1.327  17.077   0.105
  983    H    LYS 130           H        LYS 130   2.140  12.865   1.083
  984    HA   LYS 130           HA       LYS 130   3.942  14.146   2.839
  985   1HB   LYS 130          2HB       LYS 130   2.257  13.622   4.219
  986   2HB   LYS 130          1HB       LYS 130   1.586  12.506   3.040
  987   1HG   LYS 130          2HG       LYS 130   2.522  10.680   4.024
  988   2HG   LYS 130          1HG       LYS 130   3.904  11.586   4.650
  989   1HD   LYS 130          2HD       LYS 130   2.392  12.656   6.299
  990   2HD   LYS 130          1HD       LYS 130   1.074  11.642   5.706
  991   1HE   LYS 130          2HE       LYS 130   1.835   9.809   6.770
  992   2HE   LYS 130          1HE       LYS 130   3.524  10.195   6.439
  993   1HZ   LYS 130          1HZ       LYS 130   2.611  12.102   8.231
  994   2HZ   LYS 130          2HZ       LYS 130   3.702  10.843   8.535
  995   3HZ   LYS 130          3HZ       LYS 130   2.044  10.610   8.807
  996    H    ALA 131           H        ALA 131   3.777  10.905   1.461
  997    HA   ALA 131           HA       ALA 131   5.870   9.775   2.971
  998   1HB   ALA 131          1HB       ALA 131   5.668   7.918   1.628
  999   2HB   ALA 131          2HB       ALA 131   5.318   8.867   0.183
 1000   3HB   ALA 131          3HB       ALA 131   4.084   8.666   1.428
 1001    H    MET 132           H        MET 132   5.880  11.562  -0.100
 1002    HA   MET 132           HA       MET 132   8.661  11.141  -0.559
 1003   1HB   MET 132          2HB       MET 132   8.374  12.322  -2.492
 1004   2HB   MET 132          1HB       MET 132   6.700  11.896  -2.182
 1005   1HG   MET 132          2HG       MET 132   6.155  14.045  -1.479
 1006   2HG   MET 132          1HG       MET 132   7.839  14.480  -1.191
 1007   1HE   MET 132          1HE       MET 132   4.980  14.016  -3.289
 1008   2HE   MET 132          2HE       MET 132   5.435  14.277  -4.972
 1009   3HE   MET 132          3HE       MET 132   5.145  15.657  -3.913
 1010    H    LYS 133           H        LYS 133   6.811  13.374   1.331
 1011    HA   LYS 133           HA       LYS 133   8.995  15.249   1.629
 1012   1HB   LYS 133          2HB       LYS 133   6.172  15.135   2.342
 1013   2HB   LYS 133          1HB       LYS 133   7.163  15.775   3.646
 1014   1HG   LYS 133          2HG       LYS 133   6.531  17.656   2.437
 1015   2HG   LYS 133          1HG       LYS 133   8.168  17.319   1.869
 1016   1HD   LYS 133          2HD       LYS 133   7.470  16.722  -0.206
 1017   2HD   LYS 133          1HD       LYS 133   5.962  16.025   0.386
 1018   1HE   LYS 133          2HE       LYS 133   5.457  17.975  -0.923
 1019   2HE   LYS 133          1HE       LYS 133   5.109  18.320   0.770
 1020   1HZ   LYS 133          1HZ       LYS 133   6.445  19.999  -0.705
 1021   2HZ   LYS 133          2HZ       LYS 133   7.760  19.016  -0.278
 1022   3HZ   LYS 133          3HZ       LYS 133   6.842  19.776   0.930
 1023    H    GLN 134           H        GLN 134   7.427  12.739   3.533
 1024    HA   GLN 134           HA       GLN 134   9.208  13.194   5.783
 1025   1HB   GLN 134          2HB       GLN 134   6.693  11.719   5.300
 1026   2HB   GLN 134          1HB       GLN 134   7.781  10.992   6.471
 1027   1HG   GLN 134          2HG       GLN 134   5.935  12.692   7.208
 1028   2HG   GLN 134          1HG       GLN 134   7.519  12.680   7.978
 1029   1HE2  GLN 134          1HE2      GLN 134   5.589  14.270   5.496
 1030   2HE2  GLN 134          2HE2      GLN 134   6.397  15.800   5.590
 1031    H    TYR 135           H        TYR 135   8.269  10.294   3.911
 1032    HA   TYR 135           HA       TYR 135  10.419   8.783   5.033
 1033   1HB   TYR 135          2HB       TYR 135   8.021   8.145   3.863
 1034   2HB   TYR 135          1HB       TYR 135   9.177   7.679   2.619
 1035    HD1  TYR 135           1HD      TYR 135  11.287   7.149   5.033
 1036    HD2  TYR 135           2HD      TYR 135   7.429   5.721   3.966
 1037    HE1  TYR 135           1HE      TYR 135  11.730   5.060   6.257
 1038    HE2  TYR 135           2HE      TYR 135   7.855   3.630   5.186
 1039    HH   TYR 135           HH       TYR 135   9.592   3.084   7.335
 1040    H    LYS 136           H        LYS 136   9.769   9.982   1.732
 1041    HA   LYS 136           HA       LYS 136  12.088   8.815   0.631
 1042   1HB   LYS 136          2HB       LYS 136  10.154   9.534  -0.723
 1043   2HB   LYS 136          1HB       LYS 136  10.546  11.213  -0.373
 1044   1HG   LYS 136          2HG       LYS 136  12.877  10.532  -1.368
 1045   2HG   LYS 136          1HG       LYS 136  11.917   9.272  -2.150
 1046   1HD   LYS 136          2HD       LYS 136  10.419  11.001  -3.060
 1047   2HD   LYS 136          1HD       LYS 136  11.422  12.247  -2.312
 1048   1HE   LYS 136          2HE       LYS 136  13.066  10.476  -3.852
 1049   2HE   LYS 136          1HE       LYS 136  11.730  11.057  -4.846
 1050   1HZ   LYS 136          1HZ       LYS 136  13.627  12.756  -3.313
 1051   2HZ   LYS 136          2HZ       LYS 136  12.329  13.329  -4.244
 1052   3HZ   LYS 136          3HZ       LYS 136  13.625  12.534  -4.994
 1053    H    GLY 137           H        GLY 137  14.088   9.267   1.237
 1054   1HA   GLY 137          2HA       GLY 137  15.760  11.100   0.661
 1055   2HA   GLY 137          1HA       GLY 137  14.801  12.065   1.781
 1056    H    VAL 138           H        VAL 138  14.403   9.319   3.194
 1057    HA   VAL 138           HA       VAL 138  16.374   9.834   5.190
 1058    HB   VAL 138           HB       VAL 138  15.424   7.927   6.393
 1059   1HG1  VAL 138          1HG1      VAL 138  12.954   9.232   5.529
 1060   2HG1  VAL 138          2HG1      VAL 138  14.266  10.344   5.921
 1061   3HG1  VAL 138          3HG1      VAL 138  13.715   9.174   7.119
 1062   1HG2  VAL 138          1HG2      VAL 138  14.016   6.385   5.525
 1063   2HG2  VAL 138          2HG2      VAL 138  14.818   6.836   4.020
 1064   3HG2  VAL 138          3HG2      VAL 138  13.254   7.539   4.429
 1065    HA   PRO 139           HA       PRO 139  19.520   6.921   3.900
 1066   1HB   PRO 139          2HB       PRO 139  20.635   7.611   6.528
 1067   2HB   PRO 139          1HB       PRO 139  21.351   7.818   4.928
 1068   1HG   PRO 139          2HG       PRO 139  20.521   9.913   6.402
 1069   2HG   PRO 139          1HG       PRO 139  20.415   9.902   4.630
 1070   1HD   PRO 139          2HD       PRO 139  18.268   9.399   6.661
 1071   2HD   PRO 139          1HD       PRO 139  18.195  10.332   5.150
 1072    H    LEU 140           H        LEU 140  19.171   4.787   4.228
 1073    HA   LEU 140           HA       LEU 140  18.063   4.009   6.832
 1074   1HB   LEU 140          2HB       LEU 140  16.720   3.937   4.411
 1075   2HB   LEU 140          1HB       LEU 140  17.321   2.298   4.578
 1076    HG   LEU 140           HG       LEU 140  16.270   2.348   6.924
 1077   1HD1  LEU 140          1HD1      LEU 140  14.680   3.936   7.446
 1078   2HD1  LEU 140          2HD1      LEU 140  14.475   4.437   5.768
 1079   3HD1  LEU 140          3HD1      LEU 140  15.923   4.908   6.657
 1080   1HD2  LEU 140          1HD2      LEU 140  14.125   1.648   6.051
 1081   2HD2  LEU 140          2HD2      LEU 140  15.422   1.043   5.018
 1082   3HD2  LEU 140          3HD2      LEU 140  14.465   2.437   4.511
 1083    H    ASP 141           H        ASP 141  19.371   2.591   7.825
 1084    HA   ASP 141           HA       ASP 141  21.344   1.524   8.212
 1085   1HB   ASP 141          2HB       ASP 141  19.914  -0.311   7.315
 1086   2HB   ASP 141          1HB       ASP 141  20.578  -0.003   5.714
 1087    H    GLY 142           H        GLY 142  22.358   3.650   7.555
 1088   1HA   GLY 142          2HA       GLY 142  24.591   4.120   6.945
 1089   2HA   GLY 142          1HA       GLY 142  24.481   2.900   5.686
 1090    H    ARG 143           H        ARG 143  22.557   3.520   4.043
 1091    HA   ARG 143           HA       ARG 143  23.153   6.304   3.262
 1092   1HB   ARG 143          2HB       ARG 143  23.823   3.826   1.935
 1093   2HB   ARG 143          1HB       ARG 143  22.777   4.804   0.916
 1094   1HG   ARG 143          2HG       ARG 143  24.647   6.597   1.905
 1095   2HG   ARG 143          1HG       ARG 143  25.571   5.135   1.553
 1096   1HD   ARG 143          2HD       ARG 143  24.770   5.106  -0.710
 1097   2HD   ARG 143          1HD       ARG 143  23.664   6.439  -0.382
 1098    HE   ARG 143           HE       ARG 143  25.446   7.931  -0.449
 1099   1HH1  ARG 143          1HH1      ARG 143  26.534   4.620  -0.838
 1100   2HH1  ARG 143          2HH1      ARG 143  28.140   5.070  -1.339
 1101   1HH2  ARG 143          1HH2      ARG 143  27.552   8.524  -1.116
 1102   2HH2  ARG 143          2HH2      ARG 143  28.719   7.285  -1.473
 1103    HA   PRO 144           HA       PRO 144  18.813   6.961   2.535
 1104   1HB   PRO 144          2HB       PRO 144  19.640   8.088  -0.095
 1105   2HB   PRO 144          1HB       PRO 144  18.644   8.808   1.175
 1106   1HG   PRO 144          2HG       PRO 144  21.158   9.604   0.805
 1107   2HG   PRO 144          1HG       PRO 144  20.483   9.445   2.438
 1108   1HD   PRO 144          2HD       PRO 144  22.362   7.639   0.978
 1109   2HD   PRO 144          1HD       PRO 144  22.322   8.073   2.698
 1110    H    MET 145           H        MET 145  17.320   5.568   1.814
 1111    HA   MET 145           HA       MET 145  18.139   3.505  -0.023
 1112   1HB   MET 145          2HB       MET 145  15.997   2.467   0.441
 1113   2HB   MET 145          1HB       MET 145  16.752   2.983   1.940
 1114   1HG   MET 145          2HG       MET 145  15.272   4.845   2.124
 1115   2HG   MET 145          1HG       MET 145  14.622   4.554   0.510
 1116   1HE   MET 145          1HE       MET 145  12.213   4.810   1.918
 1117   2HE   MET 145          2HE       MET 145  13.100   4.862   3.444
 1118   3HE   MET 145          3HE       MET 145  11.782   3.709   3.227
 1119    H    ASP 146           H        ASP 146  15.940   2.863  -1.479
 1120    HA   ASP 146           HA       ASP 146  15.870   5.102  -3.390
 1121   1HB   ASP 146          2HB       ASP 146  16.859   2.974  -4.188
 1122   2HB   ASP 146          1HB       ASP 146  15.339   2.154  -3.846
 1123    H    ILE 147           H        ILE 147  14.094   6.288  -2.979
 1124    HA   ILE 147           HA       ILE 147  11.533   4.854  -2.706
 1125    HB   ILE 147           HB       ILE 147  11.559   7.453  -1.388
 1126   1HG1  ILE 147          2HG1      ILE 147  12.779   6.218   0.652
 1127   2HG1  ILE 147          1HG1      ILE 147  13.644   5.450  -0.674
 1128   1HG2  ILE 147          1HG2      ILE 147  11.039   5.004   0.146
 1129   2HG2  ILE 147          2HG2      ILE 147  10.052   5.215  -1.301
 1130   3HG2  ILE 147          3HG2      ILE 147  10.058   6.457  -0.047
 1131   1HD1  ILE 147          1HD1      ILE 147  14.142   7.774  -1.520
 1132   2HD1  ILE 147          2HD1      ILE 147  14.938   7.296  -0.020
 1133   3HD1  ILE 147          3HD1      ILE 147  13.534   8.362   0.026
 1134    H    GLN 148           H        GLN 148  10.194   5.346  -4.332
 1135    HA   GLN 148           HA       GLN 148  10.410   8.042  -5.507
 1136   1HB   GLN 148          2HB       GLN 148  10.058   5.355  -6.792
 1137   2HB   GLN 148          1HB       GLN 148   9.432   6.797  -7.583
 1138   1HG   GLN 148          2HG       GLN 148  11.436   7.053  -8.478
 1139   2HG   GLN 148          1HG       GLN 148  12.013   7.486  -6.868
 1140   1HE2  GLN 148          1HE2      GLN 148  11.650   4.865  -5.750
 1141   2HE2  GLN 148          2HE2      GLN 148  12.908   3.867  -6.400
 1142    H    LEU 149           H        LEU 149   8.693   9.203  -4.988
 1143    HA   LEU 149           HA       LEU 149   6.114   7.848  -4.652
 1144   1HB   LEU 149          2HB       LEU 149   7.311  10.347  -3.543
 1145   2HB   LEU 149          1HB       LEU 149   5.571  10.267  -3.730
 1146    HG   LEU 149           HG       LEU 149   5.966   9.637  -1.510
 1147   1HD1  LEU 149          1HD1      LEU 149   4.784   7.736  -1.450
 1148   2HD1  LEU 149          2HD1      LEU 149   5.934   6.866  -2.465
 1149   3HD1  LEU 149          3HD1      LEU 149   4.735   7.928  -3.203
 1150   1HD2  LEU 149          1HD2      LEU 149   7.615   7.527  -1.269
 1151   2HD2  LEU 149          2HD2      LEU 149   8.141   9.203  -1.101
 1152   3HD2  LEU 149          3HD2      LEU 149   8.372   8.354  -2.630
 1153    H    VAL 150           H        VAL 150   5.119   7.778  -6.575
 1154    HA   VAL 150           HA       VAL 150   5.115  10.237  -8.181
 1155    HB   VAL 150           HB       VAL 150   5.836   8.608  -9.648
 1156   1HG1  VAL 150          1HG1      VAL 150   4.372   6.370  -9.736
 1157   2HG1  VAL 150          2HG1      VAL 150   4.202   6.773  -8.027
 1158   3HG1  VAL 150          3HG1      VAL 150   5.806   6.559  -8.727
 1159   1HG2  VAL 150          1HG2      VAL 150   3.970   9.760 -10.652
 1160   2HG2  VAL 150          2HG2      VAL 150   2.837   8.605  -9.951
 1161   3HG2  VAL 150          3HG2      VAL 150   3.980   8.080 -11.186
 1162    H    ALA 151           H        ALA 151   3.570  11.452  -7.560
 1163    HA   ALA 151           HA       ALA 151   0.840  10.845  -7.962
 1164   1HB   ALA 151          1HB       ALA 151   0.342  11.426  -5.423
 1165   2HB   ALA 151          2HB       ALA 151   1.914  10.661  -5.188
 1166   3HB   ALA 151          3HB       ALA 151   0.601   9.763  -5.950
 1167    H    SER 152           H        SER 152   2.927  12.727  -8.626
 1168    HA   SER 152           HA       SER 152   2.640  15.169  -7.205
 1169   1HB   SER 152          2HB       SER 152   3.470  15.596  -9.914
 1170   2HB   SER 152          1HB       SER 152   4.458  15.624  -8.451
 1171    HG   SER 152           HG       SER 152   5.263  14.021  -9.786
 1172    H    GLN 153           H        GLN 153   1.375  13.917 -10.242
 1173    HA   GLN 153           HA       GLN 153  -1.122  15.283  -9.836
 1174   1HB   GLN 153          2HB       GLN 153   0.661  16.742 -11.233
 1175   2HB   GLN 153          1HB       GLN 153   0.017  15.746 -12.529
 1176   1HG   GLN 153          2HG       GLN 153  -1.085  17.981 -12.189
 1177   2HG   GLN 153          1HG       GLN 153  -2.155  16.583 -12.247
 1178   1HE2  GLN 153          1HE2      GLN 153  -0.971  19.195 -10.367
 1179   2HE2  GLN 153          2HE2      GLN 153  -1.976  18.928  -8.975
 1180    H    ILE 154           H        ILE 154  -2.100  13.324  -9.821
 1181    HA   ILE 154           HA       ILE 154  -1.511  11.325 -11.801
 1182    HB   ILE 154           HB       ILE 154  -3.734  10.333 -10.698
 1183   1HG1  ILE 154          2HG1      ILE 154  -2.574  11.832  -8.364
 1184   2HG1  ILE 154          1HG1      ILE 154  -3.856  12.555  -9.333
 1185   1HG2  ILE 154          1HG2      ILE 154  -0.983  10.352  -9.461
 1186   2HG2  ILE 154          2HG2      ILE 154  -1.568   9.264 -10.720
 1187   3HG2  ILE 154          3HG2      ILE 154  -2.253   9.182  -9.096
 1188   1HD1  ILE 154          1HD1      ILE 154  -4.021   9.920  -7.889
 1189   2HD1  ILE 154          2HD1      ILE 154  -5.308  10.670  -8.833
 1190   3HD1  ILE 154          3HD1      ILE 154  -4.732  11.442  -7.354
 1191    H    ASP 155           H        ASP 155  -1.963  13.040 -13.408
 1192    HA   ASP 155           HA       ASP 155  -4.705  12.737 -14.413
 1193   1HB   ASP 155          2HB       ASP 155  -4.725  14.948 -13.585
 1194   2HB   ASP 155          1HB       ASP 155  -3.072  15.250 -14.105
 1195    H    LEU 156           H        LEU 156  -1.357  12.573 -14.901
 1196    HA   LEU 156           HA       LEU 156  -1.584  12.769 -17.813
 1197   1HB   LEU 156          2HB       LEU 156   0.935  12.675 -16.163
 1198   2HB   LEU 156          1HB       LEU 156   0.791  13.100 -17.859
 1199    HG   LEU 156           HG       LEU 156  -0.869  14.861 -16.347
 1200   1HD1  LEU 156          1HD1      LEU 156   1.158  15.983 -15.187
 1201   2HD1  LEU 156          2HD1      LEU 156   1.853  14.363 -15.228
 1202   3HD1  LEU 156          3HD1      LEU 156   0.329  14.648 -14.389
 1203   1HD2  LEU 156          1HD2      LEU 156   0.698  14.949 -18.567
 1204   2HD2  LEU 156          2HD2      LEU 156   1.654  15.885 -17.419
 1205   3HD2  LEU 156          3HD2      LEU 156  -0.008  16.356 -17.772
 1206    H    GLU 157           H        GLU 157   0.238  10.825 -15.439
 1207    HA   GLU 157           HA       GLU 157   1.015   8.715 -15.477
 1208   1HB   GLU 157          2HB       GLU 157  -1.784   8.508 -16.440
 1209   2HB   GLU 157          1HB       GLU 157  -0.774   7.060 -16.402
 1210   1HG   GLU 157          2HG       GLU 157  -1.494   6.929 -14.287
 1211   2HG   GLU 157          1HG       GLU 157  -0.202   8.087 -14.003
 1212    H    HIS 158           H        HIS 158   2.523   9.665 -17.120
 1213    HA   HIS 158           HA       HIS 158   2.641   7.791 -19.355
 1214   1HB   HIS 158          2HB       HIS 158   1.709   9.882 -20.291
 1215   2HB   HIS 158          1HB       HIS 158   3.084  10.777 -19.653
 1216    HD1  HIS 158           1HD      HIS 158   2.223   8.197 -22.281
 1217    HD2  HIS 158           2HD      HIS 158   5.337  10.750 -21.233
 1218    HE1  HIS 158           1HE      HIS 158   3.859   8.091 -24.185
 1219    HE2  HIS 158           2HE      HIS 158   5.795   9.534 -23.473
  Start of MODEL    6
    1    H    MET   1           H        MET   1-121.440 -63.190 -27.734
    2    HA   MET   1           HA       MET   1-123.469 -61.100 -27.974
    3   1HB   MET   1          2HB       MET   1-121.671 -61.644 -25.993
    4   2HB   MET   1          1HB       MET   1-120.835 -60.381 -26.887
    5   1HG   MET   1          2HG       MET   1-123.435 -59.450 -26.646
    6   2HG   MET   1          1HG       MET   1-123.083 -60.197 -25.088
    7   1HE   MET   1          1HE       MET   1-120.202 -59.991 -24.708
    8   2HE   MET   1          2HE       MET   1-121.015 -59.164 -23.380
    9   3HE   MET   1          3HE       MET   1-119.680 -58.377 -24.222
   10    H    ALA   2           H        ALA   2-120.707 -62.287 -29.571
   11    HA   ALA   2           HA       ALA   2-119.360 -61.555 -31.247
   12   1HB   ALA   2          1HB       ALA   2-120.661 -59.618 -32.631
   13   2HB   ALA   2          2HB       ALA   2-122.003 -60.415 -31.810
   14   3HB   ALA   2          3HB       ALA   2-120.922 -61.348 -32.845
   15    H    ASP   3           H        ASP   3-118.887 -60.416 -28.791
   16    HA   ASP   3           HA       ASP   3-117.793 -57.801 -29.476
   17   1HB   ASP   3          2HB       ASP   3-120.257 -57.974 -28.188
   18   2HB   ASP   3          1HB       ASP   3-119.110 -57.655 -26.897
   19    H    LYS   4           H        LYS   4-118.235 -60.422 -27.257
   20    HA   LYS   4           HA       LYS   4-116.231 -59.650 -25.388
   21   1HB   LYS   4          2HB       LYS   4-118.150 -61.767 -25.715
   22   2HB   LYS   4          1HB       LYS   4-116.592 -62.439 -25.248
   23   1HG   LYS   4          2HG       LYS   4-116.698 -60.478 -23.469
   24   2HG   LYS   4          1HG       LYS   4-118.431 -60.675 -23.734
   25   1HD   LYS   4          2HD       LYS   4-118.023 -62.143 -21.989
   26   2HD   LYS   4          1HD       LYS   4-117.943 -63.200 -23.402
   27   1HE   LYS   4          2HE       LYS   4-115.564 -63.199 -23.366
   28   2HE   LYS   4          1HE       LYS   4-115.519 -61.905 -22.171
   29   1HZ   LYS   4          1HZ       LYS   4-115.167 -63.701 -20.847
   30   2HZ   LYS   4          2HZ       LYS   4-116.084 -64.757 -21.808
   31   3HZ   LYS   4          3HZ       LYS   4-116.860 -63.653 -20.778
   32    H    MET   5           H        MET   5-115.188 -59.554 -28.026
   33    HA   MET   5           HA       MET   5-113.288 -61.785 -28.115
   34   1HB   MET   5          2HB       MET   5-114.546 -60.138 -30.104
   35   2HB   MET   5          1HB       MET   5-112.802 -59.951 -30.221
   36   1HG   MET   5          2HG       MET   5-114.111 -62.645 -30.118
   37   2HG   MET   5          1HG       MET   5-113.883 -61.764 -31.628
   38   1HE   MET   5          1HE       MET   5-112.924 -64.067 -29.286
   39   2HE   MET   5          2HE       MET   5-111.194 -63.992 -28.956
   40   3HE   MET   5          3HE       MET   5-111.786 -64.888 -30.355
   41    H    ASP   6           H        ASP   6-113.499 -58.283 -27.823
   42    HA   ASP   6           HA       ASP   6-110.683 -58.248 -26.974
   43   1HB   ASP   6          2HB       ASP   6-110.948 -55.698 -27.422
   44   2HB   ASP   6          1HB       ASP   6-110.706 -56.785 -28.778
   45    H    MET   7           H        MET   7-113.802 -56.647 -26.399
   46    HA   MET   7           HA       MET   7-114.905 -56.112 -24.481
   47   1HB   MET   7          2HB       MET   7-112.660 -57.662 -23.210
   48   2HB   MET   7          1HB       MET   7-113.857 -56.815 -22.240
   49   1HG   MET   7          2HG       MET   7-115.553 -58.234 -22.842
   50   2HG   MET   7          1HG       MET   7-114.776 -58.696 -24.355
   51   1HE   MET   7          1HE       MET   7-112.276 -59.516 -24.143
   52   2HE   MET   7          2HE       MET   7-113.017 -61.097 -24.393
   53   3HE   MET   7          3HE       MET   7-111.832 -60.873 -23.107
   54    H    SER   8           H        SER   8-111.457 -55.781 -23.658
   55    HA   SER   8           HA       SER   8-111.915 -53.083 -22.711
   56   1HB   SER   8          2HB       SER   8-109.231 -54.423 -22.975
   57   2HB   SER   8          1HB       SER   8-109.744 -53.200 -21.811
   58    HG   SER   8           HG       SER   8-111.245 -54.858 -21.016
   59    H    LEU   9           H        LEU   9-112.663 -52.435 -24.862
   60    HA   LEU   9           HA       LEU   9-110.988 -52.425 -27.137
   61   1HB   LEU   9          2HB       LEU   9-113.481 -50.955 -26.352
   62   2HB   LEU   9          1HB       LEU   9-112.634 -50.530 -27.825
   63    HG   LEU   9           HG       LEU   9-112.853 -53.176 -28.220
   64   1HD1  LEU   9          1HD1      LEU   9-114.786 -54.120 -27.351
   65   2HD1  LEU   9          2HD1      LEU   9-115.460 -52.560 -26.884
   66   3HD1  LEU   9          3HD1      LEU   9-114.116 -53.248 -25.973
   67   1HD2  LEU   9          1HD2      LEU   9-114.262 -52.596 -29.893
   68   2HD2  LEU   9          2HD2      LEU   9-113.804 -50.964 -29.403
   69   3HD2  LEU   9          3HD2      LEU   9-115.317 -51.664 -28.829
   70    H    ASP  10           H        ASP  10-111.489 -50.169 -24.504
   71    HA   ASP  10           HA       ASP  10-110.463 -47.841 -25.586
   72   1HB   ASP  10          2HB       ASP  10-110.456 -46.978 -23.449
   73   2HB   ASP  10          1HB       ASP  10-111.550 -48.341 -23.254
   74    H    ASP  11           H        ASP  11-108.666 -50.536 -24.170
   75    HA   ASP  11           HA       ASP  11-106.143 -49.232 -24.158
   76   1HB   ASP  11          2HB       ASP  11-106.419 -51.147 -22.758
   77   2HB   ASP  11          1HB       ASP  11-106.925 -52.148 -24.115
   78    H    ILE  12           H        ILE  12-107.808 -51.285 -26.486
   79    HA   ILE  12           HA       ILE  12-105.664 -51.407 -28.352
   80    HB   ILE  12           HB       ILE  12-108.601 -51.654 -28.964
   81   1HG1  ILE  12          2HG1      ILE  12-106.805 -53.995 -28.418
   82   2HG1  ILE  12          1HG1      ILE  12-107.540 -53.135 -27.070
   83   1HG2  ILE  12          1HG2      ILE  12-106.641 -51.466 -30.747
   84   2HG2  ILE  12          2HG2      ILE  12-108.001 -52.572 -30.978
   85   3HG2  ILE  12          3HG2      ILE  12-106.463 -53.182 -30.368
   86   1HD1  ILE  12          1HD1      ILE  12-109.346 -53.937 -29.254
   87   2HD1  ILE  12          2HD1      ILE  12-109.599 -53.929 -27.509
   88   3HD1  ILE  12          3HD1      ILE  12-108.674 -55.228 -28.261
   89    H    ILE  13           H        ILE  13-108.614 -49.454 -28.134
   90    HA   ILE  13           HA       ILE  13-108.284 -47.729 -30.259
   91    HB   ILE  13           HB       ILE  13-109.251 -47.079 -27.474
   92   1HG1  ILE  13          2HG1      ILE  13-110.870 -47.556 -29.978
   93   2HG1  ILE  13          1HG1      ILE  13-110.463 -48.842 -28.846
   94   1HG2  ILE  13          1HG2      ILE  13-109.682 -45.482 -29.996
   95   2HG2  ILE  13          2HG2      ILE  13-108.557 -45.051 -28.707
   96   3HG2  ILE  13          3HG2      ILE  13-110.290 -45.099 -28.385
   97   1HD1  ILE  13          1HD1      ILE  13-111.713 -46.441 -27.689
   98   2HD1  ILE  13          2HD1      ILE  13-111.957 -48.148 -27.316
   99   3HD1  ILE  13          3HD1      ILE  13-112.728 -47.434 -28.733
  100    H    LYS  14           H        LYS  14-106.843 -47.485 -27.046
  101    HA   LYS  14           HA       LYS  14-105.316 -45.187 -27.397
  102   1HB   LYS  14          2HB       LYS  14-105.055 -47.646 -25.725
  103   2HB   LYS  14          1HB       LYS  14-103.715 -46.507 -25.771
  104   1HG   LYS  14          2HG       LYS  14-106.530 -46.002 -24.853
  105   2HG   LYS  14          1HG       LYS  14-105.048 -45.944 -23.896
  106   1HD   LYS  14          2HD       LYS  14-105.423 -44.145 -26.262
  107   2HD   LYS  14          1HD       LYS  14-106.112 -43.726 -24.689
  108   1HE   LYS  14          2HE       LYS  14-103.240 -44.524 -24.861
  109   2HE   LYS  14          1HE       LYS  14-103.713 -42.898 -25.351
  110   1HZ   LYS  14          1HZ       LYS  14-103.029 -43.243 -22.946
  111   2HZ   LYS  14          2HZ       LYS  14-104.519 -44.025 -22.738
  112   3HZ   LYS  14          3HZ       LYS  14-104.478 -42.400 -23.222
  113    H    LEU  15           H        LEU  15-104.332 -48.568 -27.923
  114    HA   LEU  15           HA       LEU  15-101.804 -47.973 -29.016
  115   1HB   LEU  15          2HB       LEU  15-103.336 -50.287 -28.455
  116   2HB   LEU  15          1HB       LEU  15-102.858 -50.392 -30.137
  117    HG   LEU  15           HG       LEU  15-101.303 -51.514 -28.524
  118   1HD1  LEU  15          1HD1      LEU  15-100.504 -49.455 -30.503
  119   2HD1  LEU  15          2HD1      LEU  15-100.233 -51.198 -30.503
  120   3HD1  LEU  15          3HD1      LEU  15 -99.243 -50.152 -29.485
  121   1HD2  LEU  15          1HD2      LEU  15 -99.674 -49.611 -27.563
  122   2HD2  LEU  15          2HD2      LEU  15-101.003 -50.307 -26.638
  123   3HD2  LEU  15          3HD2      LEU  15-101.216 -48.762 -27.460
  124    H    ASN  16           H        ASN  16-104.991 -48.039 -30.365
  125    HA   ASN  16           HA       ASN  16-104.244 -48.097 -33.108
  126   1HB   ASN  16          2HB       ASN  16-106.724 -47.661 -31.564
  127   2HB   ASN  16          1HB       ASN  16-106.672 -46.892 -33.148
  128   1HD2  ASN  16          1HD2      ASN  16-107.279 -49.696 -31.458
  129   2HD2  ASN  16          2HD2      ASN  16-107.371 -50.795 -32.798
  130    H    ARG  17           H        ARG  17-104.965 -45.549 -30.777
  131    HA   ARG  17           HA       ARG  17-104.811 -43.343 -32.520
  132   1HB   ARG  17          2HB       ARG  17-104.382 -43.668 -29.558
  133   2HB   ARG  17          1HB       ARG  17-104.143 -42.113 -30.344
  134   1HG   ARG  17          2HG       ARG  17-106.356 -41.786 -30.684
  135   2HG   ARG  17          1HG       ARG  17-106.690 -43.508 -30.891
  136   1HD   ARG  17          2HD       ARG  17-106.558 -43.874 -28.522
  137   2HD   ARG  17          1HD       ARG  17-106.033 -42.214 -28.250
  138    HE   ARG  17           HE       ARG  17-108.533 -42.236 -29.575
  139   1HH1  ARG  17          1HH1      ARG  17-107.091 -42.820 -26.440
  140   2HH1  ARG  17          2HH1      ARG  17-108.543 -42.480 -25.553
  141   1HH2  ARG  17          1HH2      ARG  17-110.460 -41.779 -28.412
  142   2HH2  ARG  17          2HH2      ARG  17-110.447 -41.856 -26.669
  143    H    ASN  18           H        ASN  18-102.392 -45.192 -30.806
  144    HA   ASN  18           HA       ASN  18-100.189 -43.571 -31.686
  145   1HB   ASN  18          2HB       ASN  18 -99.868 -44.857 -29.690
  146   2HB   ASN  18          1HB       ASN  18-100.372 -46.341 -30.491
  147   1HD2  ASN  18          1HD2      ASN  18 -98.609 -47.558 -30.302
  148   2HD2  ASN  18          2HD2      ASN  18 -97.036 -47.142 -30.899
  149    H    GLN  19           H        GLN  19-100.889 -46.978 -32.383
  150    HA   GLN  19           HA       GLN  19-100.599 -48.282 -34.195
  151   1HB   GLN  19          2HB       GLN  19-102.231 -46.146 -34.925
  152   2HB   GLN  19          1HB       GLN  19-101.095 -46.315 -36.259
  153   1HG   GLN  19          2HG       GLN  19-103.415 -47.785 -35.812
  154   2HG   GLN  19          1HG       GLN  19-102.172 -48.092 -37.022
  155   1HE2  GLN  19          1HE2      GLN  19-103.425 -48.990 -33.908
  156   2HE2  GLN  19          2HE2      GLN  19-102.525 -50.459 -33.739
  157    H    ARG  20           H        ARG  20 -98.273 -46.612 -33.309
  158    HA   ARG  20           HA       ARG  20 -96.724 -46.689 -35.802
  159   1HB   ARG  20          2HB       ARG  20 -96.413 -45.197 -33.227
  160   2HB   ARG  20          1HB       ARG  20 -94.973 -45.586 -34.157
  161   1HG   ARG  20          2HG       ARG  20 -95.336 -43.746 -35.332
  162   2HG   ARG  20          1HG       ARG  20 -96.760 -44.535 -36.014
  163   1HD   ARG  20          2HD       ARG  20 -98.144 -43.637 -34.240
  164   2HD   ARG  20          1HD       ARG  20 -96.731 -42.924 -33.465
  165    HE   ARG  20           HE       ARG  20 -96.527 -41.518 -35.518
  166   1HH1  ARG  20          1HH1      ARG  20 -99.612 -42.949 -34.675
  167   2HH1  ARG  20          2HH1      ARG  20-100.549 -41.697 -35.441
  168   1HH2  ARG  20          1HH2      ARG  20 -97.750 -39.858 -36.508
  169   2HH2  ARG  20          2HH2      ARG  20 -99.490 -39.923 -36.456
  170    H    ARG  21           H        ARG  21 -96.105 -48.749 -36.057
  171    HA   ARG  21           HA       ARG  21 -95.435 -50.393 -33.776
  172   1HB   ARG  21          2HB       ARG  21 -96.463 -50.895 -36.314
  173   2HB   ARG  21          1HB       ARG  21 -94.839 -51.567 -36.364
  174   1HG   ARG  21          2HG       ARG  21 -95.290 -53.139 -34.753
  175   2HG   ARG  21          1HG       ARG  21 -96.592 -52.187 -34.037
  176   1HD   ARG  21          2HD       ARG  21 -96.695 -53.587 -36.708
  177   2HD   ARG  21          1HD       ARG  21 -97.439 -54.164 -35.217
  178    HE   ARG  21           HE       ARG  21 -98.664 -51.876 -35.367
  179   1HH1  ARG  21          1HH1      ARG  21 -97.843 -54.015 -38.024
  180   2HH1  ARG  21          2HH1      ARG  21 -99.140 -53.462 -39.045
  181   1HH2  ARG  21          1HH2      ARG  21-100.389 -51.162 -36.698
  182   2HH2  ARG  21          2HH2      ARG  21-100.599 -51.857 -38.283
  183    H    VAL  22           H        VAL  22 -93.698 -48.478 -33.622
  184    HA   VAL  22           HA       VAL  22 -91.186 -49.753 -34.450
  185    HB   VAL  22           HB       VAL  22 -90.184 -47.414 -34.578
  186   1HG1  VAL  22          1HG1      VAL  22 -90.381 -47.436 -36.835
  187   2HG1  VAL  22          2HG1      VAL  22 -92.132 -47.639 -36.795
  188   3HG1  VAL  22          3HG1      VAL  22 -91.076 -49.020 -36.501
  189   1HG2  VAL  22          1HG2      VAL  22 -92.820 -46.680 -33.857
  190   2HG2  VAL  22          2HG2      VAL  22 -92.537 -46.092 -35.495
  191   3HG2  VAL  22          3HG2      VAL  22 -91.443 -45.627 -34.191
  192    H    ASN  23           H        ASN  23 -89.839 -50.093 -32.802
  193    HA   ASN  23           HA       ASN  23 -90.592 -49.112 -30.175
  194   1HB   ASN  23          2HB       ASN  23 -89.564 -51.489 -30.968
  195   2HB   ASN  23          1HB       ASN  23 -88.087 -50.659 -30.483
  196   1HD2  ASN  23          1HD2      ASN  23 -87.747 -51.973 -28.719
  197   2HD2  ASN  23          2HD2      ASN  23 -88.742 -51.905 -27.297
  198    H    ARG  24           H        ARG  24 -90.167 -46.896 -30.953
  199    HA   ARG  24           HA       ARG  24 -87.381 -46.158 -31.299
  200   1HB   ARG  24          2HB       ARG  24 -89.293 -45.207 -32.667
  201   2HB   ARG  24          1HB       ARG  24 -89.781 -44.331 -31.224
  202   1HG   ARG  24          2HG       ARG  24 -87.227 -43.570 -31.323
  203   2HG   ARG  24          1HG       ARG  24 -87.497 -43.881 -33.040
  204   1HD   ARG  24          2HD       ARG  24 -88.031 -41.607 -32.710
  205   2HD   ARG  24          1HD       ARG  24 -89.574 -42.450 -32.834
  206    HE   ARG  24           HE       ARG  24 -89.708 -42.313 -30.383
  207   1HH1  ARG  24          1HH1      ARG  24 -87.476 -40.167 -32.026
  208   2HH1  ARG  24          2HH1      ARG  24 -87.517 -38.959 -30.774
  209   1HH2  ARG  24          1HH2      ARG  24 -89.750 -40.759 -28.734
  210   2HH2  ARG  24          2HH2      ARG  24 -88.810 -39.299 -28.886
  211    H    GLY  25           H        GLY  25 -86.117 -45.518 -29.706
  212   1HA   GLY  25          2HA       GLY  25 -87.353 -44.610 -27.186
  213   2HA   GLY  25          1HA       GLY  25 -85.727 -45.266 -27.342
  214    H    GLY  26           H        GLY  26 -84.761 -43.860 -29.487
  215   1HA   GLY  26          2HA       GLY  26 -84.439 -41.642 -30.310
  216   2HA   GLY  26          1HA       GLY  26 -85.122 -41.021 -28.815
  217    H    GLY  27           H        GLY  27 -83.248 -39.620 -28.815
  218   1HA   GLY  27          2HA       GLY  27 -81.435 -39.338 -27.225
  219   2HA   GLY  27          1HA       GLY  27 -80.917 -40.973 -27.610
  220    HA   PRO  28           HA       PRO  28 -79.595 -38.055 -31.242
  221   1HB   PRO  28          2HB       PRO  28 -79.323 -35.445 -30.621
  222   2HB   PRO  28          1HB       PRO  28 -80.852 -36.123 -31.193
  223   1HG   PRO  28          2HG       PRO  28 -79.991 -35.478 -28.400
  224   2HG   PRO  28          1HG       PRO  28 -81.555 -35.190 -29.183
  225   1HD   PRO  28          2HD       PRO  28 -81.079 -37.287 -27.503
  226   2HD   PRO  28          1HD       PRO  28 -82.273 -37.339 -28.814
  227    H    ARG  29           H        ARG  29 -77.466 -37.194 -31.719
  228    HA   ARG  29           HA       ARG  29 -75.629 -37.400 -29.424
  229   1HB   ARG  29          2HB       ARG  29 -75.652 -38.769 -31.974
  230   2HB   ARG  29          1HB       ARG  29 -74.150 -37.881 -31.752
  231   1HG   ARG  29          2HG       ARG  29 -73.751 -40.026 -30.898
  232   2HG   ARG  29          1HG       ARG  29 -73.990 -38.995 -29.485
  233   1HD   ARG  29          2HD       ARG  29 -76.526 -39.972 -30.274
  234   2HD   ARG  29          1HD       ARG  29 -75.415 -41.340 -30.251
  235    HE   ARG  29           HE       ARG  29 -75.332 -39.621 -27.917
  236   1HH1  ARG  29          1HH1      ARG  29 -76.704 -42.483 -29.396
  237   2HH1  ARG  29          2HH1      ARG  29 -77.122 -43.222 -27.873
  238   1HH2  ARG  29          1HH2      ARG  29 -75.849 -40.583 -25.928
  239   2HH2  ARG  29          2HH2      ARG  29 -76.587 -42.160 -25.892
  240    H    ARG  30           H        ARG  30 -76.265 -35.036 -29.377
  241    HA   ARG  30           HA       ARG  30 -74.483 -33.494 -31.150
  242   1HB   ARG  30          2HB       ARG  30 -77.287 -33.051 -30.312
  243   2HB   ARG  30          1HB       ARG  30 -76.253 -31.630 -30.269
  244   1HG   ARG  30          2HG       ARG  30 -77.155 -31.534 -32.387
  245   2HG   ARG  30          1HG       ARG  30 -75.602 -32.323 -32.673
  246   1HD   ARG  30          2HD       ARG  30 -76.794 -33.880 -33.749
  247   2HD   ARG  30          1HD       ARG  30 -77.236 -34.447 -32.139
  248    HE   ARG  30           HE       ARG  30 -79.076 -32.498 -32.724
  249   1HH1  ARG  30          1HH1      ARG  30 -78.056 -35.521 -34.176
  250   2HH1  ARG  30          2HH1      ARG  30 -79.599 -35.829 -34.921
  251   1HH2  ARG  30          1HH2      ARG  30 -81.094 -32.887 -33.710
  252   2HH2  ARG  30          2HH2      ARG  30 -81.332 -34.325 -34.658
  253    H    ASN  31           H        ASN  31 -74.549 -31.090 -29.848
  254    HA   ASN  31           HA       ASN  31 -73.697 -29.883 -28.130
  255   1HB   ASN  31          2HB       ASN  31 -75.673 -31.315 -27.017
  256   2HB   ASN  31          1HB       ASN  31 -74.318 -31.934 -26.080
  257   1HD2  ASN  31          1HD2      ASN  31 -76.120 -30.696 -24.673
  258   2HD2  ASN  31          2HD2      ASN  31 -75.619 -29.108 -24.202
  259    H    ARG  32           H        ARG  32 -72.022 -31.904 -29.457
  260    HA   ARG  32           HA       ARG  32 -70.271 -32.967 -27.468
  261   1HB   ARG  32          2HB       ARG  32 -70.704 -33.683 -29.993
  262   2HB   ARG  32          1HB       ARG  32 -69.322 -32.629 -30.264
  263   1HG   ARG  32          2HG       ARG  32 -67.933 -33.947 -28.861
  264   2HG   ARG  32          1HG       ARG  32 -69.309 -34.885 -28.277
  265   1HD   ARG  32          2HD       ARG  32 -68.637 -34.823 -31.193
  266   2HD   ARG  32          1HD       ARG  32 -67.761 -35.892 -30.098
  267    HE   ARG  32           HE       ARG  32 -69.769 -37.074 -29.679
  268   1HH1  ARG  32          1HH1      ARG  32 -70.111 -34.569 -32.110
  269   2HH1  ARG  32          2HH1      ARG  32 -71.582 -35.230 -32.772
  270   1HH2  ARG  32          1HH2      ARG  32 -71.680 -37.971 -30.564
  271   2HH2  ARG  32          2HH2      ARG  32 -72.470 -37.163 -31.889
  272    HA   PRO  33           HA       PRO  33 -67.304 -29.377 -28.946
  273   1HB   PRO  33          2HB       PRO  33 -68.623 -27.162 -29.905
  274   2HB   PRO  33          1HB       PRO  33 -67.855 -28.384 -30.922
  275   1HG   PRO  33          2HG       PRO  33 -70.731 -28.093 -30.152
  276   2HG   PRO  33          1HG       PRO  33 -70.027 -28.513 -31.727
  277   1HD   PRO  33          2HD       PRO  33 -71.075 -30.387 -30.129
  278   2HD   PRO  33          1HD       PRO  33 -69.622 -30.710 -31.098
  279    H    ALA  34           H        ALA  34 -70.468 -28.930 -27.594
  280    HA   ALA  34           HA       ALA  34 -69.359 -26.981 -25.694
  281   1HB   ALA  34          1HB       ALA  34 -72.286 -27.239 -25.886
  282   2HB   ALA  34          2HB       ALA  34 -71.474 -26.588 -27.311
  283   3HB   ALA  34          3HB       ALA  34 -71.277 -25.799 -25.745
  284    H    ILE  35           H        ILE  35 -69.183 -29.891 -25.601
  285    HA   ILE  35           HA       ILE  35 -70.888 -30.878 -23.559
  286    HB   ILE  35           HB       ILE  35 -69.503 -32.261 -25.166
  287   1HG1  ILE  35          2HG1      ILE  35 -68.719 -33.788 -23.061
  288   2HG1  ILE  35          1HG1      ILE  35 -69.870 -32.714 -22.273
  289   1HG2  ILE  35          1HG2      ILE  35 -67.412 -30.814 -24.418
  290   2HG2  ILE  35          2HG2      ILE  35 -67.247 -32.475 -24.994
  291   3HG2  ILE  35          3HG2      ILE  35 -67.234 -32.137 -23.262
  292   1HD1  ILE  35          1HD1      ILE  35 -70.392 -34.519 -24.619
  293   2HD1  ILE  35          2HD1      ILE  35 -71.550 -33.354 -23.974
  294   3HD1  ILE  35          3HD1      ILE  35 -71.002 -34.699 -22.973
  295    H    ALA  36           H        ALA  36 -68.080 -28.897 -23.588
  296    HA   ALA  36           HA       ALA  36 -68.144 -28.731 -20.678
  297   1HB   ALA  36          1HB       ALA  36 -66.333 -30.366 -21.589
  298   2HB   ALA  36          2HB       ALA  36 -65.906 -29.201 -20.335
  299   3HB   ALA  36          3HB       ALA  36 -65.473 -28.886 -22.015
  300    H    ARG  37           H        ARG  37 -65.515 -27.466 -22.570
  301    HA   ARG  37           HA       ARG  37 -66.720 -24.894 -23.012
  302   1HB   ARG  37          2HB       ARG  37 -65.015 -23.696 -21.588
  303   2HB   ARG  37          1HB       ARG  37 -66.262 -24.557 -20.698
  304   1HG   ARG  37          2HG       ARG  37 -64.044 -26.303 -21.109
  305   2HG   ARG  37          1HG       ARG  37 -63.469 -24.776 -20.437
  306   1HD   ARG  37          2HD       ARG  37 -65.015 -24.956 -18.592
  307   2HD   ARG  37          1HD       ARG  37 -65.742 -26.400 -19.297
  308    HE   ARG  37           HE       ARG  37 -62.955 -26.277 -18.313
  309   1HH1  ARG  37          1HH1      ARG  37 -66.029 -27.938 -18.647
  310   2HH1  ARG  37          2HH1      ARG  37 -65.453 -29.406 -17.921
  311   1HH2  ARG  37          1HH2      ARG  37 -62.211 -28.218 -17.329
  312   2HH2  ARG  37          2HH2      ARG  37 -63.298 -29.574 -17.183
  313    H    GLY  38           H        GLY  38 -65.228 -23.416 -24.127
  314   1HA   GLY  38          2HA       GLY  38 -62.831 -24.725 -25.207
  315   2HA   GLY  38          1HA       GLY  38 -64.071 -24.194 -26.332
  316    H    GLY  39           H        GLY  39 -62.101 -22.989 -27.111
  317   1HA   GLY  39          2HA       GLY  39 -61.551 -20.738 -27.552
  318   2HA   GLY  39          1HA       GLY  39 -62.204 -20.293 -25.981
  319    H    ARG  40           H        ARG  40 -60.648 -19.416 -24.834
  320    HA   ARG  40           HA       ARG  40 -58.828 -19.296 -23.484
  321   1HB   ARG  40          2HB       ARG  40 -58.918 -22.124 -24.118
  322   2HB   ARG  40          1HB       ARG  40 -57.264 -21.562 -23.918
  323   1HG   ARG  40          2HG       ARG  40 -59.205 -20.691 -21.876
  324   2HG   ARG  40          1HG       ARG  40 -58.780 -22.403 -21.893
  325   1HD   ARG  40          2HD       ARG  40 -56.639 -20.321 -22.017
  326   2HD   ARG  40          1HD       ARG  40 -57.378 -20.737 -20.470
  327    HE   ARG  40           HE       ARG  40 -56.387 -22.966 -22.056
  328   1HH1  ARG  40          1HH1      ARG  40 -55.743 -20.664 -19.498
  329   2HH1  ARG  40          2HH1      ARG  40 -54.515 -21.645 -18.751
  330   1HH2  ARG  40          1HH2      ARG  40 -54.764 -24.249 -21.083
  331   2HH2  ARG  40          2HH2      ARG  40 -53.960 -23.678 -19.655
  332    H    ASN  41           H        ASN  41 -57.665 -21.114 -26.326
  333    HA   ASN  41           HA       ASN  41 -55.416 -19.299 -26.536
  334   1HB   ASN  41          2HB       ASN  41 -55.507 -21.926 -26.963
  335   2HB   ASN  41          1HB       ASN  41 -55.921 -21.401 -28.591
  336   1HD2  ASN  41          1HD2      ASN  41 -53.794 -22.695 -28.735
  337   2HD2  ASN  41          2HD2      ASN  41 -52.354 -21.738 -28.737
  338    H    ARG  42           H        ARG  42 -56.735 -17.476 -26.953
  339    HA   ARG  42           HA       ARG  42 -56.967 -16.951 -29.763
  340   1HB   ARG  42          2HB       ARG  42 -59.117 -17.835 -29.675
  341   2HB   ARG  42          1HB       ARG  42 -59.390 -17.268 -28.035
  342   1HG   ARG  42          2HG       ARG  42 -59.373 -14.916 -29.028
  343   2HG   ARG  42          1HG       ARG  42 -59.507 -15.712 -30.597
  344   1HD   ARG  42          2HD       ARG  42 -61.398 -16.702 -28.599
  345   2HD   ARG  42          1HD       ARG  42 -61.607 -14.997 -28.995
  346    HE   ARG  42           HE       ARG  42 -62.231 -15.573 -31.152
  347   1HH1  ARG  42          1HH1      ARG  42 -61.240 -18.412 -29.348
  348   2HH1  ARG  42          2HH1      ARG  42 -61.837 -19.538 -30.528
  349   1HH2  ARG  42          1HH2      ARG  42 -63.034 -17.051 -32.705
  350   2HH2  ARG  42          2HH2      ARG  42 -62.846 -18.760 -32.438
  351    HA   PRO  43           HA       PRO  43 -57.365 -12.901 -27.168
  352   1HB   PRO  43          2HB       PRO  43 -57.354 -13.711 -24.360
  353   2HB   PRO  43          1HB       PRO  43 -58.473 -12.639 -25.206
  354   1HG   PRO  43          2HG       PRO  43 -59.206 -15.081 -24.330
  355   2HG   PRO  43          1HG       PRO  43 -59.874 -14.363 -25.808
  356   1HD   PRO  43          2HD       PRO  43 -57.708 -16.414 -25.514
  357   2HD   PRO  43          1HD       PRO  43 -59.062 -16.360 -26.662
  358    H    ALA  44           H        ALA  44 -55.400 -15.520 -26.799
  359    HA   ALA  44           HA       ALA  44 -53.179 -13.859 -25.825
  360   1HB   ALA  44          1HB       ALA  44 -52.672 -15.314 -24.217
  361   2HB   ALA  44          2HB       ALA  44 -52.759 -16.675 -25.335
  362   3HB   ALA  44          3HB       ALA  44 -54.220 -16.095 -24.535
  363    HA   PRO  45           HA       PRO  45 -51.338 -14.766 -29.798
  364   1HB   PRO  45          2HB       PRO  45 -48.875 -14.328 -28.171
  365   2HB   PRO  45          1HB       PRO  45 -49.335 -13.623 -29.726
  366   1HG   PRO  45          2HG       PRO  45 -49.506 -12.182 -27.510
  367   2HG   PRO  45          1HG       PRO  45 -50.779 -12.084 -28.743
  368   1HD   PRO  45          2HD       PRO  45 -50.787 -13.511 -26.117
  369   2HD   PRO  45          1HD       PRO  45 -52.100 -12.632 -26.928
  370    H    TYR  46           H        TYR  46 -49.475 -15.932 -26.986
  371    HA   TYR  46           HA       TYR  46 -49.812 -18.673 -27.915
  372   1HB   TYR  46          2HB       TYR  46 -47.485 -17.373 -28.526
  373   2HB   TYR  46          1HB       TYR  46 -47.094 -18.121 -26.983
  374    HD1  TYR  46           1HD      TYR  46 -48.321 -20.672 -26.978
  375    HD2  TYR  46           2HD      TYR  46 -46.592 -18.603 -30.268
  376    HE1  TYR  46           1HE      TYR  46 -47.911 -22.818 -28.104
  377    HE2  TYR  46           2HE      TYR  46 -46.179 -20.744 -31.405
  378    HH   TYR  46           HH       TYR  46 -45.849 -23.196 -30.662
  379    H    SER  47           H        SER  47 -51.046 -19.089 -26.198
  380    HA   SER  47           HA       SER  47 -51.586 -19.824 -24.128
  381   1HB   SER  47          2HB       SER  47 -48.704 -19.463 -23.309
  382   2HB   SER  47          1HB       SER  47 -49.900 -20.561 -22.620
  383    HG   SER  47           HG       SER  47 -49.922 -21.379 -24.960
  384    H    ARG  48           H        ARG  48 -49.191 -17.191 -23.809
  385    HA   ARG  48           HA       ARG  48 -51.157 -15.701 -22.232
  386   1HB   ARG  48          2HB       ARG  48 -48.517 -16.681 -21.309
  387   2HB   ARG  48          1HB       ARG  48 -48.914 -15.019 -20.897
  388   1HG   ARG  48          2HG       ARG  48 -50.877 -17.197 -20.349
  389   2HG   ARG  48          1HG       ARG  48 -49.512 -16.935 -19.261
  390   1HD   ARG  48          2HD       ARG  48 -50.413 -15.074 -18.404
  391   2HD   ARG  48          1HD       ARG  48 -50.905 -14.478 -19.988
  392    HE   ARG  48           HE       ARG  48 -52.984 -15.436 -19.701
  393   1HH1  ARG  48          1HH1      ARG  48 -50.819 -16.460 -17.131
  394   2HH1  ARG  48          2HH1      ARG  48 -52.089 -17.182 -16.181
  395   1HH2  ARG  48          1HH2      ARG  48 -54.653 -16.346 -18.436
  396   2HH2  ARG  48          2HH2      ARG  48 -54.267 -17.098 -16.920
  397    HA   PRO  49           HA       PRO  49 -49.588 -12.420 -24.846
  398   1HB   PRO  49          2HB       PRO  49 -50.998 -10.583 -23.066
  399   2HB   PRO  49          1HB       PRO  49 -51.333 -10.969 -24.756
  400   1HG   PRO  49          2HG       PRO  49 -52.964 -11.728 -22.733
  401   2HG   PRO  49          1HG       PRO  49 -52.771 -12.676 -24.218
  402   1HD   PRO  49          2HD       PRO  49 -51.533 -13.101 -21.522
  403   2HD   PRO  49          1HD       PRO  49 -52.213 -14.294 -22.653
  404    H    LYS  50           H        LYS  50 -47.501 -11.877 -24.559
  405    HA   LYS  50           HA       LYS  50 -46.698 -10.822 -21.930
  406   1HB   LYS  50          2HB       LYS  50 -44.349 -11.477 -22.735
  407   2HB   LYS  50          1HB       LYS  50 -45.437 -12.772 -22.258
  408   1HG   LYS  50          2HG       LYS  50 -45.712 -12.200 -25.064
  409   2HG   LYS  50          1HG       LYS  50 -44.029 -12.532 -24.649
  410   1HD   LYS  50          2HD       LYS  50 -44.668 -14.628 -23.612
  411   2HD   LYS  50          1HD       LYS  50 -46.374 -14.285 -23.916
  412   1HE   LYS  50          2HE       LYS  50 -46.204 -15.221 -25.922
  413   2HE   LYS  50          1HE       LYS  50 -44.982 -14.031 -26.373
  414   1HZ   LYS  50          1HZ       LYS  50 -44.624 -16.766 -25.347
  415   2HZ   LYS  50          2HZ       LYS  50 -43.420 -15.610 -25.056
  416   3HZ   LYS  50          3HZ       LYS  50 -43.858 -15.993 -26.648
  417    HA   PRO  51           HA       PRO  51 -45.610  -7.094 -24.089
  418   1HB   PRO  51          2HB       PRO  51 -44.399  -5.793 -22.085
  419   2HB   PRO  51          1HB       PRO  51 -46.136  -6.112 -22.061
  420   1HG   PRO  51          2HG       PRO  51 -43.942  -7.451 -20.567
  421   2HG   PRO  51          1HG       PRO  51 -45.615  -7.146 -20.075
  422   1HD   PRO  51          2HD       PRO  51 -44.576  -9.562 -21.071
  423   2HD   PRO  51          1HD       PRO  51 -46.291  -9.156 -20.873
  424    H    LEU  52           H        LEU  52 -44.045  -6.996 -25.573
  425    HA   LEU  52           HA       LEU  52 -41.265  -7.264 -24.708
  426   1HB   LEU  52          2HB       LEU  52 -40.865  -8.530 -26.903
  427   2HB   LEU  52          1HB       LEU  52 -41.577  -9.403 -25.560
  428    HG   LEU  52           HG       LEU  52 -43.671  -8.292 -27.176
  429   1HD1  LEU  52          1HD1      LEU  52 -41.817  -8.419 -28.902
  430   2HD1  LEU  52          2HD1      LEU  52 -43.302  -9.298 -29.271
  431   3HD1  LEU  52          3HD1      LEU  52 -41.881 -10.169 -28.692
  432   1HD2  LEU  52          1HD2      LEU  52 -42.802 -11.136 -26.665
  433   2HD2  LEU  52          2HD2      LEU  52 -44.374 -10.622 -27.277
  434   3HD2  LEU  52          3HD2      LEU  52 -43.879 -10.186 -25.640
  435    HA   PRO  53           HA       PRO  53 -41.905  -3.739 -27.677
  436   1HB   PRO  53          2HB       PRO  53 -42.001  -1.655 -26.063
  437   2HB   PRO  53          1HB       PRO  53 -43.383  -2.752 -26.112
  438   1HG   PRO  53          2HG       PRO  53 -41.121  -2.671 -24.147
  439   2HG   PRO  53          1HG       PRO  53 -42.868  -2.712 -23.820
  440   1HD   PRO  53          2HD       PRO  53 -41.269  -4.952 -23.844
  441   2HD   PRO  53          1HD       PRO  53 -43.007  -4.976 -24.195
  442    H    ASP  54           H        ASP  54 -40.417  -1.355 -26.643
  443    HA   ASP  54           HA       ASP  54 -37.792  -2.277 -27.413
  444   1HB   ASP  54          2HB       ASP  54 -39.111   0.018 -27.938
  445   2HB   ASP  54          1HB       ASP  54 -38.159   0.532 -26.548
  446    H    LYS  55           H        LYS  55 -37.999  -3.587 -25.293
  447    HA   LYS  55           HA       LYS  55 -36.393  -2.155 -23.301
  448   1HB   LYS  55          2HB       LYS  55 -39.057  -3.207 -22.924
  449   2HB   LYS  55          1HB       LYS  55 -37.918  -4.043 -21.876
  450   1HG   LYS  55          2HG       LYS  55 -38.449  -2.326 -20.503
  451   2HG   LYS  55          1HG       LYS  55 -37.134  -1.554 -21.389
  452   1HD   LYS  55          2HD       LYS  55 -38.560  -0.228 -22.618
  453   2HD   LYS  55          1HD       LYS  55 -39.915  -1.346 -22.446
  454   1HE   LYS  55          2HE       LYS  55 -39.578  -0.671 -19.878
  455   2HE   LYS  55          1HE       LYS  55 -38.969   0.800 -20.639
  456   1HZ   LYS  55          1HZ       LYS  55 -41.636  -0.428 -21.115
  457   2HZ   LYS  55          2HZ       LYS  55 -41.053   0.982 -21.860
  458   3HZ   LYS  55          3HZ       LYS  55 -41.336   0.961 -20.188
  459    H    TRP  56           H        TRP  56 -34.678  -3.233 -24.419
  460    HA   TRP  56           HA       TRP  56 -34.562  -6.132 -24.004
  461   1HB   TRP  56          2HB       TRP  56 -32.499  -4.765 -25.645
  462   2HB   TRP  56          1HB       TRP  56 -33.295  -6.310 -25.896
  463    HD1  TRP  56           HD       TRP  56 -33.553  -2.638 -26.802
  464    HE1  TRP  56           1HE      TRP  56 -35.414  -2.328 -28.556
  465    HE3  TRP  56           3HE      TRP  56 -35.584  -7.327 -26.663
  466    HZ2  TRP  56           2HZ      TRP  56 -37.462  -3.872 -29.727
  467    HZ3  TRP  56           3HZ      TRP  56 -37.491  -7.828 -28.133
  468    HH2  TRP  56           HH       TRP  56 -38.410  -6.136 -29.632
  469    H    GLN  57           H        GLN  57 -31.840  -3.971 -24.469
  470    HA   GLN  57           HA       GLN  57 -30.703  -4.963 -21.958
  471   1HB   GLN  57          2HB       GLN  57 -28.540  -4.268 -22.850
  472   2HB   GLN  57          1HB       GLN  57 -29.368  -5.306 -23.995
  473   1HG   GLN  57          2HG       GLN  57 -29.464  -2.315 -24.218
  474   2HG   GLN  57          1HG       GLN  57 -28.143  -3.259 -24.900
  475   1HE2  GLN  57          1HE2      GLN  57 -28.609  -4.734 -26.591
  476   2HE2  GLN  57          2HE2      GLN  57 -30.005  -4.513 -27.588
  477    H    HIS  58           H        HIS  58 -32.651  -3.188 -21.507
  478    HA   HIS  58           HA       HIS  58 -33.188  -1.275 -20.396
  479   1HB   HIS  58          2HB       HIS  58 -30.786  -1.781 -19.376
  480   2HB   HIS  58          1HB       HIS  58 -30.346  -0.344 -20.289
  481    HD1  HIS  58           1HD      HIS  58 -30.888   1.879 -19.264
  482    HD2  HIS  58           2HD      HIS  58 -32.804  -1.284 -17.353
  483    HE1  HIS  58           1HE      HIS  58 -31.919   2.860 -17.190
  484    HE2  HIS  58           2HE      HIS  58 -32.899   0.893 -15.959
  485    H    ASP  59           H        ASP  59 -30.282  -0.194 -22.035
  486    HA   ASP  59           HA       ASP  59 -31.834   1.257 -24.037
  487   1HB   ASP  59          2HB       ASP  59 -29.943   3.120 -23.572
  488   2HB   ASP  59          1HB       ASP  59 -31.516   3.159 -22.781
  489    H    LEU  60           H        LEU  60 -28.552   0.882 -22.796
  490    HA   LEU  60           HA       LEU  60 -27.715  -1.100 -24.526
  491   1HB   LEU  60          2HB       LEU  60 -27.826   1.359 -25.885
  492   2HB   LEU  60          1HB       LEU  60 -26.131   1.089 -25.531
  493    HG   LEU  60           HG       LEU  60 -27.585  -1.225 -26.642
  494   1HD1  LEU  60          1HD1      LEU  60 -26.759   0.269 -28.874
  495   2HD1  LEU  60          2HD1      LEU  60 -27.766   1.334 -27.894
  496   3HD1  LEU  60          3HD1      LEU  60 -28.396  -0.222 -28.437
  497   1HD2  LEU  60          1HD2      LEU  60 -25.213  -0.554 -28.022
  498   2HD2  LEU  60          2HD2      LEU  60 -25.479  -1.867 -26.873
  499   3HD2  LEU  60          3HD2      LEU  60 -24.919  -0.293 -26.302
  500    H    PHE  61           H        PHE  61 -25.716   1.737 -24.154
  501    HA   PHE  61           HA       PHE  61 -24.282   0.379 -21.968
  502   1HB   PHE  61          2HB       PHE  61 -23.343   1.436 -24.434
  503   2HB   PHE  61          1HB       PHE  61 -22.708   2.437 -23.131
  504    HD1  PHE  61           1HD      PHE  61 -20.995   1.658 -21.717
  505    HD2  PHE  61           2HD      PHE  61 -22.912  -1.016 -24.411
  506    HE1  PHE  61           1HE      PHE  61 -19.267  -0.031 -21.261
  507    HE2  PHE  61           2HE      PHE  61 -21.189  -2.712 -23.958
  508    HZ   PHE  61           HZ       PHE  61 -19.404  -2.249 -22.345
  509    H    ASP  62           H        ASP  62 -26.580   2.139 -21.901
  510    HA   ASP  62           HA       ASP  62 -27.462   3.660 -20.498
  511   1HB   ASP  62          2HB       ASP  62 -25.536   2.542 -19.000
  512   2HB   ASP  62          1HB       ASP  62 -24.906   4.183 -19.075
  513    H    SER  63           H        SER  63 -26.229   5.936 -19.288
  514    HA   SER  63           HA       SER  63 -26.028   7.599 -21.668
  515   1HB   SER  63          2HB       SER  63 -25.924   8.665 -18.868
  516   2HB   SER  63          1HB       SER  63 -26.629   9.389 -20.315
  517    HG   SER  63           HG       SER  63 -27.833   7.039 -19.759
  518    H    GLY  64           H        GLY  64 -23.879   5.859 -19.972
  519   1HA   GLY  64          2HA       GLY  64 -21.603   6.766 -21.106
  520   2HA   GLY  64          1HA       GLY  64 -21.780   7.828 -19.717
  521    H    CYS  65           H        CYS  65 -22.220   4.325 -20.288
  522    HA   CYS  65           HA       CYS  65 -21.024   3.713 -17.740
  523   1HB   CYS  65          2HB       CYS  65 -22.258   2.139 -19.952
  524   2HB   CYS  65          1HB       CYS  65 -21.176   1.307 -18.840
  525    HG   CYS  65           HG       CYS  65 -22.685   2.052 -16.556
  526    H    GLY  66           H        GLY  66 -18.971   4.750 -18.122
  527   1HA   GLY  66          2HA       GLY  66 -16.825   3.182 -18.460
  528   2HA   GLY  66          1HA       GLY  66 -17.218   3.599 -20.122
  529    H    GLY  67           H        GLY  67 -16.298   4.897 -16.986
  530   1HA   GLY  67          2HA       GLY  67 -15.057   7.171 -18.378
  531   2HA   GLY  67          1HA       GLY  67 -16.156   7.493 -17.042
  532    H    GLY  68           H        GLY  68 -14.414   8.515 -15.932
  533   1HA   GLY  68          2HA       GLY  68 -12.056   7.006 -15.242
  534   2HA   GLY  68          1HA       GLY  68 -12.501   8.592 -14.624
  535    H    GLU  69           H        GLU  69 -12.323   5.285 -13.992
  536    HA   GLU  69           HA       GLU  69 -14.358   5.188 -11.953
  537   1HB   GLU  69          2HB       GLU  69 -12.840   3.316 -13.419
  538   2HB   GLU  69          1HB       GLU  69 -12.440   3.064 -11.725
  539   1HG   GLU  69          2HG       GLU  69 -14.353   2.022 -11.377
  540   2HG   GLU  69          1HG       GLU  69 -15.264   3.398 -12.002
  541    H    GLY  70           H        GLY  70 -11.248   6.422 -12.076
  542   1HA   GLY  70          2HA       GLY  70 -10.076   7.464 -10.357
  543   2HA   GLY  70          1HA       GLY  70 -11.210   6.773  -9.202
  544    H    VAL  71           H        VAL  71  -9.991   4.534 -11.389
  545    HA   VAL  71           HA       VAL  71  -8.578   3.135  -9.328
  546    HB   VAL  71           HB       VAL  71  -9.918   1.845 -10.858
  547   1HG1  VAL  71          1HG1      VAL  71  -9.240   1.682 -13.282
  548   2HG1  VAL  71          2HG1      VAL  71  -8.256   3.121 -13.014
  549   3HG1  VAL  71          3HG1      VAL  71 -10.005   3.195 -12.794
  550   1HG2  VAL  71          1HG2      VAL  71  -7.036   1.412 -10.681
  551   2HG2  VAL  71          2HG2      VAL  71  -7.794   0.590 -12.045
  552   3HG2  VAL  71          3HG2      VAL  71  -8.373   0.294 -10.405
  553    H    GLU  72           H        GLU  72  -7.846   5.312 -11.824
  554    HA   GLU  72           HA       GLU  72  -5.010   4.599 -11.911
  555   1HB   GLU  72          2HB       GLU  72  -5.898   6.916 -13.481
  556   2HB   GLU  72          1HB       GLU  72  -4.959   5.513 -13.975
  557   1HG   GLU  72          2HG       GLU  72  -6.829   5.193 -15.224
  558   2HG   GLU  72          1HG       GLU  72  -7.285   4.301 -13.773
  559    H    THR  73           H        THR  73  -7.168   6.988 -10.619
  560    HA   THR  73           HA       THR  73  -5.103   8.921 -10.080
  561    HB   THR  73           HB       THR  73  -7.203   9.596  -8.434
  562    HG1  THR  73           1HG      THR  73  -8.957   8.672  -9.140
  563   1HG2  THR  73          1HG2      THR  73  -7.370  11.414  -9.794
  564   2HG2  THR  73          2HG2      THR  73  -7.404  10.445 -11.266
  565   3HG2  THR  73          3HG2      THR  73  -5.873  10.754 -10.449
  566    H    GLY  74           H        GLY  74  -3.789   7.160  -9.045
  567   1HA   GLY  74          2HA       GLY  74  -4.414   7.085  -6.163
  568   2HA   GLY  74          1HA       GLY  74  -3.789   5.674  -7.007
  569    H    ALA  75           H        ALA  75  -2.277   6.082  -5.100
  570    HA   ALA  75           HA       ALA  75  -0.077   7.839  -5.972
  571   1HB   ALA  75          1HB       ALA  75   0.422   8.348  -3.740
  572   2HB   ALA  75          2HB       ALA  75  -0.554   7.014  -3.125
  573   3HB   ALA  75          3HB       ALA  75  -1.339   8.431  -3.824
  574    H    LYS  76           H        LYS  76   1.584   6.695  -6.708
  575    HA   LYS  76           HA       LYS  76   1.913   3.925  -5.814
  576   1HB   LYS  76          2HB       LYS  76   1.725   4.188  -8.194
  577   2HB   LYS  76          1HB       LYS  76   2.962   5.436  -8.209
  578   1HG   LYS  76          2HG       LYS  76   4.662   3.830  -7.649
  579   2HG   LYS  76          1HG       LYS  76   3.449   2.562  -7.456
  580   1HD   LYS  76          2HD       LYS  76   2.828   2.910  -9.857
  581   2HD   LYS  76          1HD       LYS  76   4.215   3.992  -9.996
  582   1HE   LYS  76          2HE       LYS  76   5.732   2.292  -9.847
  583   2HE   LYS  76          1HE       LYS  76   4.674   1.290  -8.854
  584   1HZ   LYS  76          1HZ       LYS  76   5.092   0.533 -11.216
  585   2HZ   LYS  76          2HZ       LYS  76   4.104   1.821 -11.711
  586   3HZ   LYS  76          3HZ       LYS  76   3.471   0.599 -10.717
  587    H    LEU  77           H        LEU  77   3.333   3.543  -4.281
  588    HA   LEU  77           HA       LEU  77   5.693   5.278  -4.015
  589   1HB   LEU  77          2HB       LEU  77   4.406   5.244  -2.028
  590   2HB   LEU  77          1HB       LEU  77   4.142   3.525  -2.127
  591    HG   LEU  77           HG       LEU  77   5.635   4.341  -0.265
  592   1HD1  LEU  77          1HD1      LEU  77   5.577   2.018  -0.864
  593   2HD1  LEU  77          2HD1      LEU  77   7.221   2.505  -0.447
  594   3HD1  LEU  77          3HD1      LEU  77   6.766   2.285  -2.138
  595   1HD2  LEU  77          1HD2      LEU  77   7.499   4.849  -2.572
  596   2HD2  LEU  77          2HD2      LEU  77   8.032   4.684  -0.900
  597   3HD2  LEU  77          3HD2      LEU  77   6.945   5.998  -1.354
  598    H    LEU  78           H        LEU  78   7.571   4.485  -4.744
  599    HA   LEU  78           HA       LEU  78   7.955   1.561  -4.751
  600   1HB   LEU  78          2HB       LEU  78   9.502   3.592  -6.351
  601   2HB   LEU  78          1HB       LEU  78   9.525   1.850  -6.536
  602    HG   LEU  78           HG       LEU  78   6.839   2.765  -6.892
  603   1HD1  LEU  78          1HD1      LEU  78   6.962   4.348  -8.574
  604   2HD1  LEU  78          2HD1      LEU  78   8.662   4.013  -8.907
  605   3HD1  LEU  78          3HD1      LEU  78   8.206   4.895  -7.450
  606   1HD2  LEU  78          1HD2      LEU  78   7.927   0.693  -7.755
  607   2HD2  LEU  78          2HD2      LEU  78   8.801   1.696  -8.913
  608   3HD2  LEU  78          3HD2      LEU  78   7.040   1.608  -8.975
  609    H    VAL  79           H        VAL  79   8.965   1.059  -2.875
  610    HA   VAL  79           HA       VAL  79  11.268   2.691  -2.054
  611    HB   VAL  79           HB       VAL  79  11.142   1.258   0.058
  612   1HG1  VAL  79          1HG1      VAL  79   8.869   2.561   0.668
  613   2HG1  VAL  79          2HG1      VAL  79   9.366   3.443  -0.776
  614   3HG1  VAL  79          3HG1      VAL  79  10.457   3.325   0.605
  615   1HG2  VAL  79          1HG2      VAL  79   9.238  -0.069  -1.450
  616   2HG2  VAL  79          2HG2      VAL  79   8.316   0.806  -0.227
  617   3HG2  VAL  79          3HG2      VAL  79   9.595  -0.308   0.259
  618    H    SER  80           H        SER  80  13.268   1.947  -2.399
  619    HA   SER  80           HA       SER  80  13.686  -0.963  -2.119
  620   1HB   SER  80          2HB       SER  80  15.767   0.476  -3.618
  621   2HB   SER  80          1HB       SER  80  14.980  -1.062  -3.979
  622    HG   SER  80           HG       SER  80  13.242   0.975  -4.269
  623    H    ASN  81           H        ASN  81  14.409  -1.160  -0.125
  624    HA   ASN  81           HA       ASN  81  16.273   0.848   0.921
  625   1HB   ASN  81          2HB       ASN  81  14.115   0.240   2.148
  626   2HB   ASN  81          1HB       ASN  81  14.861  -1.315   2.490
  627   1HD2  ASN  81          1HD2      ASN  81  14.075   0.131   4.564
  628   2HD2  ASN  81          2HD2      ASN  81  15.423   0.805   5.412
  629    H    LEU  82           H        LEU  82  16.005  -2.316   2.228
  630    HA   LEU  82           HA       LEU  82  17.837  -3.929   1.172
  631   1HB   LEU  82          2HB       LEU  82  19.456  -1.985   1.296
  632   2HB   LEU  82          1HB       LEU  82  19.379  -2.117   3.041
  633    HG   LEU  82           HG       LEU  82  20.002  -4.691   2.237
  634   1HD1  LEU  82          1HD1      LEU  82  20.392  -3.718  -0.048
  635   2HD1  LEU  82          2HD1      LEU  82  21.764  -4.569   0.659
  636   3HD1  LEU  82          3HD1      LEU  82  21.728  -2.804   0.653
  637   1HD2  LEU  82          1HD2      LEU  82  21.444  -4.304   3.876
  638   2HD2  LEU  82          2HD2      LEU  82  21.119  -2.574   3.767
  639   3HD2  LEU  82          3HD2      LEU  82  22.403  -3.292   2.795
  640    H    ASP  83           H        ASP  83  18.538  -2.651   4.362
  641    HA   ASP  83           HA       ASP  83  18.226  -3.425   6.458
  642   1HB   ASP  83          2HB       ASP  83  15.756  -3.124   5.389
  643   2HB   ASP  83          1HB       ASP  83  15.703  -4.828   5.833
  644    H    PHE  84           H        PHE  84  16.809  -5.791   7.310
  645    HA   PHE  84           HA       PHE  84  18.825  -7.775   6.631
  646   1HB   PHE  84          2HB       PHE  84  17.313  -7.187   8.933
  647   2HB   PHE  84          1HB       PHE  84  16.744  -8.758   8.375
  648    HD1  PHE  84           1HD      PHE  84  17.618  -9.948  10.270
  649    HD2  PHE  84           2HD      PHE  84  20.177  -7.616   7.797
  650    HE1  PHE  84           1HE      PHE  84  19.575 -11.021  11.295
  651    HE2  PHE  84           2HE      PHE  84  22.143  -8.688   8.817
  652    HZ   PHE  84           HZ       PHE  84  21.845 -10.389  10.571
  653    H    GLY  85           H        GLY  85  15.813  -6.844   5.547
  654   1HA   GLY  85          2HA       GLY  85  15.284  -8.315   3.480
  655   2HA   GLY  85          1HA       GLY  85  15.017  -9.539   4.716
  656    H    VAL  86           H        VAL  86  13.729  -6.809   3.090
  657    HA   VAL  86           HA       VAL  86  11.488  -6.532   4.930
  658    HB   VAL  86           HB       VAL  86  12.028  -5.128   2.302
  659   1HG1  VAL  86          1HG1      VAL  86  10.233  -3.732   2.710
  660   2HG1  VAL  86          2HG1      VAL  86  10.196  -4.110   4.432
  661   3HG1  VAL  86          3HG1      VAL  86   9.619  -5.291   3.257
  662   1HG2  VAL  86          1HG2      VAL  86  12.254  -3.723   4.901
  663   2HG2  VAL  86          2HG2      VAL  86  13.147  -3.483   3.400
  664   3HG2  VAL  86          3HG2      VAL  86  13.553  -4.831   4.463
  665    H    SER  87           H        SER  87   9.983  -8.115   4.783
  666    HA   SER  87           HA       SER  87   9.415  -9.415   2.299
  667   1HB   SER  87          2HB       SER  87   7.584  -9.797   4.584
  668   2HB   SER  87          1HB       SER  87   8.430 -10.993   3.599
  669    HG   SER  87           HG       SER  87   9.342  -9.560   5.857
  670    H    ASP  88           H        ASP  88   6.946  -9.818   1.924
  671    HA   ASP  88           HA       ASP  88   5.910  -7.536   0.715
  672   1HB   ASP  88          2HB       ASP  88   5.331 -10.175   0.617
  673   2HB   ASP  88          1HB       ASP  88   3.964  -9.606   1.567
  674    H    ALA  89           H        ALA  89   5.007  -9.048   3.787
  675    HA   ALA  89           HA       ALA  89   3.015  -7.073   4.378
  676   1HB   ALA  89          1HB       ALA  89   2.476  -9.086   5.331
  677   2HB   ALA  89          2HB       ALA  89   3.205  -8.252   6.704
  678   3HB   ALA  89          3HB       ALA  89   4.142  -9.438   5.793
  679    H    ASP  90           H        ASP  90   6.423  -7.195   4.792
  680    HA   ASP  90           HA       ASP  90   6.699  -5.825   7.238
  681   1HB   ASP  90          2HB       ASP  90   8.436  -6.500   4.960
  682   2HB   ASP  90          1HB       ASP  90   8.909  -5.045   5.829
  683    H    ILE  91           H        ILE  91   7.298  -4.478   3.992
  684    HA   ILE  91           HA       ILE  91   7.180  -1.809   4.700
  685    HB   ILE  91           HB       ILE  91   7.999  -2.700   2.520
  686   1HG1  ILE  91          2HG1      ILE  91   7.186  -0.766   1.171
  687   2HG1  ILE  91          1HG1      ILE  91   5.985  -0.445   2.418
  688   1HG2  ILE  91          1HG2      ILE  91   5.222  -3.472   2.266
  689   2HG2  ILE  91          2HG2      ILE  91   6.632  -4.006   1.353
  690   3HG2  ILE  91          3HG2      ILE  91   5.779  -2.538   0.878
  691   1HD1  ILE  91          1HD1      ILE  91   7.532   0.958   3.212
  692   2HD1  ILE  91          2HD1      ILE  91   8.847   0.156   2.353
  693   3HD1  ILE  91          3HD1      ILE  91   8.264  -0.500   3.884
  694    H    GLN  92           H        GLN  92   4.554  -4.027   4.121
  695    HA   GLN  92           HA       GLN  92   2.511  -2.074   3.804
  696   1HB   GLN  92          2HB       GLN  92   2.329  -4.517   3.176
  697   2HB   GLN  92          1HB       GLN  92   2.161  -4.869   4.891
  698   1HG   GLN  92          2HG       GLN  92   0.264  -2.986   4.618
  699   2HG   GLN  92          1HG       GLN  92   0.240  -3.686   3.000
  700   1HE2  GLN  92          1HE2      GLN  92  -1.969  -4.237   3.745
  701   2HE2  GLN  92          2HE2      GLN  92  -2.190  -5.733   4.586
  702    H    GLU  93           H        GLU  93   3.703  -3.953   6.554
  703    HA   GLU  93           HA       GLU  93   2.018  -2.817   8.506
  704   1HB   GLU  93          2HB       GLU  93   4.645  -4.263   8.572
  705   2HB   GLU  93          1HB       GLU  93   4.004  -3.542  10.041
  706   1HG   GLU  93          2HG       GLU  93   2.041  -5.135   8.610
  707   2HG   GLU  93          1HG       GLU  93   3.461  -6.057   9.104
  708    H    LEU  94           H        LEU  94   5.156  -1.886   7.208
  709    HA   LEU  94           HA       LEU  94   5.832   0.104   9.035
  710   1HB   LEU  94          2HB       LEU  94   6.722  -0.833   6.479
  711   2HB   LEU  94          1HB       LEU  94   6.698   0.918   6.466
  712    HG   LEU  94           HG       LEU  94   8.074   0.843   8.590
  713   1HD1  LEU  94          1HD1      LEU  94   8.475  -1.096   9.586
  714   2HD1  LEU  94          2HD1      LEU  94   9.247  -1.708   8.124
  715   3HD1  LEU  94          3HD1      LEU  94   7.512  -1.918   8.360
  716   1HD2  LEU  94          1HD2      LEU  94  10.104  -0.167   7.140
  717   2HD2  LEU  94          2HD2      LEU  94   9.437   1.448   6.897
  718   3HD2  LEU  94          3HD2      LEU  94   8.923   0.116   5.862
  719    H    PHE  95           H        PHE  95   4.651   0.799   5.736
  720    HA   PHE  95           HA       PHE  95   3.753   3.349   6.265
  721   1HB   PHE  95          2HB       PHE  95   3.272   1.378   4.145
  722   2HB   PHE  95          1HB       PHE  95   2.047   2.630   4.295
  723    HD1  PHE  95           1HD      PHE  95   2.885   5.062   4.361
  724    HD2  PHE  95           2HD      PHE  95   5.209   1.786   2.958
  725    HE1  PHE  95           1HE      PHE  95   4.331   6.621   3.126
  726    HE2  PHE  95           2HE      PHE  95   6.660   3.341   1.721
  727    HZ   PHE  95           HZ       PHE  95   6.189   5.749   1.755
  728    H    ALA  96           H        ALA  96   2.197   0.413   7.238
  729    HA   ALA  96           HA       ALA  96  -0.378   1.581   7.685
  730   1HB   ALA  96          1HB       ALA  96   0.157  -0.906   7.567
  731   2HB   ALA  96          2HB       ALA  96  -0.931  -0.390   8.856
  732   3HB   ALA  96          3HB       ALA  96   0.758  -0.745   9.218
  733    H    GLU  97           H        GLU  97   2.397   0.886   9.737
  734    HA   GLU  97           HA       GLU  97   1.672   2.346  12.016
  735   1HB   GLU  97          2HB       GLU  97   4.047   1.152  11.014
  736   2HB   GLU  97          1HB       GLU  97   4.453   2.801  11.474
  737   1HG   GLU  97          2HG       GLU  97   2.841   1.637  13.517
  738   2HG   GLU  97          1HG       GLU  97   4.169   0.542  13.128
  739    H    PHE  98           H        PHE  98   3.205   3.378   9.029
  740    HA   PHE  98           HA       PHE  98   3.380   6.133   9.522
  741   1HB   PHE  98          2HB       PHE  98   4.046   4.401   7.466
  742   2HB   PHE  98          1HB       PHE  98   2.845   5.459   6.741
  743    HD1  PHE  98           1HD      PHE  98   3.641   7.893   8.516
  744    HD2  PHE  98           2HD      PHE  98   5.835   5.165   6.095
  745    HE1  PHE  98           1HE      PHE  98   5.366   9.608   8.153
  746    HE2  PHE  98           2HE      PHE  98   7.556   6.869   5.730
  747    HZ   PHE  98           HZ       PHE  98   7.331   9.098   6.759
  748    H    GLY  99           H        GLY  99   0.578   4.448   9.541
  749   1HA   GLY  99          2HA       GLY  99  -1.407   5.969   9.727
  750   2HA   GLY  99          1HA       GLY  99  -0.924   6.594   8.161
  751    H    THR 100           H        THR 100  -1.639   5.597   6.343
  752    HA   THR 100           HA       THR 100  -3.262   3.170   6.747
  753    HB   THR 100           HB       THR 100  -4.412   4.742   4.662
  754    HG1  THR 100           1HG      THR 100  -3.378   6.504   5.868
  755   1HG2  THR 100          1HG2      THR 100  -6.212   3.814   5.589
  756   2HG2  THR 100          2HG2      THR 100  -5.977   4.761   7.059
  757   3HG2  THR 100          3HG2      THR 100  -5.196   3.190   6.889
  758    H    LEU 101           H        LEU 101  -2.580   1.560   5.491
  759    HA   LEU 101           HA       LEU 101  -1.512   2.263   2.842
  760   1HB   LEU 101          2HB       LEU 101   0.110   1.205   4.458
  761   2HB   LEU 101          1HB       LEU 101  -0.863  -0.251   4.363
  762    HG   LEU 101           HG       LEU 101  -0.198  -0.729   2.206
  763   1HD1  LEU 101          1HD1      LEU 101  -0.876   1.579   1.389
  764   2HD1  LEU 101          2HD1      LEU 101   0.464   0.801   0.547
  765   3HD1  LEU 101          3HD1      LEU 101   0.783   2.070   1.729
  766   1HD2  LEU 101          1HD2      LEU 101   2.295   0.684   2.482
  767   2HD2  LEU 101          2HD2      LEU 101   1.964  -1.047   2.572
  768   3HD2  LEU 101          3HD2      LEU 101   1.791  -0.039   4.010
  769    H    LYS 102           H        LYS 102  -3.145   2.072   1.575
  770    HA   LYS 102           HA       LYS 102  -5.210   0.168   1.707
  771   1HB   LYS 102          2HB       LYS 102  -4.389   2.253  -0.135
  772   2HB   LYS 102          1HB       LYS 102  -5.046   0.854  -0.978
  773   1HG   LYS 102          2HG       LYS 102  -6.476   2.061   1.357
  774   2HG   LYS 102          1HG       LYS 102  -6.651   2.723  -0.271
  775   1HD   LYS 102          2HD       LYS 102  -7.609   0.742  -1.091
  776   2HD   LYS 102          1HD       LYS 102  -7.070  -0.195   0.304
  777   1HE   LYS 102          2HE       LYS 102  -9.279   0.089   0.832
  778   2HE   LYS 102          1HE       LYS 102  -8.580   1.503   1.621
  779   1HZ   LYS 102          1HZ       LYS 102 -10.595   1.478  -0.255
  780   2HZ   LYS 102          2HZ       LYS 102  -9.243   2.081  -1.083
  781   3HZ   LYS 102          3HZ       LYS 102  -9.774   2.836   0.341
  782    H    LYS 103           H        LYS 103  -2.634   0.261  -0.802
  783    HA   LYS 103           HA       LYS 103  -2.655  -2.685  -0.733
  784   1HB   LYS 103          2HB       LYS 103  -1.906  -2.000  -3.320
  785   2HB   LYS 103          1HB       LYS 103  -3.457  -2.662  -2.824
  786   1HG   LYS 103          2HG       LYS 103  -3.798  -0.011  -2.300
  787   2HG   LYS 103          1HG       LYS 103  -2.752   0.032  -3.720
  788   1HD   LYS 103          2HD       LYS 103  -4.546  -0.335  -4.988
  789   2HD   LYS 103          1HD       LYS 103  -4.709  -1.924  -4.237
  790   1HE   LYS 103          2HE       LYS 103  -6.577  -1.287  -3.215
  791   2HE   LYS 103          1HE       LYS 103  -5.737   0.065  -2.460
  792   1HZ   LYS 103          1HZ       LYS 103  -6.381   0.498  -5.237
  793   2HZ   LYS 103          2HZ       LYS 103  -6.628   1.511  -3.894
  794   3HZ   LYS 103          3HZ       LYS 103  -7.746   0.284  -4.252
  795    H    ALA 104           H        ALA 104  -0.651  -3.666  -0.702
  796    HA   ALA 104           HA       ALA 104   1.664  -2.173  -1.640
  797   1HB   ALA 104          1HB       ALA 104   2.366  -1.505   0.355
  798   2HB   ALA 104          2HB       ALA 104   2.546  -3.201   0.815
  799   3HB   ALA 104          3HB       ALA 104   1.036  -2.354   1.152
  800    H    ALA 105           H        ALA 105   3.484  -3.455  -2.052
  801    HA   ALA 105           HA       ALA 105   3.597  -6.238  -1.392
  802   1HB   ALA 105          1HB       ALA 105   3.542  -5.873  -4.324
  803   2HB   ALA 105          2HB       ALA 105   1.987  -5.817  -3.493
  804   3HB   ALA 105          3HB       ALA 105   3.017  -7.241  -3.342
  805    H    VAL 106           H        VAL 106   5.662  -7.131  -1.895
  806    HA   VAL 106           HA       VAL 106   7.622  -5.055  -2.544
  807    HB   VAL 106           HB       VAL 106   9.317  -6.593  -1.598
  808   1HG1  VAL 106          1HG1      VAL 106   7.006  -5.980   0.240
  809   2HG1  VAL 106          2HG1      VAL 106   8.274  -4.849  -0.238
  810   3HG1  VAL 106          3HG1      VAL 106   8.676  -6.271   0.725
  811   1HG2  VAL 106          1HG2      VAL 106   8.798  -8.752  -1.499
  812   2HG2  VAL 106          2HG2      VAL 106   7.071  -8.426  -1.643
  813   3HG2  VAL 106          3HG2      VAL 106   7.852  -8.356  -0.064
  814    H    ASP 107           H        ASP 107   9.685  -5.919  -3.481
  815    HA   ASP 107           HA       ASP 107   9.268  -7.672  -5.767
  816   1HB   ASP 107          2HB       ASP 107   8.740  -5.055  -6.150
  817   2HB   ASP 107          1HB       ASP 107  10.487  -5.026  -6.375
  818    H    TYR 108           H        TYR 108  11.468  -7.825  -6.984
  819    HA   TYR 108           HA       TYR 108  13.756  -7.425  -5.259
  820   1HB   TYR 108          2HB       TYR 108  12.399 -10.032  -5.441
  821   2HB   TYR 108          1HB       TYR 108  14.138 -10.087  -5.712
  822    HD1  TYR 108           1HD      TYR 108  11.499  -9.731  -3.280
  823    HD2  TYR 108           2HD      TYR 108  15.697  -9.241  -3.889
  824    HE1  TYR 108           1HE      TYR 108  11.848  -9.711  -0.847
  825    HE2  TYR 108           2HE      TYR 108  16.041  -9.226  -1.457
  826    HH   TYR 108           HH       TYR 108  13.332  -9.676   0.802
  827    H    ASP 109           H        ASP 109  15.676  -8.846  -6.356
  828    HA   ASP 109           HA       ASP 109  15.773  -7.742  -9.054
  829   1HB   ASP 109          2HB       ASP 109  17.634  -7.638  -7.152
  830   2HB   ASP 109          1HB       ASP 109  18.083  -9.194  -7.843
  831    H    ARG 110           H        ARG 110  16.646  -9.083 -10.811
  832    HA   ARG 110           HA       ARG 110  15.205 -11.368 -11.290
  833   1HB   ARG 110          2HB       ARG 110  17.921 -10.760 -12.459
  834   2HB   ARG 110          1HB       ARG 110  16.660 -11.752 -13.179
  835   1HG   ARG 110          2HG       ARG 110  16.077  -9.920 -14.292
  836   2HG   ARG 110          1HG       ARG 110  15.390  -9.354 -12.770
  837   1HD   ARG 110          2HD       ARG 110  17.623  -8.353 -12.236
  838   2HD   ARG 110          1HD       ARG 110  18.132  -8.767 -13.873
  839    HE   ARG 110           HE       ARG 110  16.196  -7.324 -14.601
  840   1HH1  ARG 110          1HH1      ARG 110  17.846  -6.804 -11.543
  841   2HH1  ARG 110          2HH1      ARG 110  17.503  -5.096 -11.507
  842   1HH2  ARG 110          1HH2      ARG 110  15.737  -5.079 -14.545
  843   2HH2  ARG 110          2HH2      ARG 110  16.292  -4.123 -13.193
  844    H    SER 111           H        SER 111  18.576 -11.190 -10.144
  845    HA   SER 111           HA       SER 111  18.627 -14.085  -9.822
  846   1HB   SER 111          2HB       SER 111  21.014 -12.943  -8.856
  847   2HB   SER 111          1HB       SER 111  20.763 -13.740 -10.410
  848    HG   SER 111           HG       SER 111  21.461 -11.739 -10.932
  849    H    GLY 112           H        GLY 112  17.389 -11.686  -8.078
  850   1HA   GLY 112          2HA       GLY 112  16.844 -11.440  -5.856
  851   2HA   GLY 112          1HA       GLY 112  17.531 -13.035  -5.577
  852    H    ARG 113           H        ARG 113  18.667  -9.781  -6.459
  853    HA   ARG 113           HA       ARG 113  21.254 -10.159  -5.356
  854   1HB   ARG 113          2HB       ARG 113  19.846  -8.121  -6.813
  855   2HB   ARG 113          1HB       ARG 113  20.690  -7.390  -5.456
  856   1HG   ARG 113          2HG       ARG 113  22.740  -8.669  -6.264
  857   2HG   ARG 113          1HG       ARG 113  21.831  -8.933  -7.754
  858   1HD   ARG 113          2HD       ARG 113  23.149  -6.994  -8.099
  859   2HD   ARG 113          1HD       ARG 113  21.493  -6.442  -7.859
  860    HE   ARG 113           HE       ARG 113  22.118  -5.451  -5.865
  861   1HH1  ARG 113          1HH1      ARG 113  24.746  -7.395  -7.124
  862   2HH1  ARG 113          2HH1      ARG 113  25.933  -6.733  -6.039
  863   1HH2  ARG 113          1HH2      ARG 113  23.679  -4.582  -4.430
  864   2HH2  ARG 113          2HH2      ARG 113  25.322  -5.142  -4.503
  865    H    SER 114           H        SER 114  19.160  -7.504  -4.346
  866    HA   SER 114           HA       SER 114  19.006  -8.344  -1.629
  867   1HB   SER 114          2HB       SER 114  20.253  -5.748  -1.494
  868   2HB   SER 114          1HB       SER 114  20.769  -7.252  -0.736
  869    HG   SER 114           HG       SER 114  22.020  -7.723  -2.487
  870    H    LEU 115           H        LEU 115  19.251  -4.925  -2.183
  871    HA   LEU 115           HA       LEU 115  17.774  -3.275  -2.210
  872   1HB   LEU 115          2HB       LEU 115  15.820  -3.745  -3.964
  873   2HB   LEU 115          1HB       LEU 115  17.440  -3.269  -4.419
  874    HG   LEU 115           HG       LEU 115  17.171  -6.165  -4.256
  875   1HD1  LEU 115          1HD1      LEU 115  15.321  -4.623  -6.056
  876   2HD1  LEU 115          2HD1      LEU 115  14.902  -5.863  -4.872
  877   3HD1  LEU 115          3HD1      LEU 115  15.783  -6.303  -6.335
  878   1HD2  LEU 115          1HD2      LEU 115  18.102  -5.974  -6.543
  879   2HD2  LEU 115          2HD2      LEU 115  19.036  -5.086  -5.340
  880   3HD2  LEU 115          3HD2      LEU 115  17.950  -4.221  -6.427
  881    H    GLY 116           H        GLY 116  15.237  -5.627  -2.901
  882   1HA   GLY 116          2HA       GLY 116  13.409  -6.188  -1.559
  883   2HA   GLY 116          1HA       GLY 116  14.053  -5.146  -0.292
  884    H    THR 117           H        THR 117  12.985  -4.809  -3.653
  885    HA   THR 117           HA       THR 117  12.074  -2.136  -3.296
  886    HB   THR 117           HB       THR 117  10.855  -3.516  -5.537
  887    HG1  THR 117           1HG      THR 117  12.696  -4.282  -6.528
  888   1HG2  THR 117          1HG2      THR 117  12.724  -1.219  -5.109
  889   2HG2  THR 117          2HG2      THR 117  11.101  -1.229  -5.801
  890   3HG2  THR 117          3HG2      THR 117  12.464  -1.848  -6.736
  891    H    ALA 118           H        ALA 118   9.822  -1.454  -3.442
  892    HA   ALA 118           HA       ALA 118   7.785  -3.503  -3.394
  893   1HB   ALA 118          1HB       ALA 118   8.643  -3.030  -0.976
  894   2HB   ALA 118          2HB       ALA 118   6.914  -3.179  -1.299
  895   3HB   ALA 118          3HB       ALA 118   7.647  -1.582  -1.120
  896    H    ASP 119           H        ASP 119   5.862  -2.830  -4.068
  897    HA   ASP 119           HA       ASP 119   5.533   0.023  -4.713
  898   1HB   ASP 119          2HB       ASP 119   5.442  -1.204  -6.756
  899   2HB   ASP 119          1HB       ASP 119   4.468  -2.478  -6.033
  900    H    VAL 120           H        VAL 120   4.393   0.905  -3.070
  901    HA   VAL 120           HA       VAL 120   1.978  -0.557  -2.254
  902    HB   VAL 120           HB       VAL 120   2.053   0.373  -0.128
  903   1HG1  VAL 120          1HG1      VAL 120   4.910   0.029  -1.017
  904   2HG1  VAL 120          2HG1      VAL 120   3.867  -1.160  -0.238
  905   3HG1  VAL 120          3HG1      VAL 120   4.437   0.242   0.668
  906   1HG2  VAL 120          1HG2      VAL 120   3.547   2.319   0.437
  907   2HG2  VAL 120          2HG2      VAL 120   2.182   2.679  -0.624
  908   3HG2  VAL 120          3HG2      VAL 120   3.805   2.499  -1.299
  909    H    HIS 121           H        HIS 121   0.015   0.619  -2.170
  910    HA   HIS 121           HA       HIS 121   0.077   3.065  -3.800
  911   1HB   HIS 121          2HB       HIS 121  -1.164   0.455  -4.348
  912   2HB   HIS 121          1HB       HIS 121  -2.251   1.824  -4.550
  913    HD1  HIS 121           1HD      HIS 121   0.768   0.205  -6.061
  914    HD2  HIS 121           2HD      HIS 121  -1.594   3.584  -6.650
  915    HE1  HIS 121           1HE      HIS 121   1.359   1.059  -8.348
  916    HE2  HIS 121           2HE      HIS 121  -0.034   3.139  -8.669
  917    H    PHE 122           H        PHE 122  -0.825   4.657  -2.700
  918    HA   PHE 122           HA       PHE 122  -3.074   4.045  -0.913
  919   1HB   PHE 122          2HB       PHE 122  -2.067   6.817  -0.965
  920   2HB   PHE 122          1HB       PHE 122  -2.485   5.796   0.403
  921    HD1  PHE 122           1HD      PHE 122   0.179   6.908  -1.814
  922    HD2  PHE 122           2HD      PHE 122  -0.825   4.353   1.434
  923    HE1  PHE 122           1HE      PHE 122   2.568   6.580  -1.338
  924    HE2  PHE 122           2HE      PHE 122   1.560   4.025   1.921
  925    HZ   PHE 122           HZ       PHE 122   3.256   5.221   0.607
  926    H    GLU 123           H        GLU 123  -4.977   5.416  -1.067
  927    HA   GLU 123           HA       GLU 123  -5.675   5.866  -3.823
  928   1HB   GLU 123          2HB       GLU 123  -7.503   6.713  -1.640
  929   2HB   GLU 123          1HB       GLU 123  -7.856   5.860  -3.136
  930   1HG   GLU 123          2HG       GLU 123  -6.254   4.426  -1.106
  931   2HG   GLU 123          1HG       GLU 123  -7.961   4.697  -0.755
  932    H    ARG 124           H        ARG 124  -4.450   7.776  -1.287
  933    HA   ARG 124           HA       ARG 124  -5.521  10.252  -2.443
  934   1HB   ARG 124          2HB       ARG 124  -3.961  10.287   0.083
  935   2HB   ARG 124          1HB       ARG 124  -5.379  11.222  -0.374
  936   1HG   ARG 124          2HG       ARG 124  -6.707   9.082  -0.116
  937   2HG   ARG 124          1HG       ARG 124  -5.266   8.397   0.641
  938   1HD   ARG 124          2HD       ARG 124  -6.371  11.002   1.607
  939   2HD   ARG 124          1HD       ARG 124  -7.121   9.488   2.111
  940    HE   ARG 124           HE       ARG 124  -5.035   8.858   3.137
  941   1HH1  ARG 124          1HH1      ARG 124  -5.255  12.196   2.078
  942   2HH1  ARG 124          2HH1      ARG 124  -4.027  12.764   3.180
  943   1HH2  ARG 124          1HH2      ARG 124  -3.401   9.585   4.549
  944   2HH2  ARG 124          2HH2      ARG 124  -2.973  11.267   4.597
  945    H    ARG 125           H        ARG 125  -4.198  11.703  -3.437
  946    HA   ARG 125           HA       ARG 125  -1.528  10.913  -4.042
  947   1HB   ARG 125          2HB       ARG 125  -1.621  13.475  -4.901
  948   2HB   ARG 125          1HB       ARG 125  -2.251  12.112  -5.814
  949   1HG   ARG 125          2HG       ARG 125  -4.399  12.732  -5.521
  950   2HG   ARG 125          1HG       ARG 125  -4.111  13.361  -3.897
  951   1HD   ARG 125          2HD       ARG 125  -4.442  15.335  -4.963
  952   2HD   ARG 125          1HD       ARG 125  -2.717  15.158  -5.279
  953    HE   ARG 125           HE       ARG 125  -4.862  14.521  -7.200
  954   1HH1  ARG 125          1HH1      ARG 125  -1.559  15.431  -6.478
  955   2HH1  ARG 125          2HH1      ARG 125  -1.130  15.683  -8.149
  956   1HH2  ARG 125          1HH2      ARG 125  -4.307  14.848  -9.391
  957   2HH2  ARG 125          2HH2      ARG 125  -2.701  15.383  -9.801
  958    H    ALA 126           H        ALA 126  -2.957  13.266  -1.822
  959    HA   ALA 126           HA       ALA 126  -0.602  14.620  -1.109
  960   1HB   ALA 126          1HB       ALA 126  -1.825  15.071   1.066
  961   2HB   ALA 126          2HB       ALA 126  -3.142  14.098   0.412
  962   3HB   ALA 126          3HB       ALA 126  -2.643  15.575  -0.414
  963    H    ASP 127           H        ASP 127  -1.967  11.604  -0.021
  964    HA   ASP 127           HA       ASP 127  -0.325  10.991   2.141
  965   1HB   ASP 127          2HB       ASP 127  -2.279   9.654   0.791
  966   2HB   ASP 127          1HB       ASP 127  -0.856   8.747   0.289
  967    H    ALA 128           H        ALA 128   0.273  10.716  -1.316
  968    HA   ALA 128           HA       ALA 128   2.822   9.391  -0.922
  969   1HB   ALA 128          1HB       ALA 128   2.942   9.827  -3.481
  970   2HB   ALA 128          2HB       ALA 128   1.227  10.216  -3.315
  971   3HB   ALA 128          3HB       ALA 128   1.820   8.618  -2.857
  972    H    LEU 129           H        LEU 129   1.542  12.556  -1.682
  973    HA   LEU 129           HA       LEU 129   3.925  13.834  -2.414
  974   1HB   LEU 129          2HB       LEU 129   1.640  14.766  -2.691
  975   2HB   LEU 129          1HB       LEU 129   1.563  15.020  -0.957
  976    HG   LEU 129           HG       LEU 129   3.928  16.257  -2.056
  977   1HD1  LEU 129          1HD1      LEU 129   2.148  18.060  -3.074
  978   2HD1  LEU 129          2HD1      LEU 129   1.459  16.521  -3.593
  979   3HD1  LEU 129          3HD1      LEU 129   3.119  16.936  -4.025
  980   1HD2  LEU 129          1HD2      LEU 129   2.974  18.224  -0.930
  981   2HD2  LEU 129          2HD2      LEU 129   2.983  16.798   0.109
  982   3HD2  LEU 129          3HD2      LEU 129   1.481  17.325  -0.653
  983    H    LYS 130           H        LYS 130   2.332  13.592   0.761
  984    HA   LYS 130           HA       LYS 130   4.364  14.946   2.187
  985   1HB   LYS 130          2HB       LYS 130   2.498  14.867   3.486
  986   2HB   LYS 130          1HB       LYS 130   1.990  13.314   2.844
  987   1HG   LYS 130          2HG       LYS 130   4.314  12.834   4.357
  988   2HG   LYS 130          1HG       LYS 130   3.289  13.909   5.314
  989   1HD   LYS 130          2HD       LYS 130   1.491  12.089   4.316
  990   2HD   LYS 130          1HD       LYS 130   2.921  11.096   4.609
  991   1HE   LYS 130          2HE       LYS 130   2.472  11.080   6.783
  992   2HE   LYS 130          1HE       LYS 130   2.581  12.840   6.825
  993   1HZ   LYS 130          1HZ       LYS 130   0.452  12.117   7.640
  994   2HZ   LYS 130          2HZ       LYS 130   0.146  11.248   6.213
  995   3HZ   LYS 130          3HZ       LYS 130   0.238  12.942   6.173
  996    H    ALA 131           H        ALA 131   3.854  11.606   1.313
  997    HA   ALA 131           HA       ALA 131   5.966  10.536   2.913
  998   1HB   ALA 131          1HB       ALA 131   4.057   9.202   2.011
  999   2HB   ALA 131          2HB       ALA 131   5.645   8.486   1.737
 1000   3HB   ALA 131          3HB       ALA 131   4.811   9.311   0.418
 1001    H    MET 132           H        MET 132   5.798  11.865  -0.340
 1002    HA   MET 132           HA       MET 132   8.465  11.041  -1.007
 1003   1HB   MET 132          2HB       MET 132   7.913  11.650  -3.096
 1004   2HB   MET 132          1HB       MET 132   6.285  11.860  -2.471
 1005   1HG   MET 132          2HG       MET 132   6.807  14.242  -2.048
 1006   2HG   MET 132          1HG       MET 132   8.380  13.994  -2.805
 1007   1HE   MET 132          1HE       MET 132   8.155  13.740  -6.210
 1008   2HE   MET 132          2HE       MET 132   7.225  12.265  -5.948
 1009   3HE   MET 132          3HE       MET 132   8.556  12.670  -4.866
 1010    H    LYS 133           H        LYS 133   6.959  13.742   0.528
 1011    HA   LYS 133           HA       LYS 133   9.243  15.467   0.323
 1012   1HB   LYS 133          2HB       LYS 133   6.541  15.623   1.388
 1013   2HB   LYS 133          1HB       LYS 133   7.716  16.370   2.462
 1014   1HG   LYS 133          2HG       LYS 133   6.851  18.036   0.981
 1015   2HG   LYS 133          1HG       LYS 133   8.533  17.721   0.555
 1016   1HD   LYS 133          2HD       LYS 133   7.739  16.201  -1.239
 1017   2HD   LYS 133          1HD       LYS 133   6.082  16.665  -0.851
 1018   1HE   LYS 133          2HE       LYS 133   6.289  18.390  -2.236
 1019   2HE   LYS 133          1HE       LYS 133   7.508  19.063  -1.155
 1020   1HZ   LYS 133          1HZ       LYS 133   9.070  17.453  -2.443
 1021   2HZ   LYS 133          2HZ       LYS 133   8.640  18.946  -3.129
 1022   3HZ   LYS 133          3HZ       LYS 133   7.865  17.527  -3.636
 1023    H    GLN 134           H        GLN 134   7.778  13.530   2.926
 1024    HA   GLN 134           HA       GLN 134  10.035  14.152   4.645
 1025   1HB   GLN 134          2HB       GLN 134   7.309  13.218   5.033
 1026   2HB   GLN 134          1HB       GLN 134   8.468  12.333   6.018
 1027   1HG   GLN 134          2HG       GLN 134   7.368  14.492   6.941
 1028   2HG   GLN 134          1HG       GLN 134   9.084  14.197   7.215
 1029   1HE2  GLN 134          1HE2      GLN 134   6.753  15.999   5.347
 1030   2HE2  GLN 134          2HE2      GLN 134   7.838  17.251   4.832
 1031    H    TYR 135           H        TYR 135   8.504  11.135   3.448
 1032    HA   TYR 135           HA       TYR 135  10.575   9.513   4.538
 1033   1HB   TYR 135          2HB       TYR 135   8.099   8.952   3.638
 1034   2HB   TYR 135          1HB       TYR 135   9.031   8.478   2.224
 1035    HD1  TYR 135           1HD      TYR 135  11.150   7.987   4.926
 1036    HD2  TYR 135           2HD      TYR 135   7.683   6.318   3.115
 1037    HE1  TYR 135           1HE      TYR 135  11.638   5.826   5.995
 1038    HE2  TYR 135           2HE      TYR 135   8.155   4.155   4.184
 1039    HH   TYR 135           HH       TYR 135   9.732   3.601   6.596
 1040    H    LYS 136           H        LYS 136   9.790  10.233   1.116
 1041    HA   LYS 136           HA       LYS 136  12.063   9.050   0.037
 1042   1HB   LYS 136          2HB       LYS 136  10.177   9.729  -1.351
 1043   2HB   LYS 136          1HB       LYS 136  10.513  11.422  -1.016
 1044   1HG   LYS 136          2HG       LYS 136  12.871  10.198  -2.045
 1045   2HG   LYS 136          1HG       LYS 136  11.512   9.820  -3.107
 1046   1HD   LYS 136          2HD       LYS 136  11.005  12.144  -3.393
 1047   2HD   LYS 136          1HD       LYS 136  12.177  12.605  -2.156
 1048   1HE   LYS 136          2HE       LYS 136  12.830  11.282  -4.790
 1049   2HE   LYS 136          1HE       LYS 136  13.026  12.996  -4.429
 1050   1HZ   LYS 136          1HZ       LYS 136  14.584  12.349  -2.640
 1051   2HZ   LYS 136          2HZ       LYS 136  15.124  11.902  -4.185
 1052   3HZ   LYS 136          3HZ       LYS 136  14.467  10.732  -3.151
 1053    H    GLY 137           H        GLY 137  14.116   9.465   0.456
 1054   1HA   GLY 137          2HA       GLY 137  15.748  11.359  -0.136
 1055   2HA   GLY 137          1HA       GLY 137  14.886  12.208   1.140
 1056    H    VAL 138           H        VAL 138  14.580   9.513   2.527
 1057    HA   VAL 138           HA       VAL 138  16.307   9.734   4.596
 1058    HB   VAL 138           HB       VAL 138  15.582   7.036   3.460
 1059   1HG1  VAL 138          1HG1      VAL 138  17.276   7.231   5.354
 1060   2HG1  VAL 138          2HG1      VAL 138  15.884   6.182   5.630
 1061   3HG1  VAL 138          3HG1      VAL 138  15.932   7.792   6.348
 1062   1HG2  VAL 138          1HG2      VAL 138  13.559   8.245   3.594
 1063   2HG2  VAL 138          2HG2      VAL 138  13.991   8.928   5.162
 1064   3HG2  VAL 138          3HG2      VAL 138  13.628   7.208   5.019
 1065    HA   PRO 139           HA       PRO 139  20.260   8.357   3.058
 1066   1HB   PRO 139          2HB       PRO 139  21.659  10.381   4.260
 1067   2HB   PRO 139          1HB       PRO 139  21.007  10.490   2.624
 1068   1HG   PRO 139          2HG       PRO 139  20.191  11.934   4.993
 1069   2HG   PRO 139          1HG       PRO 139  19.641  12.146   3.324
 1070   1HD   PRO 139          2HD       PRO 139  18.365  10.695   5.538
 1071   2HD   PRO 139          1HD       PRO 139  17.659  11.277   4.017
 1072    H    LEU 140           H        LEU 140  21.563   7.053   4.313
 1073    HA   LEU 140           HA       LEU 140  21.593   7.499   7.169
 1074   1HB   LEU 140          2HB       LEU 140  19.664   5.845   6.326
 1075   2HB   LEU 140          1HB       LEU 140  20.985   4.695   6.400
 1076    HG   LEU 140           HG       LEU 140  20.774   6.323   8.813
 1077   1HD1  LEU 140          1HD1      LEU 140  18.365   5.084   7.697
 1078   2HD1  LEU 140          2HD1      LEU 140  18.537   6.317   8.946
 1079   3HD1  LEU 140          3HD1      LEU 140  18.733   4.612   9.356
 1080   1HD2  LEU 140          1HD2      LEU 140  20.489   3.358   8.682
 1081   2HD2  LEU 140          2HD2      LEU 140  21.346   4.358   9.856
 1082   3HD2  LEU 140          3HD2      LEU 140  22.033   4.097   8.254
 1083    H    ASP 141           H        ASP 141  23.750   7.984   6.398
 1084    HA   ASP 141           HA       ASP 141  25.985   7.549   6.534
 1085   1HB   ASP 141          2HB       ASP 141  24.987   6.318   8.630
 1086   2HB   ASP 141          1HB       ASP 141  25.445   4.866   7.747
 1087    H    GLY 142           H        GLY 142  26.286   7.349   4.253
 1088   1HA   GLY 142          2HA       GLY 142  27.297   6.251   2.486
 1089   2HA   GLY 142          1HA       GLY 142  27.513   4.862   3.541
 1090    H    ARG 143           H        ARG 143  24.390   5.691   3.641
 1091    HA   ARG 143           HA       ARG 143  23.533   4.408   1.198
 1092   1HB   ARG 143          2HB       ARG 143  23.996   2.438   2.587
 1093   2HB   ARG 143          1HB       ARG 143  22.869   3.029   3.802
 1094   1HG   ARG 143          2HG       ARG 143  21.012   2.698   2.386
 1095   2HG   ARG 143          1HG       ARG 143  22.039   2.470   0.970
 1096   1HD   ARG 143          2HD       ARG 143  22.631   0.599   3.120
 1097   2HD   ARG 143          1HD       ARG 143  20.971   0.476   2.541
 1098    HE   ARG 143           HE       ARG 143  21.912   0.138   0.295
 1099   1HH1  ARG 143          1HH1      ARG 143  23.938  -0.477   3.086
 1100   2HH1  ARG 143          2HH1      ARG 143  25.058  -1.481   2.207
 1101   1HH2  ARG 143          1HH2      ARG 143  23.328  -1.213  -0.842
 1102   2HH2  ARG 143          2HH2      ARG 143  24.693  -1.926  -0.028
 1103    HA   PRO 144           HA       PRO 144  19.866   6.765   2.323
 1104   1HB   PRO 144          2HB       PRO 144  19.510   7.966  -0.034
 1105   2HB   PRO 144          1HB       PRO 144  20.620   8.631   1.171
 1106   1HG   PRO 144          2HG       PRO 144  21.232   7.100  -1.312
 1107   2HG   PRO 144          1HG       PRO 144  22.127   8.433  -0.564
 1108   1HD   PRO 144          2HD       PRO 144  22.736   5.709  -0.329
 1109   2HD   PRO 144          1HD       PRO 144  23.361   7.006   0.707
 1110    H    MET 145           H        MET 145  18.044   5.490   2.147
 1111    HA   MET 145           HA       MET 145  17.965   3.366   0.276
 1112   1HB   MET 145          2HB       MET 145  16.143   2.623   1.386
 1113   2HB   MET 145          1HB       MET 145  16.710   3.754   2.605
 1114   1HG   MET 145          2HG       MET 145  14.853   4.958   2.461
 1115   2HG   MET 145          1HG       MET 145  14.952   5.038   0.703
 1116   1HE   MET 145          1HE       MET 145  13.175   2.656   3.701
 1117   2HE   MET 145          2HE       MET 145  11.749   3.357   2.934
 1118   3HE   MET 145          3HE       MET 145  13.082   4.397   3.437
 1119    H    ASP 146           H        ASP 146  16.043   3.037  -1.154
 1120    HA   ASP 146           HA       ASP 146  15.894   5.409  -2.900
 1121   1HB   ASP 146          2HB       ASP 146  16.823   3.135  -3.710
 1122   2HB   ASP 146          1HB       ASP 146  15.128   2.635  -3.766
 1123    H    ILE 147           H        ILE 147  14.106   6.531  -2.840
 1124    HA   ILE 147           HA       ILE 147  11.547   5.117  -2.545
 1125    HB   ILE 147           HB       ILE 147  11.349   7.741  -1.414
 1126   1HG1  ILE 147          2HG1      ILE 147  13.723   6.142  -0.580
 1127   2HG1  ILE 147          1HG1      ILE 147  13.511   7.886  -0.633
 1128   1HG2  ILE 147          1HG2      ILE 147  11.210   5.358   0.318
 1129   2HG2  ILE 147          2HG2      ILE 147  10.148   5.372  -1.091
 1130   3HG2  ILE 147          3HG2      ILE 147  10.055   6.674   0.096
 1131   1HD1  ILE 147          1HD1      ILE 147  12.082   7.710   1.387
 1132   2HD1  ILE 147          2HD1      ILE 147  13.753   7.203   1.638
 1133   3HD1  ILE 147          3HD1      ILE 147  12.482   5.994   1.464
 1134    H    GLN 148           H        GLN 148  10.141   5.620  -4.125
 1135    HA   GLN 148           HA       GLN 148  10.165   8.358  -5.171
 1136   1HB   GLN 148          2HB       GLN 148  11.082   6.159  -6.642
 1137   2HB   GLN 148          1HB       GLN 148   9.449   6.444  -7.230
 1138   1HG   GLN 148          2HG       GLN 148  11.585   8.555  -7.057
 1139   2HG   GLN 148          1HG       GLN 148  11.209   7.626  -8.508
 1140   1HE2  GLN 148          1HE2      GLN 148   9.316   8.039  -9.619
 1141   2HE2  GLN 148          2HE2      GLN 148   8.354   9.445  -9.330
 1142    H    LEU 149           H        LEU 149   8.159   9.210  -5.256
 1143    HA   LEU 149           HA       LEU 149   5.911   7.338  -4.995
 1144   1HB   LEU 149          2HB       LEU 149   6.459   9.873  -3.488
 1145   2HB   LEU 149          1HB       LEU 149   4.833   9.227  -3.637
 1146    HG   LEU 149           HG       LEU 149   6.410   7.066  -2.816
 1147   1HD1  LEU 149          1HD1      LEU 149   7.626   7.765  -0.934
 1148   2HD1  LEU 149          2HD1      LEU 149   6.956   9.395  -1.005
 1149   3HD1  LEU 149          3HD1      LEU 149   8.101   8.856  -2.235
 1150   1HD2  LEU 149          1HD2      LEU 149   4.485   6.885  -1.737
 1151   2HD2  LEU 149          2HD2      LEU 149   4.143   8.607  -1.923
 1152   3HD2  LEU 149          3HD2      LEU 149   5.115   8.041  -0.565
 1153    H    VAL 150           H        VAL 150   4.439   7.514  -6.481
 1154    HA   VAL 150           HA       VAL 150   4.603   9.803  -8.310
 1155    HB   VAL 150           HB       VAL 150   3.201   7.176  -8.803
 1156   1HG1  VAL 150          1HG1      VAL 150   3.491   7.790 -11.162
 1157   2HG1  VAL 150          2HG1      VAL 150   4.235   9.310 -10.664
 1158   3HG1  VAL 150          3HG1      VAL 150   2.545   8.987 -10.276
 1159   1HG2  VAL 150          1HG2      VAL 150   5.124   6.124  -9.179
 1160   2HG2  VAL 150          2HG2      VAL 150   5.948   7.499  -8.440
 1161   3HG2  VAL 150          3HG2      VAL 150   5.715   7.445 -10.188
 1162    H    ALA 151           H        ALA 151   3.294  11.306  -7.581
 1163    HA   ALA 151           HA       ALA 151   0.516  11.159  -7.958
 1164   1HB   ALA 151          1HB       ALA 151   1.423  11.061  -5.080
 1165   2HB   ALA 151          2HB       ALA 151   0.383   9.906  -5.916
 1166   3HB   ALA 151          3HB       ALA 151  -0.197  11.540  -5.587
 1167    H    SER 152           H        SER 152   2.843  12.720  -8.562
 1168    HA   SER 152           HA       SER 152   2.015  15.346  -7.561
 1169   1HB   SER 152          2HB       SER 152   4.787  15.531  -7.693
 1170   2HB   SER 152          1HB       SER 152   3.826  15.416  -6.218
 1171    HG   SER 152           HG       SER 152   5.088  13.702  -5.996
 1172    H    GLN 153           H        GLN 153   3.551  13.343  -9.944
 1173    HA   GLN 153           HA       GLN 153   3.383  15.571 -11.866
 1174   1HB   GLN 153          2HB       GLN 153   5.580  13.817 -11.217
 1175   2HB   GLN 153          1HB       GLN 153   5.123  13.630 -12.905
 1176   1HG   GLN 153          2HG       GLN 153   5.339  16.389 -11.910
 1177   2HG   GLN 153          1HG       GLN 153   6.844  15.478 -12.027
 1178   1HE2  GLN 153          1HE2      GLN 153   6.392  13.941 -14.248
 1179   2HE2  GLN 153          2HE2      GLN 153   6.240  14.967 -15.633
 1180    H    ILE 154           H        ILE 154   1.448  13.487 -11.024
 1181    HA   ILE 154           HA       ILE 154   1.280  11.593 -13.187
 1182    HB   ILE 154           HB       ILE 154  -1.087  11.242 -12.072
 1183   1HG1  ILE 154          2HG1      ILE 154   0.320  12.150  -9.611
 1184   2HG1  ILE 154          1HG1      ILE 154  -0.429  13.384 -10.619
 1185   1HG2  ILE 154          1HG2      ILE 154   1.409  10.059 -11.851
 1186   2HG2  ILE 154          2HG2      ILE 154  -0.136   9.374 -11.341
 1187   3HG2  ILE 154          3HG2      ILE 154   0.863  10.253 -10.185
 1188   1HD1  ILE 154          1HD1      ILE 154  -2.011  12.786  -8.975
 1189   2HD1  ILE 154          2HD1      ILE 154  -1.750  11.064  -9.248
 1190   3HD1  ILE 154          3HD1      ILE 154  -2.552  12.040 -10.478
 1191    H    ASP 155           H        ASP 155   0.800  14.716 -13.246
 1192    HA   ASP 155           HA       ASP 155  -1.793  15.135 -14.253
 1193   1HB   ASP 155          2HB       ASP 155   0.086  16.818 -13.509
 1194   2HB   ASP 155          1HB       ASP 155   0.530  16.761 -15.217
 1195    H    LEU 156           H        LEU 156   1.118  13.955 -15.696
 1196    HA   LEU 156           HA       LEU 156   0.161  14.340 -18.406
 1197   1HB   LEU 156          2HB       LEU 156   2.569  12.705 -17.769
 1198   2HB   LEU 156          1HB       LEU 156   2.298  13.823 -19.093
 1199    HG   LEU 156           HG       LEU 156   2.859  14.582 -16.223
 1200   1HD1  LEU 156          1HD1      LEU 156   4.547  14.854 -18.699
 1201   2HD1  LEU 156          2HD1      LEU 156   4.816  13.715 -17.380
 1202   3HD1  LEU 156          3HD1      LEU 156   4.956  15.449 -17.090
 1203   1HD2  LEU 156          1HD2      LEU 156   2.959  16.875 -17.050
 1204   2HD2  LEU 156          2HD2      LEU 156   1.359  16.171 -17.291
 1205   3HD2  LEU 156          3HD2      LEU 156   2.471  16.322 -18.653
 1206    H    GLU 157           H        GLU 157   0.808  11.727 -16.149
 1207    HA   GLU 157           HA       GLU 157   0.079   9.540 -17.685
 1208   1HB   GLU 157          2HB       GLU 157  -0.009  10.161 -14.768
 1209   2HB   GLU 157          1HB       GLU 157  -0.632   8.625 -15.371
 1210   1HG   GLU 157          2HG       GLU 157   1.445   7.878 -15.233
 1211   2HG   GLU 157          1HG       GLU 157   1.792   8.880 -16.635
 1212    H    HIS 158           H        HIS 158  -1.946  11.756 -15.795
 1213    HA   HIS 158           HA       HIS 158  -4.283  10.609 -17.169
 1214   1HB   HIS 158          2HB       HIS 158  -3.958  10.366 -14.527
 1215   2HB   HIS 158          1HB       HIS 158  -4.686  11.969 -14.557
 1216    HD1  HIS 158           1HD      HIS 158  -7.137  12.141 -15.478
 1217    HD2  HIS 158           2HD      HIS 158  -5.673   8.266 -15.088
 1218    HE1  HIS 158           1HE      HIS 158  -9.145  10.631 -15.646
 1219    HE2  HIS 158           2HE      HIS 158  -8.251   8.294 -15.309
  Start of MODEL    7
    1    H    MET   1           H        MET   1-134.218  -9.635  20.931
    2    HA   MET   1           HA       MET   1-131.367  -9.015  21.299
    3   1HB   MET   1          2HB       MET   1-132.909  -9.665  18.976
    4   2HB   MET   1          1HB       MET   1-132.317  -8.017  18.814
    5   1HG   MET   1          2HG       MET   1-130.308  -9.913  19.758
    6   2HG   MET   1          1HG       MET   1-130.938 -10.268  18.150
    7   1HE   MET   1          1HE       MET   1-127.811  -7.362  19.293
    8   2HE   MET   1          2HE       MET   1-128.548  -8.684  20.197
    9   3HE   MET   1          3HE       MET   1-129.276  -7.080  20.233
   10    H    ALA   2           H        ALA   2-134.419  -7.542  20.224
   11    HA   ALA   2           HA       ALA   2-135.271  -5.444  20.377
   12   1HB   ALA   2          1HB       ALA   2-133.768  -5.732  22.929
   13   2HB   ALA   2          2HB       ALA   2-135.496  -5.515  22.650
   14   3HB   ALA   2          3HB       ALA   2-134.399  -4.142  22.500
   15    H    ASP   3           H        ASP   3-132.910  -5.881  18.817
   16    HA   ASP   3           HA       ASP   3-131.841  -3.170  18.713
   17   1HB   ASP   3          2HB       ASP   3-130.182  -4.160  20.093
   18   2HB   ASP   3          1HB       ASP   3-130.191  -5.656  19.166
   19    H    LYS   4           H        LYS   4-130.822  -6.251  17.292
   20    HA   LYS   4           HA       LYS   4-130.612  -6.965  15.153
   21   1HB   LYS   4          2HB       LYS   4-133.275  -6.114  15.516
   22   2HB   LYS   4          1HB       LYS   4-132.793  -5.555  13.921
   23   1HG   LYS   4          2HG       LYS   4-133.772  -7.700  13.666
   24   2HG   LYS   4          1HG       LYS   4-132.035  -7.879  13.419
   25   1HD   LYS   4          2HD       LYS   4-131.739  -8.849  15.563
   26   2HD   LYS   4          1HD       LYS   4-133.368  -8.393  16.068
   27   1HE   LYS   4          2HE       LYS   4-134.292  -9.910  14.357
   28   2HE   LYS   4          1HE       LYS   4-132.654 -10.399  13.930
   29   1HZ   LYS   4          1HZ       LYS   4-133.842 -11.927  15.475
   30   2HZ   LYS   4          2HZ       LYS   4-133.792 -10.709  16.651
   31   3HZ   LYS   4          3HZ       LYS   4-132.347 -11.367  16.053
   32    H    MET   5           H        MET   5-129.183  -4.598  15.852
   33    HA   MET   5           HA       MET   5-128.896  -3.416  13.173
   34   1HB   MET   5          2HB       MET   5-130.073  -1.942  15.002
   35   2HB   MET   5          1HB       MET   5-128.435  -1.733  15.607
   36   1HG   MET   5          2HG       MET   5-128.311  -1.287  12.841
   37   2HG   MET   5          1HG       MET   5-129.742  -0.436  13.421
   38   1HE   MET   5          1HE       MET   5-125.390   0.675  14.022
   39   2HE   MET   5          2HE       MET   5-126.196   0.072  12.573
   40   3HE   MET   5          3HE       MET   5-125.917  -1.007  13.941
   41    H    ASP   6           H        ASP   6-127.520  -4.135  16.312
   42    HA   ASP   6           HA       ASP   6-124.823  -4.081  15.129
   43   1HB   ASP   6          2HB       ASP   6-125.887  -3.611  17.865
   44   2HB   ASP   6          1HB       ASP   6-124.351  -4.464  17.760
   45    H    MET   7           H        MET   7-127.097  -5.953  17.050
   46    HA   MET   7           HA       MET   7-127.448  -8.164  17.336
   47   1HB   MET   7          2HB       MET   7-127.106  -7.972  14.741
   48   2HB   MET   7          1HB       MET   7-125.638  -8.880  15.076
   49   1HG   MET   7          2HG       MET   7-126.871 -10.713  14.958
   50   2HG   MET   7          1HG       MET   7-127.593 -10.228  16.489
   51   1HE   MET   7          1HE       MET   7-129.160  -8.785  12.493
   52   2HE   MET   7          2HE       MET   7-128.641 -10.467  12.405
   53   3HE   MET   7          3HE       MET   7-127.504  -9.221  12.920
   54    H    SER   8           H        SER   8-124.190  -8.608  16.008
   55    HA   SER   8           HA       SER   8-123.429 -10.101  18.359
   56   1HB   SER   8          2HB       SER   8-121.211  -9.600  16.617
   57   2HB   SER   8          1HB       SER   8-122.079 -11.113  16.880
   58    HG   SER   8           HG       SER   8-122.106  -9.506  14.727
   59    H    LEU   9           H        LEU   9-123.933  -7.894  19.492
   60    HA   LEU   9           HA       LEU   9-122.343  -5.650  19.243
   61   1HB   LEU   9          2HB       LEU   9-122.971  -5.240  21.686
   62   2HB   LEU   9          1HB       LEU   9-124.266  -5.379  20.514
   63    HG   LEU   9           HG       LEU   9-123.812  -7.977  21.542
   64   1HD1  LEU   9          1HD1      LEU   9-123.966  -7.770  23.871
   65   2HD1  LEU   9          2HD1      LEU   9-124.294  -6.039  23.783
   66   3HD1  LEU   9          3HD1      LEU   9-122.685  -6.652  23.401
   67   1HD2  LEU   9          1HD2      LEU   9-125.988  -5.925  21.799
   68   2HD2  LEU   9          2HD2      LEU   9-126.117  -7.524  22.531
   69   3HD2  LEU   9          3HD2      LEU   9-125.946  -7.365  20.782
   70    H    ASP  10           H        ASP  10-121.781  -8.483  21.313
   71    HA   ASP  10           HA       ASP  10-119.524  -7.355  22.632
   72   1HB   ASP  10          2HB       ASP  10-121.054  -9.388  23.302
   73   2HB   ASP  10          1HB       ASP  10-119.880 -10.315  22.376
   74    H    ASP  11           H        ASP  11-119.950  -9.410  19.803
   75    HA   ASP  11           HA       ASP  11-117.206  -9.941  19.352
   76   1HB   ASP  11          2HB       ASP  11-119.372 -10.957  18.241
   77   2HB   ASP  11          1HB       ASP  11-119.121  -9.670  17.065
   78    H    ILE  12           H        ILE  12-119.369  -7.355  18.348
   79    HA   ILE  12           HA       ILE  12-117.539  -5.906  16.762
   80    HB   ILE  12           HB       ILE  12-119.834  -4.891  18.436
   81   1HG1  ILE  12          2HG1      ILE  12-119.907  -5.186  15.457
   82   2HG1  ILE  12          1HG1      ILE  12-120.115  -6.622  16.457
   83   1HG2  ILE  12          1HG2      ILE  12-119.146  -3.346  16.075
   84   2HG2  ILE  12          2HG2      ILE  12-117.819  -3.410  17.241
   85   3HG2  ILE  12          3HG2      ILE  12-119.407  -2.815  17.736
   86   1HD1  ILE  12          1HD1      ILE  12-121.757  -4.184  16.961
   87   2HD1  ILE  12          2HD1      ILE  12-122.104  -5.871  17.347
   88   3HD1  ILE  12          3HD1      ILE  12-122.187  -5.313  15.676
   89    H    ILE  13           H        ILE  13-118.456  -5.583  20.178
   90    HA   ILE  13           HA       ILE  13-116.746  -3.605  21.033
   91    HB   ILE  13           HB       ILE  13-117.525  -6.164  22.435
   92   1HG1  ILE  13          2HG1      ILE  13-118.447  -3.375  23.084
   93   2HG1  ILE  13          1HG1      ILE  13-119.220  -4.311  21.809
   94   1HG2  ILE  13          1HG2      ILE  13-115.366  -5.159  23.293
   95   2HG2  ILE  13          2HG2      ILE  13-116.659  -5.348  24.479
   96   3HG2  ILE  13          3HG2      ILE  13-116.320  -3.760  23.789
   97   1HD1  ILE  13          1HD1      ILE  13-120.229  -4.343  24.172
   98   2HD1  ILE  13          2HD1      ILE  13-118.908  -5.446  24.554
   99   3HD1  ILE  13          3HD1      ILE  13-120.072  -5.866  23.297
  100    H    LYS  14           H        LYS  14-116.043  -7.043  20.665
  101    HA   LYS  14           HA       LYS  14-113.418  -7.127  21.522
  102   1HB   LYS  14          2HB       LYS  14-114.883  -8.660  19.394
  103   2HB   LYS  14          1HB       LYS  14-113.208  -9.013  19.795
  104   1HG   LYS  14          2HG       LYS  14-115.679  -9.526  21.335
  105   2HG   LYS  14          1HG       LYS  14-114.228 -10.513  21.155
  106   1HD   LYS  14          2HD       LYS  14-113.023  -8.952  22.639
  107   2HD   LYS  14          1HD       LYS  14-114.514  -8.033  22.852
  108   1HE   LYS  14          2HE       LYS  14-113.851 -10.797  23.796
  109   2HE   LYS  14          1HE       LYS  14-114.416  -9.414  24.731
  110   1HZ   LYS  14          1HZ       LYS  14-116.191 -10.981  24.481
  111   2HZ   LYS  14          2HZ       LYS  14-116.004 -11.020  22.798
  112   3HZ   LYS  14          3HZ       LYS  14-116.566  -9.608  23.558
  113    H    LEU  15           H        LEU  15-114.485  -6.746  18.122
  114    HA   LEU  15           HA       LEU  15-111.840  -6.265  17.208
  115   1HB   LEU  15          2HB       LEU  15-112.881  -5.622  15.077
  116   2HB   LEU  15          1HB       LEU  15-113.464  -7.158  15.680
  117    HG   LEU  15           HG       LEU  15-115.356  -5.445  16.658
  118   1HD1  LEU  15          1HD1      LEU  15-115.992  -3.959  14.832
  119   2HD1  LEU  15          2HD1      LEU  15-114.546  -4.429  13.936
  120   3HD1  LEU  15          3HD1      LEU  15-114.394  -3.547  15.455
  121   1HD2  LEU  15          1HD2      LEU  15-115.386  -6.781  13.956
  122   2HD2  LEU  15          2HD2      LEU  15-116.788  -6.337  14.930
  123   3HD2  LEU  15          3HD2      LEU  15-115.685  -7.596  15.492
  124    H    ASN  16           H        ASN  16-114.385  -4.223  18.389
  125    HA   ASN  16           HA       ASN  16-113.366  -1.770  17.398
  126   1HB   ASN  16          2HB       ASN  16-115.511  -2.611  19.189
  127   2HB   ASN  16          1HB       ASN  16-114.769  -1.087  19.668
  128   1HD2  ASN  16          1HD2      ASN  16-116.281  -2.793  17.008
  129   2HD2  ASN  16          2HD2      ASN  16-116.880  -1.378  16.197
  130    H    ARG  17           H        ARG  17-113.062  -3.443  20.516
  131    HA   ARG  17           HA       ARG  17-111.387  -1.428  21.654
  132   1HB   ARG  17          2HB       ARG  17-111.308  -2.745  23.568
  133   2HB   ARG  17          1HB       ARG  17-112.853  -3.193  22.863
  134   1HG   ARG  17          2HG       ARG  17-111.467  -5.107  21.754
  135   2HG   ARG  17          1HG       ARG  17-110.331  -4.768  23.060
  136   1HD   ARG  17          2HD       ARG  17-113.257  -5.255  23.547
  137   2HD   ARG  17          1HD       ARG  17-112.081  -6.567  23.487
  138    HE   ARG  17           HE       ARG  17-112.258  -4.454  25.520
  139   1HH1  ARG  17          1HH1      ARG  17-110.718  -7.380  24.334
  140   2HH1  ARG  17          2HH1      ARG  17-109.941  -7.729  25.854
  141   1HH2  ARG  17          1HH2      ARG  17-111.239  -4.919  27.516
  142   2HH2  ARG  17          2HH2      ARG  17-110.231  -6.336  27.655
  143    H    ASN  18           H        ASN  18-110.865  -4.314  19.777
  144    HA   ASN  18           HA       ASN  18-108.030  -4.418  20.196
  145   1HB   ASN  18          2HB       ASN  18-109.417  -6.384  19.500
  146   2HB   ASN  18          1HB       ASN  18-109.652  -5.615  17.935
  147   1HD2  ASN  18          1HD2      ASN  18-108.575  -6.887  16.588
  148   2HD2  ASN  18          2HD2      ASN  18-106.900  -7.307  16.737
  149    H    GLN  19           H        GLN  19-110.153  -2.588  18.249
  150    HA   GLN  19           HA       GLN  19-108.351  -1.934  16.144
  151   1HB   GLN  19          2HB       GLN  19-111.071  -1.286  16.908
  152   2HB   GLN  19          1HB       GLN  19-110.210   0.145  16.356
  153   1HG   GLN  19          2HG       GLN  19-110.683  -2.414  14.854
  154   2HG   GLN  19          1HG       GLN  19-111.301  -0.805  14.481
  155   1HE2  GLN  19          1HE2      GLN  19-109.472  -2.866  13.126
  156   2HE2  GLN  19          2HE2      GLN  19-108.135  -1.908  12.575
  157    H    ARG  20           H        ARG  20-106.469  -1.038  16.729
  158    HA   ARG  20           HA       ARG  20-106.345   1.073  18.697
  159   1HB   ARG  20          2HB       ARG  20-104.211  -0.131  16.923
  160   2HB   ARG  20          1HB       ARG  20-103.917   1.034  18.207
  161   1HG   ARG  20          2HG       ARG  20-104.944  -1.782  18.496
  162   2HG   ARG  20          1HG       ARG  20-103.391  -1.139  19.039
  163   1HD   ARG  20          2HD       ARG  20-104.274  -0.402  20.946
  164   2HD   ARG  20          1HD       ARG  20-105.585   0.405  20.086
  165    HE   ARG  20           HE       ARG  20-106.959  -1.371  20.536
  166   1HH1  ARG  20          1HH1      ARG  20-103.658  -2.288  21.311
  167   2HH1  ARG  20          2HH1      ARG  20-104.134  -3.732  22.147
  168   1HH2  ARG  20          1HH2      ARG  20-107.572  -3.244  21.662
  169   2HH2  ARG  20          2HH2      ARG  20-106.357  -4.283  22.352
  170    H    ARG  21           H        ARG  21-107.320   0.946  15.614
  171    HA   ARG  21           HA       ARG  21-107.867   2.518  14.086
  172   1HB   ARG  21          2HB       ARG  21-106.834   4.376  16.219
  173   2HB   ARG  21          1HB       ARG  21-107.466   4.957  14.684
  174   1HG   ARG  21          2HG       ARG  21-109.593   4.593  15.280
  175   2HG   ARG  21          1HG       ARG  21-109.214   3.066  16.078
  176   1HD   ARG  21          2HD       ARG  21-108.070   5.272  17.524
  177   2HD   ARG  21          1HD       ARG  21-109.797   5.526  17.280
  178    HE   ARG  21           HE       ARG  21-110.019   3.186  18.245
  179   1HH1  ARG  21          1HH1      ARG  21-107.375   5.326  19.087
  180   2HH1  ARG  21          2HH1      ARG  21-107.207   4.682  20.693
  181   1HH2  ARG  21          1HH2      ARG  21-109.794   2.326  20.322
  182   2HH2  ARG  21          2HH2      ARG  21-108.585   2.971  21.404
  183    H    VAL  22           H        VAL  22-105.055   1.355  14.479
  184    HA   VAL  22           HA       VAL  22-103.790   3.084  12.465
  185    HB   VAL  22           HB       VAL  22-102.461   3.398  14.403
  186   1HG1  VAL  22          1HG1      VAL  22-101.605   1.638  15.807
  187   2HG1  VAL  22          2HG1      VAL  22-102.339   0.412  14.772
  188   3HG1  VAL  22          3HG1      VAL  22-103.361   1.509  15.701
  189   1HG2  VAL  22          1HG2      VAL  22-101.087   3.096  12.484
  190   2HG2  VAL  22          2HG2      VAL  22-101.199   1.341  12.604
  191   3HG2  VAL  22          3HG2      VAL  22-100.310   2.251  13.823
  192    H    ASN  23           H        ASN  23-103.879   2.073  10.604
  193    HA   ASN  23           HA       ASN  23-104.173  -0.808  10.501
  194   1HB   ASN  23          2HB       ASN  23-104.654  -0.447   8.107
  195   2HB   ASN  23          1HB       ASN  23-105.673   0.543   9.143
  196   1HD2  ASN  23          1HD2      ASN  23-104.789   0.808   6.316
  197   2HD2  ASN  23          2HD2      ASN  23-104.115   2.403   6.208
  198    H    ARG  24           H        ARG  24-101.681  -0.184  11.399
  199    HA   ARG  24           HA       ARG  24 -99.686   0.007   9.423
  200   1HB   ARG  24          2HB       ARG  24 -99.239   0.407  11.805
  201   2HB   ARG  24          1HB       ARG  24 -99.555  -1.286  12.157
  202   1HG   ARG  24          2HG       ARG  24 -97.351  -1.552  11.977
  203   2HG   ARG  24          1HG       ARG  24 -97.612  -1.443  10.236
  204   1HD   ARG  24          2HD       ARG  24 -97.045   0.849  10.196
  205   2HD   ARG  24          1HD       ARG  24 -97.146   0.981  11.950
  206    HE   ARG  24           HE       ARG  24 -95.162  -0.684  11.835
  207   1HH1  ARG  24          1HH1      ARG  24 -95.781   1.946   9.609
  208   2HH1  ARG  24          2HH1      ARG  24 -94.100   2.218   9.259
  209   1HH2  ARG  24          1HH2      ARG  24 -92.956  -0.359  11.364
  210   2HH2  ARG  24          2HH2      ARG  24 -92.487   0.883  10.232
  211    H    GLY  25           H        GLY  25-101.183  -2.779  11.015
  212   1HA   GLY  25          2HA       GLY  25-101.663  -4.836  10.010
  213   2HA   GLY  25          1HA       GLY  25-100.623  -4.398   8.661
  214    H    GLY  26           H        GLY  26 -98.383  -4.692   8.835
  215   1HA   GLY  26          2HA       GLY  26 -97.657  -6.887  10.577
  216   2HA   GLY  26          1HA       GLY  26 -96.659  -6.176   9.315
  217    H    GLY  27           H        GLY  27 -97.660  -5.972  12.651
  218   1HA   GLY  27          2HA       GLY  27 -96.257  -3.727  13.507
  219   2HA   GLY  27          1HA       GLY  27 -96.553  -5.154  14.491
  220    HA   PRO  28           HA       PRO  28 -92.247  -6.378  14.068
  221   1HB   PRO  28          2HB       PRO  28 -92.991  -9.008  12.963
  222   2HB   PRO  28          1HB       PRO  28 -92.139  -8.625  14.462
  223   1HG   PRO  28          2HG       PRO  28 -94.660  -9.545  14.470
  224   2HG   PRO  28          1HG       PRO  28 -94.094  -8.359  15.660
  225   1HD   PRO  28          2HD       PRO  28 -95.740  -7.933  13.192
  226   2HD   PRO  28          1HD       PRO  28 -95.913  -7.202  14.803
  227    H    ARG  29           H        ARG  29 -91.589  -5.069  12.402
  228    HA   ARG  29           HA       ARG  29 -92.361  -5.408   9.703
  229   1HB   ARG  29          2HB       ARG  29 -91.563  -3.272  10.739
  230   2HB   ARG  29          1HB       ARG  29 -89.938  -3.942  10.758
  231   1HG   ARG  29          2HG       ARG  29 -90.076  -2.533   8.869
  232   2HG   ARG  29          1HG       ARG  29 -90.118  -4.191   8.266
  233   1HD   ARG  29          2HD       ARG  29 -92.740  -3.788   8.512
  234   2HD   ARG  29          1HD       ARG  29 -92.237  -2.114   8.284
  235    HE   ARG  29           HE       ARG  29 -91.572  -2.612   6.110
  236   1HH1  ARG  29          1HH1      ARG  29 -92.677  -5.486   7.778
  237   2HH1  ARG  29          2HH1      ARG  29 -92.765  -6.453   6.340
  238   1HH2  ARG  29          1HH2      ARG  29 -91.687  -3.875   4.214
  239   2HH2  ARG  29          2HH2      ARG  29 -92.184  -5.541   4.309
  240    H    ARG  30           H        ARG  30 -89.841  -6.780  11.633
  241    HA   ARG  30           HA       ARG  30 -88.306  -8.402  11.254
  242   1HB   ARG  30          2HB       ARG  30 -90.317  -8.925   9.333
  243   2HB   ARG  30          1HB       ARG  30 -88.774  -9.099   8.510
  244   1HG   ARG  30          2HG       ARG  30 -88.268 -10.467  10.777
  245   2HG   ARG  30          1HG       ARG  30 -90.000 -10.756  10.602
  246   1HD   ARG  30          2HD       ARG  30 -89.739 -11.800   8.534
  247   2HD   ARG  30          1HD       ARG  30 -88.137 -11.108   8.282
  248    HE   ARG  30           HE       ARG  30 -88.756 -13.277  10.187
  249   1HH1  ARG  30          1HH1      ARG  30 -86.531 -11.600   8.056
  250   2HH1  ARG  30          2HH1      ARG  30 -85.244 -12.747   8.307
  251   1HH2  ARG  30          1HH2      ARG  30 -87.066 -14.759  10.528
  252   2HH2  ARG  30          2HH2      ARG  30 -85.546 -14.543   9.714
  253    H    ASN  31           H        ASN  31 -88.681  -6.886   8.053
  254    HA   ASN  31           HA       ASN  31 -85.791  -6.591   7.857
  255   1HB   ASN  31          2HB       ASN  31 -87.959  -6.874   5.998
  256   2HB   ASN  31          1HB       ASN  31 -87.085  -5.387   5.636
  257   1HD2  ASN  31          1HD2      ASN  31 -86.295  -6.239   3.707
  258   2HD2  ASN  31          2HD2      ASN  31 -85.027  -7.423   3.686
  259    H    ARG  32           H        ARG  32 -86.867  -5.075   9.886
  260    HA   ARG  32           HA       ARG  32 -87.573  -2.445   9.157
  261   1HB   ARG  32          2HB       ARG  32 -87.838  -3.681  11.425
  262   2HB   ARG  32          1HB       ARG  32 -86.221  -3.075  11.756
  263   1HG   ARG  32          2HG       ARG  32 -87.003  -1.063  12.262
  264   2HG   ARG  32          1HG       ARG  32 -87.916  -0.971  10.754
  265   1HD   ARG  32          2HD       ARG  32 -89.836  -1.744  11.710
  266   2HD   ARG  32          1HD       ARG  32 -88.979  -2.724  12.898
  267    HE   ARG  32           HE       ARG  32 -88.912   0.195  13.181
  268   1HH1  ARG  32          1HH1      ARG  32 -90.085  -2.919  14.300
  269   2HH1  ARG  32          2HH1      ARG  32 -90.589  -2.309  15.848
  270   1HH2  ARG  32          1HH2      ARG  32 -89.584   0.988  15.225
  271   2HH2  ARG  32          2HH2      ARG  32 -90.342  -0.095  16.355
  272    HA   PRO  33           HA       PRO  33 -82.766  -1.474  10.044
  273   1HB   PRO  33          2HB       PRO  33 -81.813  -3.993   8.760
  274   2HB   PRO  33          1HB       PRO  33 -81.079  -3.042  10.057
  275   1HG   PRO  33          2HG       PRO  33 -82.345  -5.317  10.598
  276   2HG   PRO  33          1HG       PRO  33 -82.488  -3.916  11.676
  277   1HD   PRO  33          2HD       PRO  33 -84.448  -5.014   9.716
  278   2HD   PRO  33          1HD       PRO  33 -84.732  -4.238  11.288
  279    H    ALA  34           H        ALA  34 -83.855  -3.501   7.347
  280    HA   ALA  34           HA       ALA  34 -83.911  -3.202   5.101
  281   1HB   ALA  34          1HB       ALA  34 -84.359  -0.515   6.221
  282   2HB   ALA  34          2HB       ALA  34 -85.321  -1.445   5.072
  283   3HB   ALA  34          3HB       ALA  34 -83.894  -0.569   4.521
  284    H    ILE  35           H        ILE  35 -81.474  -3.878   5.936
  285    HA   ILE  35           HA       ILE  35 -79.609  -2.012   4.637
  286    HB   ILE  35           HB       ILE  35 -78.834  -2.319   6.821
  287   1HG1  ILE  35          2HG1      ILE  35 -77.188  -4.531   5.754
  288   2HG1  ILE  35          1HG1      ILE  35 -77.270  -3.089   4.747
  289   1HG2  ILE  35          1HG2      ILE  35 -80.236  -4.739   6.739
  290   2HG2  ILE  35          2HG2      ILE  35 -79.422  -4.009   8.123
  291   3HG2  ILE  35          3HG2      ILE  35 -78.562  -5.159   7.099
  292   1HD1  ILE  35          1HD1      ILE  35 -76.379  -1.734   6.482
  293   2HD1  ILE  35          2HD1      ILE  35 -75.355  -3.164   6.342
  294   3HD1  ILE  35          3HD1      ILE  35 -76.523  -3.041   7.656
  295    H    ALA  36           H        ALA  36 -80.311  -5.484   4.956
  296    HA   ALA  36           HA       ALA  36 -79.961  -7.260   3.609
  297   1HB   ALA  36          1HB       ALA  36 -80.530  -7.060   1.381
  298   2HB   ALA  36          2HB       ALA  36 -79.764  -5.480   1.216
  299   3HB   ALA  36          3HB       ALA  36 -81.293  -5.633   2.083
  300    H    ARG  37           H        ARG  37 -78.238  -5.573   1.154
  301    HA   ARG  37           HA       ARG  37 -75.679  -6.488   2.277
  302   1HB   ARG  37          2HB       ARG  37 -77.026  -7.417  -0.147
  303   2HB   ARG  37          1HB       ARG  37 -75.386  -6.859  -0.447
  304   1HG   ARG  37          2HG       ARG  37 -75.038  -9.076   0.001
  305   2HG   ARG  37          1HG       ARG  37 -74.797  -8.361   1.596
  306   1HD   ARG  37          2HD       ARG  37 -76.251  -9.946   2.257
  307   2HD   ARG  37          1HD       ARG  37 -77.461  -8.816   1.653
  308    HE   ARG  37           HE       ARG  37 -77.942 -10.274  -0.039
  309   1HH1  ARG  37          1HH1      ARG  37 -74.879 -11.194   1.410
  310   2HH1  ARG  37          2HH1      ARG  37 -74.724 -12.648   0.469
  311   1HH2  ARG  37          1HH2      ARG  37 -77.762 -12.214  -1.239
  312   2HH2  ARG  37          2HH2      ARG  37 -76.376 -13.244  -1.016
  313    H    GLY  38           H        GLY  38 -74.718  -4.588   2.668
  314   1HA   GLY  38          2HA       GLY  38 -74.815  -2.528   0.552
  315   2HA   GLY  38          1HA       GLY  38 -74.534  -2.208   2.257
  316    H    GLY  39           H        GLY  39 -72.909  -4.953   1.123
  317   1HA   GLY  39          2HA       GLY  39 -70.787  -5.270   0.205
  318   2HA   GLY  39          1HA       GLY  39 -70.579  -3.527   0.137
  319    H    ARG  40           H        ARG  40 -70.327  -2.437   2.275
  320    HA   ARG  40           HA       ARG  40 -69.109  -2.078   4.153
  321   1HB   ARG  40          2HB       ARG  40 -69.442  -4.973   4.900
  322   2HB   ARG  40          1HB       ARG  40 -69.343  -3.571   5.954
  323   1HG   ARG  40          2HG       ARG  40 -71.598  -3.187   4.311
  324   2HG   ARG  40          1HG       ARG  40 -71.651  -4.859   4.872
  325   1HD   ARG  40          2HD       ARG  40 -72.590  -4.020   6.720
  326   2HD   ARG  40          1HD       ARG  40 -70.961  -3.502   7.147
  327    HE   ARG  40           HE       ARG  40 -72.647  -1.696   5.564
  328   1HH1  ARG  40          1HH1      ARG  40 -71.140  -2.490   8.630
  329   2HH1  ARG  40          2HH1      ARG  40 -71.288  -0.874   9.267
  330   1HH2  ARG  40          1HH2      ARG  40 -72.839   0.428   6.395
  331   2HH2  ARG  40          2HH2      ARG  40 -72.257   0.778   7.993
  332    H    ASN  41           H        ASN  41 -67.281  -1.772   2.808
  333    HA   ASN  41           HA       ASN  41 -65.154  -2.032   2.117
  334   1HB   ASN  41          2HB       ASN  41 -65.158  -2.966   4.718
  335   2HB   ASN  41          1HB       ASN  41 -64.389  -4.277   3.825
  336   1HD2  ASN  41          1HD2      ASN  41 -62.851  -3.087   5.585
  337   2HD2  ASN  41          2HD2      ASN  41 -61.711  -2.024   4.831
  338    H    ARG  42           H        ARG  42 -65.473  -2.723   0.126
  339    HA   ARG  42           HA       ARG  42 -65.558  -5.624  -0.331
  340   1HB   ARG  42          2HB       ARG  42 -67.714  -4.499  -0.788
  341   2HB   ARG  42          1HB       ARG  42 -66.907  -3.480  -1.971
  342   1HG   ARG  42          2HG       ARG  42 -67.270  -5.009  -3.527
  343   2HG   ARG  42          1HG       ARG  42 -66.312  -6.174  -2.610
  344   1HD   ARG  42          2HD       ARG  42 -69.120  -5.658  -1.770
  345   2HD   ARG  42          1HD       ARG  42 -68.839  -6.637  -3.208
  346    HE   ARG  42           HE       ARG  42 -67.750  -7.290  -0.533
  347   1HH1  ARG  42          1HH1      ARG  42 -69.109  -8.236  -3.626
  348   2HH1  ARG  42          2HH1      ARG  42 -69.094  -9.935  -3.255
  349   1HH2  ARG  42          1HH2      ARG  42 -67.741  -9.520  -0.042
  350   2HH2  ARG  42          2HH2      ARG  42 -68.341 -10.666  -1.206
  351    HA   PRO  43           HA       PRO  43 -62.966  -3.647  -3.944
  352   1HB   PRO  43          2HB       PRO  43 -61.999  -1.136  -3.479
  353   2HB   PRO  43          1HB       PRO  43 -63.482  -1.457  -4.386
  354   1HG   PRO  43          2HG       PRO  43 -63.149  -0.668  -1.518
  355   2HG   PRO  43          1HG       PRO  43 -64.314  -0.072  -2.715
  356   1HD   PRO  43          2HD       PRO  43 -65.000  -1.887  -0.859
  357   2HD   PRO  43          1HD       PRO  43 -65.676  -1.929  -2.499
  358    H    ALA  44           H        ALA  44 -62.491  -3.218  -0.567
  359    HA   ALA  44           HA       ALA  44 -59.588  -3.344  -0.763
  360   1HB   ALA  44          1HB       ALA  44 -61.527  -2.662   1.296
  361   2HB   ALA  44          2HB       ALA  44 -59.842  -2.173   1.123
  362   3HB   ALA  44          3HB       ALA  44 -60.240  -3.709   1.894
  363    HA   PRO  45           HA       PRO  45 -59.188  -7.782  -0.628
  364   1HB   PRO  45          2HB       PRO  45 -57.053  -7.189   1.370
  365   2HB   PRO  45          1HB       PRO  45 -56.983  -8.189  -0.087
  366   1HG   PRO  45          2HG       PRO  45 -55.874  -5.769  -0.050
  367   2HG   PRO  45          1HG       PRO  45 -56.725  -6.361  -1.490
  368   1HD   PRO  45          2HD       PRO  45 -57.609  -4.377   0.554
  369   2HD   PRO  45          1HD       PRO  45 -57.924  -4.417  -1.191
  370    H    TYR  46           H        TYR  46 -58.545  -6.251   2.526
  371    HA   TYR  46           HA       TYR  46 -60.833  -7.733   3.608
  372   1HB   TYR  46          2HB       TYR  46 -58.809  -8.896   4.365
  373   2HB   TYR  46          1HB       TYR  46 -58.160  -7.382   4.992
  374    HD1  TYR  46           1HD      TYR  46 -58.059  -7.603   7.302
  375    HD2  TYR  46           2HD      TYR  46 -61.574  -8.863   5.266
  376    HE1  TYR  46           1HE      TYR  46 -59.162  -8.005   9.462
  377    HE2  TYR  46           2HE      TYR  46 -62.684  -9.271   7.418
  378    HH   TYR  46           HH       TYR  46 -62.127  -8.084  10.017
  379    H    SER  47           H        SER  47 -58.439  -5.273   4.570
  380    HA   SER  47           HA       SER  47 -60.699  -3.588   5.425
  381   1HB   SER  47          2HB       SER  47 -58.399  -2.764   6.827
  382   2HB   SER  47          1HB       SER  47 -59.804  -3.609   7.479
  383    HG   SER  47           HG       SER  47 -58.315  -5.062   7.915
  384    H    ARG  48           H        ARG  48 -57.372  -3.589   4.197
  385    HA   ARG  48           HA       ARG  48 -57.963  -1.165   2.677
  386   1HB   ARG  48          2HB       ARG  48 -56.324  -1.226   5.037
  387   2HB   ARG  48          1HB       ARG  48 -55.322  -0.852   3.641
  388   1HG   ARG  48          2HG       ARG  48 -55.957   1.245   4.190
  389   2HG   ARG  48          1HG       ARG  48 -57.310   0.824   3.137
  390   1HD   ARG  48          2HD       ARG  48 -58.558   0.082   5.168
  391   2HD   ARG  48          1HD       ARG  48 -57.238   0.720   6.149
  392    HE   ARG  48           HE       ARG  48 -59.084   2.300   4.494
  393   1HH1  ARG  48          1HH1      ARG  48 -56.640   2.083   6.991
  394   2HH1  ARG  48          2HH1      ARG  48 -56.792   3.749   7.463
  395   1HH2  ARG  48          1HH2      ARG  48 -59.280   4.502   5.098
  396   2HH2  ARG  48          2HH2      ARG  48 -58.297   5.120   6.398
  397    HA   PRO  49           HA       PRO  49 -55.563  -3.494  -0.300
  398   1HB   PRO  49          2HB       PRO  49 -55.412  -1.561  -2.202
  399   2HB   PRO  49          1HB       PRO  49 -56.862  -2.533  -1.935
  400   1HG   PRO  49          2HG       PRO  49 -56.249   0.245  -1.030
  401   2HG   PRO  49          1HG       PRO  49 -57.768  -0.421  -1.651
  402   1HD   PRO  49          2HD       PRO  49 -57.280  -0.015   1.001
  403   2HD   PRO  49          1HD       PRO  49 -58.371  -1.274   0.392
  404    H    LYS  50           H        LYS  50 -53.415  -3.671  -0.744
  405    HA   LYS  50           HA       LYS  50 -51.703  -1.483   0.243
  406   1HB   LYS  50          2HB       LYS  50 -50.082  -3.699   0.246
  407   2HB   LYS  50          1HB       LYS  50 -50.904  -3.035   1.650
  408   1HG   LYS  50          2HG       LYS  50 -51.634  -5.156   1.854
  409   2HG   LYS  50          1HG       LYS  50 -52.855  -4.608   0.704
  410   1HD   LYS  50          2HD       LYS  50 -52.091  -6.608  -0.220
  411   2HD   LYS  50          1HD       LYS  50 -51.194  -5.374  -1.106
  412   1HE   LYS  50          2HE       LYS  50 -49.409  -5.733   0.759
  413   2HE   LYS  50          1HE       LYS  50 -50.244  -7.266   1.005
  414   1HZ   LYS  50          1HZ       LYS  50 -49.023  -6.320  -1.537
  415   2HZ   LYS  50          2HZ       LYS  50 -49.882  -7.771  -1.352
  416   3HZ   LYS  50          3HZ       LYS  50 -48.419  -7.542  -0.526
  417    HA   PRO  51           HA       PRO  51 -50.496  -1.360  -4.050
  418   1HB   PRO  51          2HB       PRO  51 -48.711   0.704  -3.734
  419   2HB   PRO  51          1HB       PRO  51 -50.447   0.915  -3.965
  420   1HG   PRO  51          2HG       PRO  51 -48.831   1.087  -1.481
  421   2HG   PRO  51          1HG       PRO  51 -50.286   1.983  -1.943
  422   1HD   PRO  51          2HD       PRO  51 -50.248  -0.119  -0.172
  423   2HD   PRO  51          1HD       PRO  51 -51.674   0.382  -1.098
  424    H    LEU  52           H        LEU  52 -47.820  -0.572  -1.823
  425    HA   LEU  52           HA       LEU  52 -45.668  -1.267  -1.720
  426   1HB   LEU  52          2HB       LEU  52 -47.280  -3.716  -1.990
  427   2HB   LEU  52          1HB       LEU  52 -45.576  -3.906  -2.354
  428    HG   LEU  52           HG       LEU  52 -45.710  -2.443   0.053
  429   1HD1  LEU  52          1HD1      LEU  52 -48.107  -3.545  -0.072
  430   2HD1  LEU  52          2HD1      LEU  52 -47.199  -3.472   1.438
  431   3HD1  LEU  52          3HD1      LEU  52 -47.219  -4.961   0.494
  432   1HD2  LEU  52          1HD2      LEU  52 -44.710  -4.544   0.970
  433   2HD2  LEU  52          2HD2      LEU  52 -43.915  -3.923  -0.475
  434   3HD2  LEU  52          3HD2      LEU  52 -45.010  -5.300  -0.594
  435    HA   PRO  53           HA       PRO  53 -45.106  -0.967  -6.318
  436   1HB   PRO  53          2HB       PRO  53 -43.372   1.141  -6.173
  437   2HB   PRO  53          1HB       PRO  53 -45.125   1.325  -6.306
  438   1HG   PRO  53          2HG       PRO  53 -43.376   1.505  -3.890
  439   2HG   PRO  53          1HG       PRO  53 -44.773   2.500  -4.342
  440   1HD   PRO  53          2HD       PRO  53 -44.919   0.509  -2.507
  441   2HD   PRO  53          1HD       PRO  53 -46.285   0.953  -3.549
  442    H    ASP  54           H        ASP  54 -42.870  -0.781  -3.620
  443    HA   ASP  54           HA       ASP  54 -40.844  -1.678  -3.187
  444   1HB   ASP  54          2HB       ASP  54 -42.059  -3.747  -4.154
  445   2HB   ASP  54          1HB       ASP  54 -41.080  -3.466  -5.591
  446    H    LYS  55           H        LYS  55 -39.322  -0.215  -3.490
  447    HA   LYS  55           HA       LYS  55 -38.605   0.865  -6.020
  448   1HB   LYS  55          2HB       LYS  55 -37.955   1.340  -3.285
  449   2HB   LYS  55          1HB       LYS  55 -36.450   1.147  -4.174
  450   1HG   LYS  55          2HG       LYS  55 -38.413   2.861  -5.501
  451   2HG   LYS  55          1HG       LYS  55 -37.847   3.466  -3.943
  452   1HD   LYS  55          2HD       LYS  55 -35.615   3.536  -4.655
  453   2HD   LYS  55          1HD       LYS  55 -35.932   2.480  -6.034
  454   1HE   LYS  55          2HE       LYS  55 -35.785   4.534  -7.060
  455   2HE   LYS  55          1HE       LYS  55 -37.521   4.404  -6.784
  456   1HZ   LYS  55          1HZ       LYS  55 -36.706   5.574  -4.516
  457   2HZ   LYS  55          2HZ       LYS  55 -37.256   6.422  -5.879
  458   3HZ   LYS  55          3HZ       LYS  55 -35.594   6.222  -5.619
  459    H    TRP  56           H        TRP  56 -37.841  -0.456  -7.533
  460    HA   TRP  56           HA       TRP  56 -36.221  -2.739  -6.903
  461   1HB   TRP  56          2HB       TRP  56 -37.383  -1.560  -9.389
  462   2HB   TRP  56          1HB       TRP  56 -36.067  -2.722  -9.538
  463    HD1  TRP  56           HD       TRP  56 -39.699  -2.461  -8.328
  464    HE1  TRP  56           1HE      TRP  56 -40.692  -4.831  -8.197
  465    HE3  TRP  56           3HE      TRP  56 -35.466  -5.149  -9.297
  466    HZ2  TRP  56           2HZ      TRP  56 -39.785  -7.495  -8.475
  467    HZ3  TRP  56           3HZ      TRP  56 -35.612  -7.604  -9.346
  468    HH2  TRP  56           HH       TRP  56 -37.729  -8.750  -8.944
  469    H    GLN  57           H        GLN  57 -34.099  -3.054  -7.246
  470    HA   GLN  57           HA       GLN  57 -31.894  -2.612  -7.464
  471   1HB   GLN  57          2HB       GLN  57 -33.087  -0.794  -9.471
  472   2HB   GLN  57          1HB       GLN  57 -31.454  -0.401  -8.953
  473   1HG   GLN  57          2HG       GLN  57 -30.549  -2.195  -9.971
  474   2HG   GLN  57          1HG       GLN  57 -31.947  -3.220  -9.650
  475   1HE2  GLN  57          1HE2      GLN  57 -30.332  -2.632 -12.112
  476   2HE2  GLN  57          2HE2      GLN  57 -31.507  -2.201 -13.303
  477    H    HIS  58           H        HIS  58 -30.246  -0.690  -7.202
  478    HA   HIS  58           HA       HIS  58 -31.263   1.339  -5.368
  479   1HB   HIS  58          2HB       HIS  58 -30.097  -0.937  -4.359
  480   2HB   HIS  58          1HB       HIS  58 -28.723   0.157  -4.472
  481    HD1  HIS  58           1HD      HIS  58 -32.178  -0.013  -2.896
  482    HD2  HIS  58           2HD      HIS  58 -28.546   1.975  -2.451
  483    HE1  HIS  58           1HE      HIS  58 -32.377   1.302  -0.763
  484    HE2  HIS  58           2HE      HIS  58 -30.123   2.386  -0.440
  485    H    ASP  59           H        ASP  59 -28.003   1.262  -4.979
  486    HA   ASP  59           HA       ASP  59 -27.656   3.324  -7.021
  487   1HB   ASP  59          2HB       ASP  59 -26.860   3.245  -4.407
  488   2HB   ASP  59          1HB       ASP  59 -25.393   2.730  -5.231
  489    H    LEU  60           H        LEU  60 -26.913   0.080  -6.349
  490    HA   LEU  60           HA       LEU  60 -25.968  -1.568  -7.566
  491   1HB   LEU  60          2HB       LEU  60 -26.591   0.486  -9.529
  492   2HB   LEU  60          1HB       LEU  60 -25.225  -0.502 -10.011
  493    HG   LEU  60           HG       LEU  60 -26.532  -2.498  -9.962
  494   1HD1  LEU  60          1HD1      LEU  60 -28.516  -2.796  -8.902
  495   2HD1  LEU  60          2HD1      LEU  60 -29.050  -1.141  -9.196
  496   3HD1  LEU  60          3HD1      LEU  60 -27.890  -1.477  -7.911
  497   1HD2  LEU  60          1HD2      LEU  60 -26.807  -1.253 -11.983
  498   2HD2  LEU  60          2HD2      LEU  60 -28.024  -0.215 -11.241
  499   3HD2  LEU  60          3HD2      LEU  60 -28.377  -1.918 -11.537
  500    H    PHE  61           H        PHE  61 -24.110   0.869  -9.285
  501    HA   PHE  61           HA       PHE  61 -21.648  -0.303  -8.368
  502   1HB   PHE  61          2HB       PHE  61 -22.430   1.789 -10.330
  503   2HB   PHE  61          1HB       PHE  61 -20.806   1.892  -9.657
  504    HD1  PHE  61           1HD      PHE  61 -19.281  -0.100  -9.877
  505    HD2  PHE  61           2HD      PHE  61 -22.948   0.246 -12.007
  506    HE1  PHE  61           1HE      PHE  61 -18.507  -1.801 -11.478
  507    HE2  PHE  61           2HE      PHE  61 -22.182  -1.454 -13.612
  508    HZ   PHE  61           HZ       PHE  61 -19.969  -2.507 -13.325
  509    H    ASP  62           H        ASP  62 -23.788   1.883  -7.124
  510    HA   ASP  62           HA       ASP  62 -23.793   3.272  -5.336
  511   1HB   ASP  62          2HB       ASP  62 -21.743   1.239  -4.762
  512   2HB   ASP  62          1HB       ASP  62 -21.571   2.718  -3.824
  513    H    SER  63           H        SER  63 -21.500   4.361  -3.898
  514    HA   SER  63           HA       SER  63 -20.773   6.419  -5.802
  515   1HB   SER  63          2HB       SER  63 -19.836   6.264  -2.943
  516   2HB   SER  63          1HB       SER  63 -20.078   7.695  -3.947
  517    HG   SER  63           HG       SER  63 -22.390   6.981  -3.946
  518    H    GLY  64           H        GLY  64 -19.648   4.377  -6.873
  519   1HA   GLY  64          2HA       GLY  64 -17.536   3.983  -7.802
  520   2HA   GLY  64          1HA       GLY  64 -16.806   4.832  -6.448
  521    H    CYS  65           H        CYS  65 -19.074   2.107  -6.392
  522    HA   CYS  65           HA       CYS  65 -16.950   0.498  -5.144
  523   1HB   CYS  65          2HB       CYS  65 -19.892   0.542  -4.467
  524   2HB   CYS  65          1HB       CYS  65 -18.725  -0.596  -3.802
  525    HG   CYS  65           HG       CYS  65 -17.419   2.284  -3.258
  526    H    GLY  66           H        GLY  66 -16.460  -0.328  -7.232
  527   1HA   GLY  66          2HA       GLY  66 -17.636  -2.805  -7.759
  528   2HA   GLY  66          1HA       GLY  66 -18.348  -1.643  -8.868
  529    H    GLY  67           H        GLY  67 -15.123  -2.498  -7.616
  530   1HA   GLY  67          2HA       GLY  67 -13.782  -3.487  -9.634
  531   2HA   GLY  67          1HA       GLY  67 -14.003  -1.859 -10.255
  532    H    GLY  68           H        GLY  68 -13.818  -1.474  -7.019
  533   1HA   GLY  68          2HA       GLY  68 -11.035  -0.644  -7.173
  534   2HA   GLY  68          1HA       GLY  68 -12.145  -0.338  -5.842
  535    H    GLU  69           H        GLU  69 -10.450  -2.976  -7.454
  536    HA   GLU  69           HA       GLU  69 -10.385  -4.489  -4.958
  537   1HB   GLU  69          2HB       GLU  69  -9.241  -6.084  -6.849
  538   2HB   GLU  69          1HB       GLU  69 -10.945  -6.083  -6.431
  539   1HG   GLU  69          2HG       GLU  69 -11.395  -4.528  -8.256
  540   2HG   GLU  69          1HG       GLU  69  -9.682  -4.525  -8.673
  541    H    GLY  70           H        GLY  70  -8.760  -2.358  -4.770
  542   1HA   GLY  70          2HA       GLY  70  -6.589  -1.943  -4.047
  543   2HA   GLY  70          1HA       GLY  70  -6.132  -3.558  -4.583
  544    H    VAL  71           H        VAL  71  -7.865  -1.799  -6.845
  545    HA   VAL  71           HA       VAL  71  -5.435  -1.069  -8.290
  546    HB   VAL  71           HB       VAL  71  -6.464  -3.230  -9.078
  547   1HG1  VAL  71          1HG1      VAL  71  -8.467  -2.609 -10.736
  548   2HG1  VAL  71          2HG1      VAL  71  -8.781  -1.446  -9.449
  549   3HG1  VAL  71          3HG1      VAL  71  -8.714  -3.171  -9.082
  550   1HG2  VAL  71          1HG2      VAL  71  -4.984  -2.085 -10.545
  551   2HG2  VAL  71          2HG2      VAL  71  -6.235  -0.928 -11.001
  552   3HG2  VAL  71          3HG2      VAL  71  -6.371  -2.614 -11.500
  553    H    GLU  72           H        GLU  72  -7.356   0.404  -6.630
  554    HA   GLU  72           HA       GLU  72  -9.050   2.019  -8.191
  555   1HB   GLU  72          2HB       GLU  72  -7.760   2.372  -5.497
  556   2HB   GLU  72          1HB       GLU  72  -8.768   3.629  -6.199
  557   1HG   GLU  72          2HG       GLU  72 -10.414   2.581  -5.109
  558   2HG   GLU  72          1HG       GLU  72 -10.381   1.485  -6.489
  559    H    THR  73           H        THR  73  -5.672   1.948  -7.906
  560    HA   THR  73           HA       THR  73  -3.976   3.177  -8.728
  561    HB   THR  73           HB       THR  73  -4.361   4.346 -10.894
  562    HG1  THR  73           1HG      THR  73  -6.928   4.283 -10.069
  563   1HG2  THR  73          1HG2      THR  73  -5.581   1.593 -10.693
  564   2HG2  THR  73          2HG2      THR  73  -3.857   1.948 -10.794
  565   3HG2  THR  73          3HG2      THR  73  -4.917   2.333 -12.151
  566    H    GLY  74           H        GLY  74  -3.986   4.398  -6.738
  567   1HA   GLY  74          2HA       GLY  74  -4.780   7.206  -7.154
  568   2HA   GLY  74          1HA       GLY  74  -4.623   6.442  -5.578
  569    H    ALA  75           H        ALA  75  -2.523   5.927  -4.807
  570    HA   ALA  75           HA       ALA  75  -0.448   7.684  -5.956
  571   1HB   ALA  75          1HB       ALA  75  -0.338   6.972  -3.081
  572   2HB   ALA  75          2HB       ALA  75  -1.605   8.092  -3.581
  573   3HB   ALA  75          3HB       ALA  75   0.088   8.478  -3.892
  574    H    LYS  76           H        LYS  76   1.219   6.591  -6.781
  575    HA   LYS  76           HA       LYS  76   1.689   3.841  -5.885
  576   1HB   LYS  76          2HB       LYS  76   1.363   4.085  -8.251
  577   2HB   LYS  76          1HB       LYS  76   2.565   5.365  -8.341
  578   1HG   LYS  76          2HG       LYS  76   4.302   3.722  -7.712
  579   2HG   LYS  76          1HG       LYS  76   3.075   2.457  -7.751
  580   1HD   LYS  76          2HD       LYS  76   2.627   3.056 -10.127
  581   2HD   LYS  76          1HD       LYS  76   3.988   4.177 -10.054
  582   1HE   LYS  76          2HE       LYS  76   4.812   2.179 -11.023
  583   2HE   LYS  76          1HE       LYS  76   5.419   2.223  -9.368
  584   1HZ   LYS  76          1HZ       LYS  76   4.536   0.030 -10.090
  585   2HZ   LYS  76          2HZ       LYS  76   2.991   0.726 -10.184
  586   3HZ   LYS  76          3HZ       LYS  76   3.794   0.648  -8.692
  587    H    LEU  77           H        LEU  77   3.137   3.580  -4.348
  588    HA   LEU  77           HA       LEU  77   5.539   5.272  -4.278
  589   1HB   LEU  77          2HB       LEU  77   4.271   5.332  -2.249
  590   2HB   LEU  77          1HB       LEU  77   4.087   3.598  -2.230
  591    HG   LEU  77           HG       LEU  77   5.609   4.554  -0.486
  592   1HD1  LEU  77          1HD1      LEU  77   7.109   2.779  -0.484
  593   2HD1  LEU  77          2HD1      LEU  77   7.100   2.649  -2.241
  594   3HD1  LEU  77          3HD1      LEU  77   5.675   2.176  -1.315
  595   1HD2  LEU  77          1HD2      LEU  77   7.314   5.143  -2.893
  596   2HD2  LEU  77          2HD2      LEU  77   7.953   5.039  -1.252
  597   3HD2  LEU  77          3HD2      LEU  77   6.754   6.268  -1.655
  598    H    LEU  78           H        LEU  78   7.416   4.391  -4.940
  599    HA   LEU  78           HA       LEU  78   7.750   1.473  -4.666
  600   1HB   LEU  78          2HB       LEU  78   9.273   3.359  -6.466
  601   2HB   LEU  78          1HB       LEU  78   9.443   1.615  -6.407
  602    HG   LEU  78           HG       LEU  78   6.702   2.273  -6.931
  603   1HD1  LEU  78          1HD1      LEU  78   7.586   4.387  -7.789
  604   2HD1  LEU  78          2HD1      LEU  78   6.949   3.373  -9.085
  605   3HD1  LEU  78          3HD1      LEU  78   8.691   3.498  -8.836
  606   1HD2  LEU  78          1HD2      LEU  78   8.131   0.198  -7.456
  607   2HD2  LEU  78          2HD2      LEU  78   8.652   1.098  -8.880
  608   3HD2  LEU  78          3HD2      LEU  78   6.943   0.721  -8.649
  609    H    VAL  79           H        VAL  79   8.849   1.020  -2.841
  610    HA   VAL  79           HA       VAL  79  10.982   2.810  -1.974
  611    HB   VAL  79           HB       VAL  79  10.986   0.700  -0.201
  612   1HG1  VAL  79          1HG1      VAL  79   9.538   3.326  -0.128
  613   2HG1  VAL  79          2HG1      VAL  79  11.116   2.926   0.550
  614   3HG1  VAL  79          3HG1      VAL  79   9.652   2.251   1.266
  615   1HG2  VAL  79          1HG2      VAL  79   8.536   0.503   0.401
  616   2HG2  VAL  79          2HG2      VAL  79   9.080  -0.389  -1.019
  617   3HG2  VAL  79          3HG2      VAL  79   8.200   1.127  -1.214
  618    H    SER  80           H        SER  80  12.937   1.769  -1.086
  619    HA   SER  80           HA       SER  80  13.915  -0.688  -2.101
  620   1HB   SER  80          2HB       SER  80  15.311   1.703  -3.312
  621   2HB   SER  80          1HB       SER  80  15.500  -0.002  -3.727
  622    HG   SER  80           HG       SER  80  12.992   0.497  -4.152
  623    H    ASN  81           H        ASN  81  14.899  -1.239  -0.272
  624    HA   ASN  81           HA       ASN  81  16.152   0.805   1.391
  625   1HB   ASN  81          2HB       ASN  81  14.537  -1.172   2.102
  626   2HB   ASN  81          1HB       ASN  81  16.044  -2.078   2.167
  627   1HD2  ASN  81          1HD2      ASN  81  15.495  -2.287   4.423
  628   2HD2  ASN  81          2HD2      ASN  81  15.929  -1.022   5.524
  629    H    LEU  82           H        LEU  82  17.053  -1.380  -0.962
  630    HA   LEU  82           HA       LEU  82  19.037  -2.031  -1.842
  631   1HB   LEU  82          2HB       LEU  82  19.797   0.255  -0.755
  632   2HB   LEU  82          1HB       LEU  82  20.645  -0.806   0.355
  633    HG   LEU  82           HG       LEU  82  21.879   0.121  -1.737
  634   1HD1  LEU  82          1HD1      LEU  82  23.429  -1.428  -1.300
  635   2HD1  LEU  82          2HD1      LEU  82  22.336  -2.765  -1.664
  636   3HD1  LEU  82          3HD1      LEU  82  22.292  -1.996  -0.076
  637   1HD2  LEU  82          1HD2      LEU  82  20.234  -0.497  -3.401
  638   2HD2  LEU  82          2HD2      LEU  82  20.363  -2.194  -2.936
  639   3HD2  LEU  82          3HD2      LEU  82  21.735  -1.378  -3.685
  640    H    ASP  83           H        ASP  83  19.301  -2.058   1.697
  641    HA   ASP  83           HA       ASP  83  19.813  -4.958   1.543
  642   1HB   ASP  83          2HB       ASP  83  21.544  -3.197   2.608
  643   2HB   ASP  83          1HB       ASP  83  20.514  -3.448   4.013
  644    H    PHE  84           H        PHE  84  19.242  -5.760   4.031
  645    HA   PHE  84           HA       PHE  84  17.509  -6.393   5.366
  646   1HB   PHE  84          2HB       PHE  84  16.436  -3.591   5.307
  647   2HB   PHE  84          1HB       PHE  84  16.534  -4.715   6.658
  648    HD1  PHE  84           1HD      PHE  84  17.820  -1.774   5.399
  649    HD2  PHE  84           2HD      PHE  84  19.096  -5.412   7.201
  650    HE1  PHE  84           1HE      PHE  84  19.891  -0.675   6.144
  651    HE2  PHE  84           2HE      PHE  84  21.167  -4.318   7.952
  652    HZ   PHE  84           HZ       PHE  84  21.566  -1.947   7.423
  653    H    GLY  85           H        GLY  85  16.625  -7.618   3.613
  654   1HA   GLY  85          2HA       GLY  85  14.668  -6.453   1.856
  655   2HA   GLY  85          1HA       GLY  85  15.200  -8.131   1.876
  656    H    VAL  86           H        VAL  86  13.479  -5.841   3.904
  657    HA   VAL  86           HA       VAL  86  11.866  -7.487   5.386
  658    HB   VAL  86           HB       VAL  86  10.118  -5.613   5.213
  659   1HG1  VAL  86          1HG1      VAL  86  11.277  -5.379   7.134
  660   2HG1  VAL  86          2HG1      VAL  86  11.965  -3.989   6.294
  661   3HG1  VAL  86          3HG1      VAL  86  12.844  -5.519   6.334
  662   1HG2  VAL  86          1HG2      VAL  86  11.986  -3.655   4.274
  663   2HG2  VAL  86          2HG2      VAL  86  10.358  -4.009   3.694
  664   3HG2  VAL  86          3HG2      VAL  86  11.741  -4.882   3.031
  665    H    SER  87           H        SER  87   9.748  -8.307   5.177
  666    HA   SER  87           HA       SER  87   9.322  -9.477   2.594
  667   1HB   SER  87          2HB       SER  87   7.309  -9.905   4.709
  668   2HB   SER  87          1HB       SER  87   8.189 -11.079   3.730
  669    HG   SER  87           HG       SER  87   9.066  -9.716   6.065
  670    H    ASP  88           H        ASP  88   6.900  -9.801   2.032
  671    HA   ASP  88           HA       ASP  88   5.916  -7.526   0.822
  672   1HB   ASP  88          2HB       ASP  88   5.134 -10.232   1.095
  673   2HB   ASP  88          1HB       ASP  88   3.723  -9.261   1.492
  674    H    ALA  89           H        ALA  89   4.708  -9.033   3.812
  675    HA   ALA  89           HA       ALA  89   2.858  -6.893   4.305
  676   1HB   ALA  89          1HB       ALA  89   1.879  -8.416   5.578
  677   2HB   ALA  89          2HB       ALA  89   3.291  -8.500   6.629
  678   3HB   ALA  89          3HB       ALA  89   3.189  -9.533   5.204
  679    H    ASP  90           H        ASP  90   6.158  -7.400   5.010
  680    HA   ASP  90           HA       ASP  90   6.361  -6.034   7.476
  681   1HB   ASP  90          2HB       ASP  90   8.293  -6.692   5.289
  682   2HB   ASP  90          1HB       ASP  90   8.778  -5.562   6.550
  683    H    ILE  91           H        ILE  91   7.270  -4.842   4.234
  684    HA   ILE  91           HA       ILE  91   7.346  -2.143   4.907
  685    HB   ILE  91           HB       ILE  91   8.214  -3.175   2.784
  686   1HG1  ILE  91          2HG1      ILE  91   7.582  -1.164   1.363
  687   2HG1  ILE  91          1HG1      ILE  91   6.527  -0.677   2.686
  688   1HG2  ILE  91          1HG2      ILE  91   6.872  -4.149   1.317
  689   2HG2  ILE  91          2HG2      ILE  91   5.897  -2.687   1.177
  690   3HG2  ILE  91          3HG2      ILE  91   5.524  -3.881   2.422
  691   1HD1  ILE  91          1HD1      ILE  91   9.074   0.131   2.409
  692   2HD1  ILE  91          2HD1      ILE  91   9.302  -1.282   3.439
  693   3HD1  ILE  91          3HD1      ILE  91   8.238   0.024   3.958
  694    H    GLN  92           H        GLN  92   4.639  -4.207   4.216
  695    HA   GLN  92           HA       GLN  92   2.709  -2.197   3.713
  696   1HB   GLN  92          2HB       GLN  92   2.352  -4.560   3.127
  697   2HB   GLN  92          1HB       GLN  92   2.335  -4.983   4.834
  698   1HG   GLN  92          2HG       GLN  92   0.370  -3.406   5.062
  699   2HG   GLN  92          1HG       GLN  92   0.319  -3.374   3.300
  700   1HE2  GLN  92          1HE2      GLN  92  -0.198  -5.282   6.159
  701   2HE2  GLN  92          2HE2      GLN  92  -1.048  -6.576   5.376
  702    H    GLU  93           H        GLU  93   3.427  -4.082   6.654
  703    HA   GLU  93           HA       GLU  93   1.669  -2.674   8.330
  704   1HB   GLU  93          2HB       GLU  93   4.085  -4.383   8.822
  705   2HB   GLU  93          1HB       GLU  93   3.290  -3.559  10.158
  706   1HG   GLU  93          2HG       GLU  93   2.384  -5.849   8.533
  707   2HG   GLU  93          1HG       GLU  93   2.156  -5.509  10.247
  708    H    LEU  94           H        LEU  94   4.960  -2.058   7.361
  709    HA   LEU  94           HA       LEU  94   5.566  -0.027   9.223
  710   1HB   LEU  94          2HB       LEU  94   7.103  -1.284   7.557
  711   2HB   LEU  94          1HB       LEU  94   6.614  -0.052   6.410
  712    HG   LEU  94           HG       LEU  94   7.440   1.273   8.783
  713   1HD1  LEU  94          1HD1      LEU  94   9.221  -0.975   7.914
  714   2HD1  LEU  94          2HD1      LEU  94   8.732  -0.511   9.543
  715   3HD1  LEU  94          3HD1      LEU  94   9.876   0.488   8.648
  716   1HD2  LEU  94          1HD2      LEU  94   9.148   2.201   7.263
  717   2HD2  LEU  94          2HD2      LEU  94   7.530   2.227   6.564
  718   3HD2  LEU  94          3HD2      LEU  94   8.691   1.004   6.053
  719    H    PHE  95           H        PHE  95   4.848   0.420   5.765
  720    HA   PHE  95           HA       PHE  95   4.242   3.107   5.914
  721   1HB   PHE  95          2HB       PHE  95   4.095   1.048   3.941
  722   2HB   PHE  95          1HB       PHE  95   2.663   2.067   3.829
  723    HD1  PHE  95           1HD      PHE  95   3.308   4.689   4.154
  724    HD2  PHE  95           2HD      PHE  95   5.822   1.641   2.580
  725    HE1  PHE  95           1HE      PHE  95   4.618   6.392   2.958
  726    HE2  PHE  95           2HE      PHE  95   7.140   3.337   1.384
  727    HZ   PHE  95           HZ       PHE  95   6.512   5.714   1.549
  728    H    ALA  96           H        ALA  96   2.148   0.459   6.813
  729    HA   ALA  96           HA       ALA  96  -0.274   1.970   6.822
  730   1HB   ALA  96          1HB       ALA  96  -1.249   0.129   7.733
  731   2HB   ALA  96          2HB       ALA  96   0.084  -0.157   8.853
  732   3HB   ALA  96          3HB       ALA  96   0.232  -0.638   7.162
  733    H    GLU  97           H        GLU  97   2.000   1.106   9.351
  734    HA   GLU  97           HA       GLU  97   1.236   2.877  11.352
  735   1HB   GLU  97          2HB       GLU  97   3.137   1.174  11.419
  736   2HB   GLU  97          1HB       GLU  97   4.134   2.413  10.670
  737   1HG   GLU  97          2HG       GLU  97   4.630   2.805  12.842
  738   2HG   GLU  97          1HG       GLU  97   3.229   3.862  12.676
  739    H    PHE  98           H        PHE  98   3.158   3.510   8.467
  740    HA   PHE  98           HA       PHE  98   3.550   6.274   8.877
  741   1HB   PHE  98          2HB       PHE  98   4.074   4.362   6.797
  742   2HB   PHE  98          1HB       PHE  98   3.413   5.839   6.101
  743    HD1  PHE  98           1HD      PHE  98   6.310   4.456   6.159
  744    HD2  PHE  98           2HD      PHE  98   4.514   7.837   8.022
  745    HE1  PHE  98           1HE      PHE  98   8.518   5.524   6.341
  746    HE2  PHE  98           2HE      PHE  98   6.715   8.910   8.199
  747    HZ   PHE  98           HZ       PHE  98   8.719   7.759   7.394
  748    H    GLY  99           H        GLY  99   0.709   4.848   8.763
  749   1HA   GLY  99          2HA       GLY  99  -1.218   6.340   8.795
  750   2HA   GLY  99          1HA       GLY  99  -0.559   7.122   7.375
  751    H    THR 100           H        THR 100  -0.293   5.397   5.455
  752    HA   THR 100           HA       THR 100  -3.002   4.265   5.242
  753    HB   THR 100           HB       THR 100  -1.950   5.692   2.872
  754    HG1  THR 100           1HG      THR 100  -1.501   7.390   4.120
  755   1HG2  THR 100          1HG2      THR 100  -4.249   4.557   3.208
  756   2HG2  THR 100          2HG2      THR 100  -4.200   6.148   2.447
  757   3HG2  THR 100          3HG2      THR 100  -4.650   5.995   4.145
  758    H    LEU 101           H        LEU 101  -3.338   2.793   3.520
  759    HA   LEU 101           HA       LEU 101  -1.441   1.974   1.677
  760   1HB   LEU 101          2HB       LEU 101  -0.641   1.067   4.108
  761   2HB   LEU 101          1HB       LEU 101  -1.590  -0.293   3.532
  762    HG   LEU 101           HG       LEU 101  -0.097  -0.832   1.903
  763   1HD1  LEU 101          1HD1      LEU 101  -0.248   1.021   0.482
  764   2HD1  LEU 101          2HD1      LEU 101   1.464   0.938   0.903
  765   3HD1  LEU 101          3HD1      LEU 101   0.419   2.118   1.693
  766   1HD2  LEU 101          1HD2      LEU 101   2.256  -0.141   2.628
  767   2HD2  LEU 101          2HD2      LEU 101   1.265  -1.049   3.774
  768   3HD2  LEU 101          3HD2      LEU 101   1.445   0.696   3.955
  769    H    LYS 102           H        LYS 102  -3.147   1.955   0.384
  770    HA   LYS 102           HA       LYS 102  -5.433   0.289   0.649
  771   1HB   LYS 102          2HB       LYS 102  -4.534   2.158  -1.224
  772   2HB   LYS 102          1HB       LYS 102  -4.601   0.644  -2.116
  773   1HG   LYS 102          2HG       LYS 102  -6.919   1.499  -0.439
  774   2HG   LYS 102          1HG       LYS 102  -6.677   2.185  -2.048
  775   1HD   LYS 102          2HD       LYS 102  -7.642   0.384  -2.924
  776   2HD   LYS 102          1HD       LYS 102  -6.325  -0.603  -2.287
  777   1HE   LYS 102          2HE       LYS 102  -7.576  -1.405  -0.599
  778   2HE   LYS 102          1HE       LYS 102  -8.374   0.143  -0.321
  779   1HZ   LYS 102          1HZ       LYS 102 -10.077  -1.167  -1.092
  780   2HZ   LYS 102          2HZ       LYS 102  -9.101  -2.013  -2.187
  781   3HZ   LYS 102          3HZ       LYS 102  -9.569  -0.415  -2.528
  782    H    LYS 103           H        LYS 103  -2.550  -0.133  -1.413
  783    HA   LYS 103           HA       LYS 103  -2.504  -2.961  -0.650
  784   1HB   LYS 103          2HB       LYS 103  -2.657  -3.779  -2.758
  785   2HB   LYS 103          1HB       LYS 103  -3.458  -2.252  -3.092
  786   1HG   LYS 103          2HG       LYS 103  -1.911  -1.751  -4.594
  787   2HG   LYS 103          1HG       LYS 103  -0.650  -1.868  -3.366
  788   1HD   LYS 103          2HD       LYS 103  -1.386  -4.508  -4.030
  789   2HD   LYS 103          1HD       LYS 103  -1.212  -3.632  -5.553
  790   1HE   LYS 103          2HE       LYS 103   0.914  -3.064  -3.632
  791   2HE   LYS 103          1HE       LYS 103   0.832  -4.760  -4.099
  792   1HZ   LYS 103          1HZ       LYS 103   0.585  -3.481  -6.468
  793   2HZ   LYS 103          2HZ       LYS 103   2.036  -4.105  -5.848
  794   3HZ   LYS 103          3HZ       LYS 103   1.662  -2.464  -5.637
  795    H    ALA 104           H        ALA 104  -0.409  -3.853  -0.510
  796    HA   ALA 104           HA       ALA 104   1.833  -2.291  -1.508
  797   1HB   ALA 104          1HB       ALA 104   1.063  -2.155   1.238
  798   2HB   ALA 104          2HB       ALA 104   2.415  -1.363   0.419
  799   3HB   ALA 104          3HB       ALA 104   2.619  -2.977   1.111
  800    H    ALA 105           H        ALA 105   3.513  -3.536  -2.079
  801    HA   ALA 105           HA       ALA 105   3.907  -6.198  -1.012
  802   1HB   ALA 105          1HB       ALA 105   2.204  -6.079  -3.108
  803   2HB   ALA 105          2HB       ALA 105   3.274  -7.445  -2.790
  804   3HB   ALA 105          3HB       ALA 105   3.746  -6.205  -3.954
  805    H    VAL 106           H        VAL 106   5.998  -7.097  -1.757
  806    HA   VAL 106           HA       VAL 106   7.776  -4.904  -2.506
  807    HB   VAL 106           HB       VAL 106   9.612  -6.301  -1.732
  808   1HG1  VAL 106          1HG1      VAL 106   8.989  -6.452   0.647
  809   2HG1  VAL 106          2HG1      VAL 106   7.304  -6.192   0.200
  810   3HG1  VAL 106          3HG1      VAL 106   8.499  -4.928  -0.092
  811   1HG2  VAL 106          1HG2      VAL 106   7.519  -8.401  -1.697
  812   2HG2  VAL 106          2HG2      VAL 106   8.748  -8.450  -0.433
  813   3HG2  VAL 106          3HG2      VAL 106   9.226  -8.506  -2.130
  814    H    ASP 107           H        ASP 107   9.741  -5.558  -3.767
  815    HA   ASP 107           HA       ASP 107   9.145  -7.263  -6.048
  816   1HB   ASP 107          2HB       ASP 107   8.417  -4.602  -6.174
  817   2HB   ASP 107          1HB       ASP 107  10.026  -4.591  -6.891
  818    H    TYR 108           H        TYR 108  11.113  -7.147  -7.611
  819    HA   TYR 108           HA       TYR 108  13.603  -6.584  -6.258
  820   1HB   TYR 108          2HB       TYR 108  12.563  -9.380  -6.535
  821   2HB   TYR 108          1HB       TYR 108  14.296  -9.087  -6.658
  822    HD1  TYR 108           1HD      TYR 108  15.442  -7.862  -4.708
  823    HD2  TYR 108           2HD      TYR 108  11.532  -9.541  -4.446
  824    HE1  TYR 108           1HE      TYR 108  15.584  -7.822  -2.251
  825    HE2  TYR 108           2HE      TYR 108  11.670  -9.504  -1.993
  826    HH   TYR 108           HH       TYR 108  12.881  -8.305  -0.236
  827    H    ASP 109           H        ASP 109  15.448  -7.785  -7.688
  828    HA   ASP 109           HA       ASP 109  14.994  -6.649 -10.342
  829   1HB   ASP 109          2HB       ASP 109  17.079  -5.897  -9.806
  830   2HB   ASP 109          1HB       ASP 109  17.325  -7.155  -8.604
  831    H    ARG 110           H        ARG 110  15.777  -7.989 -12.245
  832    HA   ARG 110           HA       ARG 110  14.369 -10.346 -12.460
  833   1HB   ARG 110          2HB       ARG 110  16.716  -9.262 -13.981
  834   2HB   ARG 110          1HB       ARG 110  16.052 -10.841 -14.375
  835   1HG   ARG 110          2HG       ARG 110  14.406  -9.924 -15.534
  836   2HG   ARG 110          1HG       ARG 110  13.943  -8.908 -14.166
  837   1HD   ARG 110          2HD       ARG 110  16.378  -8.106 -15.631
  838   2HD   ARG 110          1HD       ARG 110  14.853  -7.936 -16.501
  839    HE   ARG 110           HE       ARG 110  14.086  -6.501 -14.685
  840   1HH1  ARG 110          1HH1      ARG 110  17.534  -7.107 -14.905
  841   2HH1  ARG 110          2HH1      ARG 110  17.967  -5.671 -14.020
  842   1HH2  ARG 110          1HH2      ARG 110  14.646  -4.622 -13.544
  843   2HH2  ARG 110          2HH2      ARG 110  16.321  -4.244 -13.269
  844    H    SER 111           H        SER 111  17.781  -9.944 -11.591
  845    HA   SER 111           HA       SER 111  18.117 -12.822 -11.304
  846   1HB   SER 111          2HB       SER 111  20.424 -11.498 -10.393
  847   2HB   SER 111          1HB       SER 111  20.187 -12.254 -11.971
  848    HG   SER 111           HG       SER 111  19.550  -9.558 -11.285
  849    H    GLY 112           H        GLY 112  16.893 -10.411  -9.433
  850   1HA   GLY 112          2HA       GLY 112  16.444 -10.234  -7.180
  851   2HA   GLY 112          1HA       GLY 112  17.157 -11.829  -6.970
  852    H    ARG 113           H        ARG 113  18.481  -8.767  -8.170
  853    HA   ARG 113           HA       ARG 113  21.043  -9.155  -7.158
  854   1HB   ARG 113          2HB       ARG 113  20.274  -7.478  -8.903
  855   2HB   ARG 113          1HB       ARG 113  19.785  -6.443  -7.571
  856   1HG   ARG 113          2HG       ARG 113  22.046  -6.279  -6.790
  857   2HG   ARG 113          1HG       ARG 113  22.585  -7.469  -7.976
  858   1HD   ARG 113          2HD       ARG 113  21.194  -5.000  -8.909
  859   2HD   ARG 113          1HD       ARG 113  22.885  -4.903  -8.423
  860    HE   ARG 113           HE       ARG 113  23.452  -6.364 -10.202
  861   1HH1  ARG 113          1HH1      ARG 113  20.101  -5.355 -10.230
  862   2HH1  ARG 113          2HH1      ARG 113  19.821  -5.882 -11.860
  863   1HH2  ARG 113          1HH2      ARG 113  23.121  -6.998 -12.352
  864   2HH2  ARG 113          2HH2      ARG 113  21.549  -6.800 -13.082
  865    H    SER 114           H        SER 114  18.944  -6.566  -5.905
  866    HA   SER 114           HA       SER 114  19.141  -7.403  -3.202
  867   1HB   SER 114          2HB       SER 114  20.319  -5.066  -2.665
  868   2HB   SER 114          1HB       SER 114  21.264  -6.526  -2.951
  869    HG   SER 114           HG       SER 114  22.112  -4.899  -4.212
  870    H    LEU 115           H        LEU 115  19.262  -3.990  -3.621
  871    HA   LEU 115           HA       LEU 115  17.825  -2.332  -3.599
  872   1HB   LEU 115          2HB       LEU 115  15.624  -2.889  -5.064
  873   2HB   LEU 115          1HB       LEU 115  17.139  -2.291  -5.695
  874    HG   LEU 115           HG       LEU 115  17.102  -5.195  -5.573
  875   1HD1  LEU 115          1HD1      LEU 115  15.069  -3.881  -7.354
  876   2HD1  LEU 115          2HD1      LEU 115  14.678  -4.727  -5.856
  877   3HD1  LEU 115          3HD1      LEU 115  15.414  -5.604  -7.199
  878   1HD2  LEU 115          1HD2      LEU 115  17.719  -3.026  -7.516
  879   2HD2  LEU 115          2HD2      LEU 115  17.452  -4.659  -8.125
  880   3HD2  LEU 115          3HD2      LEU 115  18.729  -4.355  -6.948
  881    H    GLY 116           H        GLY 116  15.711  -5.196  -3.354
  882   1HA   GLY 116          2HA       GLY 116  13.966  -5.609  -1.899
  883   2HA   GLY 116          1HA       GLY 116  14.710  -4.431  -0.823
  884    H    THR 117           H        THR 117  13.076  -4.407  -3.970
  885    HA   THR 117           HA       THR 117  12.050  -1.764  -3.520
  886    HB   THR 117           HB       THR 117  10.681  -3.015  -5.672
  887    HG1  THR 117           1HG      THR 117  12.272  -4.632  -5.652
  888   1HG2  THR 117          1HG2      THR 117  11.161  -0.965  -6.408
  889   2HG2  THR 117          2HG2      THR 117  12.801  -1.528  -6.730
  890   3HG2  THR 117          3HG2      THR 117  12.417  -0.764  -5.187
  891    H    ALA 118           H        ALA 118   9.770  -1.250  -3.485
  892    HA   ALA 118           HA       ALA 118   7.872  -3.423  -3.342
  893   1HB   ALA 118          1HB       ALA 118   7.512  -1.576  -1.071
  894   2HB   ALA 118          2HB       ALA 118   8.851  -2.716  -0.930
  895   3HB   ALA 118          3HB       ALA 118   7.208  -3.310  -1.188
  896    H    ASP 119           H        ASP 119   5.949  -2.848  -4.121
  897    HA   ASP 119           HA       ASP 119   5.514  -0.003  -4.705
  898   1HB   ASP 119          2HB       ASP 119   5.365  -1.303  -6.723
  899   2HB   ASP 119          1HB       ASP 119   4.333  -2.499  -5.945
  900    H    VAL 120           H        VAL 120   4.477   0.876  -3.039
  901    HA   VAL 120           HA       VAL 120   2.112  -0.562  -2.069
  902    HB   VAL 120           HB       VAL 120   2.311   0.418   0.022
  903   1HG1  VAL 120          1HG1      VAL 120   4.810  -0.502  -1.138
  904   2HG1  VAL 120          2HG1      VAL 120   4.085  -0.875   0.427
  905   3HG1  VAL 120          3HG1      VAL 120   5.060   0.582   0.229
  906   1HG2  VAL 120          1HG2      VAL 120   3.948   2.520  -1.329
  907   2HG2  VAL 120          2HG2      VAL 120   3.880   2.365   0.430
  908   3HG2  VAL 120          3HG2      VAL 120   2.408   2.701  -0.485
  909    H    HIS 121           H        HIS 121   0.188   0.639  -1.858
  910    HA   HIS 121           HA       HIS 121   0.094   3.024  -3.579
  911   1HB   HIS 121          2HB       HIS 121  -1.131   0.379  -3.973
  912   2HB   HIS 121          1HB       HIS 121  -2.262   1.719  -4.127
  913    HD1  HIS 121           1HD      HIS 121   0.722   0.157  -5.794
  914    HD2  HIS 121           2HD      HIS 121  -1.860   3.380  -6.342
  915    HE1  HIS 121           1HE      HIS 121   1.088   0.926  -8.152
  916    HE2  HIS 121           2HE      HIS 121  -0.646   2.716  -8.532
  917    H    PHE 122           H        PHE 122  -0.864   4.650  -2.519
  918    HA   PHE 122           HA       PHE 122  -2.797   3.978  -0.408
  919   1HB   PHE 122          2HB       PHE 122  -1.934   6.795  -0.769
  920   2HB   PHE 122          1HB       PHE 122  -2.235   5.893   0.708
  921    HD1  PHE 122           1HD      PHE 122   0.231   7.026  -1.655
  922    HD2  PHE 122           2HD      PHE 122  -0.481   4.367   1.587
  923    HE1  PHE 122           1HE      PHE 122   2.654   6.813  -1.306
  924    HE2  PHE 122           2HE      PHE 122   1.942   4.146   1.942
  925    HZ   PHE 122           HZ       PHE 122   3.513   5.371   0.494
  926    H    GLU 123           H        GLU 123  -4.776   5.173  -0.284
  927    HA   GLU 123           HA       GLU 123  -5.934   5.797  -2.837
  928   1HB   GLU 123          2HB       GLU 123  -7.206   4.714  -0.983
  929   2HB   GLU 123          1HB       GLU 123  -7.073   6.204  -0.061
  930   1HG   GLU 123          2HG       GLU 123  -8.211   6.492  -2.756
  931   2HG   GLU 123          1HG       GLU 123  -9.177   5.554  -1.616
  932    H    ARG 124           H        ARG 124  -4.399   7.519  -0.254
  933    HA   ARG 124           HA       ARG 124  -5.418  10.100  -1.137
  934   1HB   ARG 124          2HB       ARG 124  -3.365   9.787   1.007
  935   2HB   ARG 124          1HB       ARG 124  -4.674  10.956   0.882
  936   1HG   ARG 124          2HG       ARG 124  -5.466   8.132   1.231
  937   2HG   ARG 124          1HG       ARG 124  -4.683   8.911   2.607
  938   1HD   ARG 124          2HD       ARG 124  -7.035   9.215   2.848
  939   2HD   ARG 124          1HD       ARG 124  -6.341  10.770   2.393
  940    HE   ARG 124           HE       ARG 124  -7.883   8.988   0.612
  941   1HH1  ARG 124          1HH1      ARG 124  -6.664  12.161   1.469
  942   2HH1  ARG 124          2HH1      ARG 124  -7.459  12.963   0.142
  943   1HH2  ARG 124          1HH2      ARG 124  -8.923  10.025  -1.126
  944   2HH2  ARG 124          2HH2      ARG 124  -8.746  11.749  -1.335
  945    H    ARG 125           H        ARG 125  -4.264  11.365  -2.491
  946    HA   ARG 125           HA       ARG 125  -1.715  10.391  -3.419
  947   1HB   ARG 125          2HB       ARG 125  -2.745  13.005  -4.356
  948   2HB   ARG 125          1HB       ARG 125  -2.060  11.672  -5.271
  949   1HG   ARG 125          2HG       ARG 125  -4.822  11.645  -4.079
  950   2HG   ARG 125          1HG       ARG 125  -4.460  12.130  -5.736
  951   1HD   ARG 125          2HD       ARG 125  -3.184   9.739  -5.600
  952   2HD   ARG 125          1HD       ARG 125  -4.550   9.455  -4.521
  953    HE   ARG 125           HE       ARG 125  -4.683  10.080  -7.386
  954   1HH1  ARG 125          1HH1      ARG 125  -6.285   9.082  -4.423
  955   2HH1  ARG 125          2HH1      ARG 125  -7.785   8.705  -5.217
  956   1HH2  ARG 125          1HH2      ARG 125  -6.650   9.592  -8.420
  957   2HH2  ARG 125          2HH2      ARG 125  -7.989   8.981  -7.489
  958    H    ALA 126           H        ALA 126  -2.933  13.082  -1.487
  959    HA   ALA 126           HA       ALA 126  -0.537  14.548  -1.312
  960   1HB   ALA 126          1HB       ALA 126  -1.601  15.042   1.088
  961   2HB   ALA 126          2HB       ALA 126  -3.017  14.361   0.286
  962   3HB   ALA 126          3HB       ALA 126  -2.210  15.773  -0.398
  963    H    ASP 127           H        ASP 127  -1.691  11.743   0.373
  964    HA   ASP 127           HA       ASP 127   0.316  11.473   2.294
  965   1HB   ASP 127          2HB       ASP 127  -1.810   9.876   1.371
  966   2HB   ASP 127          1HB       ASP 127  -0.361   8.877   1.262
  967    H    ALA 128           H        ALA 128   0.376  10.830  -1.131
  968    HA   ALA 128           HA       ALA 128   2.901   9.430  -1.065
  969   1HB   ALA 128          1HB       ALA 128   1.018   9.318  -2.878
  970   2HB   ALA 128          2HB       ALA 128   2.712   9.231  -3.365
  971   3HB   ALA 128          3HB       ALA 128   1.823  10.746  -3.526
  972    H    LEU 129           H        LEU 129   1.699  12.623  -1.839
  973    HA   LEU 129           HA       LEU 129   4.025  14.005  -2.440
  974   1HB   LEU 129          2HB       LEU 129   1.615  14.799  -2.381
  975   2HB   LEU 129          1HB       LEU 129   1.892  15.120  -0.681
  976    HG   LEU 129           HG       LEU 129   2.378  16.806  -2.808
  977   1HD1  LEU 129          1HD1      LEU 129   3.369  18.254  -0.999
  978   2HD1  LEU 129          2HD1      LEU 129   3.217  16.858   0.077
  979   3HD1  LEU 129          3HD1      LEU 129   1.775  17.581  -0.647
  980   1HD2  LEU 129          1HD2      LEU 129   4.981  15.778  -1.736
  981   2HD2  LEU 129          2HD2      LEU 129   4.802  17.336  -2.538
  982   3HD2  LEU 129          3HD2      LEU 129   4.453  15.850  -3.419
  983    H    LYS 130           H        LYS 130   2.520  13.520   0.736
  984    HA   LYS 130           HA       LYS 130   4.480  14.847   2.238
  985   1HB   LYS 130          2HB       LYS 130   2.879  14.546   3.772
  986   2HB   LYS 130          1HB       LYS 130   2.068  13.391   2.728
  987   1HG   LYS 130          2HG       LYS 130   4.208  11.994   3.871
  988   2HG   LYS 130          1HG       LYS 130   3.498  12.948   5.178
  989   1HD   LYS 130          2HD       LYS 130   1.391  11.954   4.915
  990   2HD   LYS 130          1HD       LYS 130   1.788  11.330   3.313
  991   1HE   LYS 130          2HE       LYS 130   3.048   9.586   4.165
  992   2HE   LYS 130          1HE       LYS 130   3.338  10.408   5.699
  993   1HZ   LYS 130          1HZ       LYS 130   0.848  10.139   6.062
  994   2HZ   LYS 130          2HZ       LYS 130   1.800   8.744   6.198
  995   3HZ   LYS 130          3HZ       LYS 130   0.884   9.014   4.792
  996    H    ALA 131           H        ALA 131   4.195  11.555   1.119
  997    HA   ALA 131           HA       ALA 131   6.283  10.495   2.761
  998   1HB   ALA 131          1HB       ALA 131   4.429   9.166   1.680
  999   2HB   ALA 131          2HB       ALA 131   6.050   8.480   1.549
 1000   3HB   ALA 131          3HB       ALA 131   5.329   9.310   0.169
 1001    H    MET 132           H        MET 132   6.177  11.925  -0.466
 1002    HA   MET 132           HA       MET 132   8.899  11.288  -1.057
 1003   1HB   MET 132          2HB       MET 132   8.365  12.012  -3.106
 1004   2HB   MET 132          1HB       MET 132   6.728  12.207  -2.506
 1005   1HG   MET 132          2HG       MET 132   7.307  14.551  -1.896
 1006   2HG   MET 132          1HG       MET 132   8.865  14.317  -2.685
 1007   1HE   MET 132          1HE       MET 132   8.783  13.917  -5.848
 1008   2HE   MET 132          2HE       MET 132   7.310  12.990  -6.130
 1009   3HE   MET 132          3HE       MET 132   8.396  12.542  -4.815
 1010    H    LYS 133           H        LYS 133   7.283  13.810   0.697
 1011    HA   LYS 133           HA       LYS 133   9.610  15.520   0.772
 1012   1HB   LYS 133          2HB       LYS 133   6.825  15.657   1.622
 1013   2HB   LYS 133          1HB       LYS 133   7.924  16.309   2.830
 1014   1HG   LYS 133          2HG       LYS 133   7.339  18.139   1.514
 1015   2HG   LYS 133          1HG       LYS 133   8.936  17.669   0.927
 1016   1HD   LYS 133          2HD       LYS 133   7.782  16.344  -0.863
 1017   2HD   LYS 133          1HD       LYS 133   6.265  17.077  -0.336
 1018   1HE   LYS 133          2HE       LYS 133   6.732  18.696  -1.808
 1019   2HE   LYS 133          1HE       LYS 133   7.904  19.254  -0.616
 1020   1HZ   LYS 133          1HZ       LYS 133   9.266  19.066  -2.391
 1021   2HZ   LYS 133          2HZ       LYS 133   8.338  17.862  -3.141
 1022   3HZ   LYS 133          3HZ       LYS 133   9.377  17.458  -1.860
 1023    H    GLN 134           H        GLN 134   7.916  13.355   2.997
 1024    HA   GLN 134           HA       GLN 134   9.809  13.859   5.114
 1025   1HB   GLN 134          2HB       GLN 134   7.188  12.694   4.876
 1026   2HB   GLN 134          1HB       GLN 134   8.244  11.628   5.792
 1027   1HG   GLN 134          2HG       GLN 134   7.284  12.977   7.410
 1028   2HG   GLN 134          1HG       GLN 134   8.864  13.710   7.141
 1029   1HE2  GLN 134          1HE2      GLN 134   6.355  14.060   4.786
 1030   2HE2  GLN 134          2HE2      GLN 134   5.997  15.724   5.101
 1031    H    TYR 135           H        TYR 135   8.812  10.883   3.390
 1032    HA   TYR 135           HA       TYR 135  10.898   9.373   4.612
 1033   1HB   TYR 135          2HB       TYR 135   8.572   8.643   3.541
 1034   2HB   TYR 135          1HB       TYR 135   9.590   8.380   2.129
 1035    HD1  TYR 135           1HD      TYR 135   8.139   6.158   3.341
 1036    HD2  TYR 135           2HD      TYR 135  11.956   7.757   4.316
 1037    HE1  TYR 135           1HE      TYR 135   8.818   3.968   4.238
 1038    HE2  TYR 135           2HE      TYR 135  12.653   5.572   5.215
 1039    HH   TYR 135           HH       TYR 135  10.481   3.116   5.925
 1040    H    LYS 136           H        LYS 136  10.443  10.683   1.329
 1041    HA   LYS 136           HA       LYS 136  12.922   9.574   0.443
 1042   1HB   LYS 136          2HB       LYS 136  11.021  10.075  -1.092
 1043   2HB   LYS 136          1HB       LYS 136  11.352  11.790  -0.869
 1044   1HG   LYS 136          2HG       LYS 136  12.334  10.921  -2.934
 1045   2HG   LYS 136          1HG       LYS 136  13.558  11.521  -1.805
 1046   1HD   LYS 136          2HD       LYS 136  14.204   9.328  -1.203
 1047   2HD   LYS 136          1HD       LYS 136  12.798   8.618  -1.997
 1048   1HE   LYS 136          2HE       LYS 136  14.671  10.225  -3.651
 1049   2HE   LYS 136          1HE       LYS 136  15.200   8.627  -3.125
 1050   1HZ   LYS 136          1HZ       LYS 136  12.548   8.525  -4.120
 1051   2HZ   LYS 136          2HZ       LYS 136  13.922   7.683  -4.654
 1052   3HZ   LYS 136          3HZ       LYS 136  13.574   9.229  -5.271
 1053    H    GLY 137           H        GLY 137  14.864  10.299   0.718
 1054   1HA   GLY 137          2HA       GLY 137  16.426  12.194   0.740
 1055   2HA   GLY 137          1HA       GLY 137  15.211  13.077   1.662
 1056    H    VAL 138           H        VAL 138  14.799  10.228   2.911
 1057    HA   VAL 138           HA       VAL 138  16.411  10.769   5.241
 1058    HB   VAL 138           HB       VAL 138  14.511   8.510   4.608
 1059   1HG1  VAL 138          1HG1      VAL 138  15.009   8.767   7.400
 1060   2HG1  VAL 138          2HG1      VAL 138  16.552   8.573   6.569
 1061   3HG1  VAL 138          3HG1      VAL 138  15.278   7.373   6.354
 1062   1HG2  VAL 138          1HG2      VAL 138  13.031  10.127   5.066
 1063   2HG2  VAL 138          2HG2      VAL 138  14.253  11.174   5.788
 1064   3HG2  VAL 138          3HG2      VAL 138  13.517   9.888   6.744
 1065    HA   PRO 139           HA       PRO 139  19.773   8.149   3.830
 1066   1HB   PRO 139          2HB       PRO 139  21.156   9.180   6.174
 1067   2HB   PRO 139          1HB       PRO 139  21.539   9.424   4.469
 1068   1HG   PRO 139          2HG       PRO 139  20.630  11.412   6.082
 1069   2HG   PRO 139          1HG       PRO 139  20.322  11.362   4.337
 1070   1HD   PRO 139          2HD       PRO 139  18.523  10.590   6.606
 1071   2HD   PRO 139          1HD       PRO 139  18.138  11.475   5.113
 1072    H    LEU 140           H        LEU 140  19.688   6.011   4.381
 1073    HA   LEU 140           HA       LEU 140  19.062   5.426   7.183
 1074   1HB   LEU 140          2HB       LEU 140  17.694   4.552   4.700
 1075   2HB   LEU 140          1HB       LEU 140  17.906   3.340   5.948
 1076    HG   LEU 140           HG       LEU 140  16.335   5.898   6.090
 1077   1HD1  LEU 140          1HD1      LEU 140  14.991   4.187   5.272
 1078   2HD1  LEU 140          2HD1      LEU 140  14.653   4.185   7.003
 1079   3HD1  LEU 140          3HD1      LEU 140  15.734   2.974   6.313
 1080   1HD2  LEU 140          1HD2      LEU 140  17.904   5.290   8.134
 1081   2HD2  LEU 140          2HD2      LEU 140  16.594   4.162   8.485
 1082   3HD2  LEU 140          3HD2      LEU 140  16.260   5.889   8.367
 1083    H    ASP 141           H        ASP 141  20.607   4.250   8.058
 1084    HA   ASP 141           HA       ASP 141  22.606   3.176   8.257
 1085   1HB   ASP 141          2HB       ASP 141  20.906   1.335   7.809
 1086   2HB   ASP 141          1HB       ASP 141  21.517   1.305   6.157
 1087    H    GLY 142           H        GLY 142  23.801   4.936   7.285
 1088   1HA   GLY 142          2HA       GLY 142  25.780   5.219   6.063
 1089   2HA   GLY 142          1HA       GLY 142  25.280   3.924   4.985
 1090    H    ARG 143           H        ARG 143  23.019   4.607   3.815
 1091    HA   ARG 143           HA       ARG 143  23.397   7.341   2.820
 1092   1HB   ARG 143          2HB       ARG 143  24.338   5.088   1.497
 1093   2HB   ARG 143          1HB       ARG 143  22.792   5.400   0.722
 1094   1HG   ARG 143          2HG       ARG 143  24.135   6.671  -0.589
 1095   2HG   ARG 143          1HG       ARG 143  23.729   7.866   0.646
 1096   1HD   ARG 143          2HD       ARG 143  26.015   8.092   0.525
 1097   2HD   ARG 143          1HD       ARG 143  25.848   6.930   1.840
 1098    HE   ARG 143           HE       ARG 143  26.874   5.356   0.547
 1099   1HH1  ARG 143          1HH1      ARG 143  25.907   8.045  -1.482
 1100   2HH1  ARG 143          2HH1      ARG 143  26.678   7.416  -2.908
 1101   1HH2  ARG 143          1HH2      ARG 143  27.890   4.521  -1.321
 1102   2HH2  ARG 143          2HH2      ARG 143  27.818   5.417  -2.812
 1103    HA   PRO 144           HA       PRO 144  18.975   7.666   2.811
 1104   1HB   PRO 144          2HB       PRO 144  18.606   8.735   0.260
 1105   2HB   PRO 144          1HB       PRO 144  18.911   9.658   1.735
 1106   1HG   PRO 144          2HG       PRO 144  20.813   8.803  -0.399
 1107   2HG   PRO 144          1HG       PRO 144  20.763  10.319   0.523
 1108   1HD   PRO 144          2HD       PRO 144  22.556   8.424   1.090
 1109   2HD   PRO 144          1HD       PRO 144  21.779   9.361   2.384
 1110    H    MET 145           H        MET 145  17.311   6.393   2.316
 1111    HA   MET 145           HA       MET 145  17.763   4.253   0.399
 1112   1HB   MET 145          2HB       MET 145  16.100   3.047   1.467
 1113   2HB   MET 145          1HB       MET 145  16.751   3.999   2.789
 1114   1HG   MET 145          2HG       MET 145  14.904   5.529   2.665
 1115   2HG   MET 145          1HG       MET 145  14.284   4.728   1.220
 1116   1HE   MET 145          1HE       MET 145  12.512   2.430   1.510
 1117   2HE   MET 145          2HE       MET 145  13.312   1.240   2.539
 1118   3HE   MET 145          3HE       MET 145  14.229   2.087   1.293
 1119    H    ASP 146           H        ASP 146  15.679   3.618  -0.874
 1120    HA   ASP 146           HA       ASP 146  15.050   6.054  -2.389
 1121   1HB   ASP 146          2HB       ASP 146  16.205   4.058  -3.493
 1122   2HB   ASP 146          1HB       ASP 146  14.639   3.253  -3.404
 1123    H    ILE 147           H        ILE 147  13.155   6.849  -2.467
 1124    HA   ILE 147           HA       ILE 147  10.775   5.176  -2.201
 1125    HB   ILE 147           HB       ILE 147  10.055   7.612  -1.027
 1126   1HG1  ILE 147          2HG1      ILE 147  12.748   7.523  -0.692
 1127   2HG1  ILE 147          1HG1      ILE 147  11.642   8.333   0.409
 1128   1HG2  ILE 147          1HG2      ILE 147   9.334   6.320   0.752
 1129   2HG2  ILE 147          2HG2      ILE 147  10.678   5.181   0.595
 1130   3HG2  ILE 147          3HG2      ILE 147   9.368   5.175  -0.590
 1131   1HD1  ILE 147          1HD1      ILE 147  12.518   5.486   0.771
 1132   2HD1  ILE 147          2HD1      ILE 147  11.707   6.535   1.934
 1133   3HD1  ILE 147          3HD1      ILE 147  13.375   6.864   1.462
 1134    H    GLN 148           H        GLN 148  10.035   5.410  -4.224
 1135    HA   GLN 148           HA       GLN 148   9.940   8.120  -5.371
 1136   1HB   GLN 148          2HB       GLN 148  10.958   5.864  -6.506
 1137   2HB   GLN 148          1HB       GLN 148   9.303   5.809  -7.098
 1138   1HG   GLN 148          2HG       GLN 148   9.638   7.478  -8.531
 1139   2HG   GLN 148          1HG       GLN 148  10.517   8.443  -7.345
 1140   1HE2  GLN 148          1HE2      GLN 148  10.897   5.563  -9.371
 1141   2HE2  GLN 148          2HE2      GLN 148  12.562   5.836  -9.749
 1142    H    LEU 149           H        LEU 149   7.992   9.066  -5.591
 1143    HA   LEU 149           HA       LEU 149   5.650   7.334  -5.296
 1144   1HB   LEU 149          2HB       LEU 149   6.132  10.025  -4.036
 1145   2HB   LEU 149          1HB       LEU 149   4.571   9.215  -4.060
 1146    HG   LEU 149           HG       LEU 149   6.398   7.322  -3.082
 1147   1HD1  LEU 149          1HD1      LEU 149   7.507   9.807  -2.632
 1148   2HD1  LEU 149          2HD1      LEU 149   7.899   8.307  -1.791
 1149   3HD1  LEU 149          3HD1      LEU 149   6.703   9.412  -1.112
 1150   1HD2  LEU 149          1HD2      LEU 149   3.909   8.064  -2.529
 1151   2HD2  LEU 149          2HD2      LEU 149   4.732   8.851  -1.181
 1152   3HD2  LEU 149          3HD2      LEU 149   4.889   7.110  -1.417
 1153    H    VAL 150           H        VAL 150   4.514   7.331  -7.002
 1154    HA   VAL 150           HA       VAL 150   4.791   9.541  -8.926
 1155    HB   VAL 150           HB       VAL 150   3.725   6.785  -9.535
 1156   1HG1  VAL 150          1HG1      VAL 150   4.066   7.318 -11.792
 1157   2HG1  VAL 150          2HG1      VAL 150   5.092   8.700 -11.402
 1158   3HG1  VAL 150          3HG1      VAL 150   3.357   8.773 -11.093
 1159   1HG2  VAL 150          1HG2      VAL 150   5.769   5.886  -9.623
 1160   2HG2  VAL 150          2HG2      VAL 150   6.289   7.264  -8.652
 1161   3HG2  VAL 150          3HG2      VAL 150   6.454   7.311 -10.408
 1162    H    ALA 151           H        ALA 151   3.142  10.796  -9.367
 1163    HA   ALA 151           HA       ALA 151   1.053  11.509  -9.864
 1164   1HB   ALA 151          1HB       ALA 151   0.643   8.612  -9.786
 1165   2HB   ALA 151          2HB       ALA 151   0.059   9.814 -10.938
 1166   3HB   ALA 151          3HB       ALA 151  -0.797   9.560  -9.417
 1167    H    SER 152           H        SER 152   1.960  12.365  -7.583
 1168    HA   SER 152           HA       SER 152  -0.097  11.882  -5.566
 1169   1HB   SER 152          2HB       SER 152   1.843  13.830  -4.756
 1170   2HB   SER 152          1HB       SER 152   1.580  12.214  -4.102
 1171    HG   SER 152           HG       SER 152   3.365  13.063  -6.110
 1172    H    GLN 153           H        GLN 153   1.531  14.497  -7.332
 1173    HA   GLN 153           HA       GLN 153  -0.741  16.263  -6.860
 1174   1HB   GLN 153          2HB       GLN 153   2.039  16.650  -7.371
 1175   2HB   GLN 153          1HB       GLN 153   1.123  17.391  -8.677
 1176   1HG   GLN 153          2HG       GLN 153   1.649  18.905  -6.764
 1177   2HG   GLN 153          1HG       GLN 153  -0.062  18.789  -7.177
 1178   1HE2  GLN 153          1HE2      GLN 153  -1.266  18.825  -5.430
 1179   2HE2  GLN 153          2HE2      GLN 153  -0.916  18.027  -3.930
 1180    H    ILE 154           H        ILE 154  -1.901  14.487  -8.085
 1181    HA   ILE 154           HA       ILE 154  -1.588  14.373 -10.930
 1182    HB   ILE 154           HB       ILE 154  -4.108  13.397 -10.488
 1183   1HG1  ILE 154          2HG1      ILE 154  -3.409  11.845  -8.397
 1184   2HG1  ILE 154          1HG1      ILE 154  -2.587  13.333  -7.937
 1185   1HG2  ILE 154          1HG2      ILE 154  -1.859  11.545  -9.981
 1186   2HG2  ILE 154          2HG2      ILE 154  -1.812  12.479 -11.478
 1187   3HG2  ILE 154          3HG2      ILE 154  -3.189  11.432 -11.136
 1188   1HD1  ILE 154          1HD1      ILE 154  -5.523  13.047  -8.539
 1189   2HD1  ILE 154          2HD1      ILE 154  -4.704  14.542  -8.086
 1190   3HD1  ILE 154          3HD1      ILE 154  -4.794  13.204  -6.942
 1191    H    ASP 155           H        ASP 155  -1.673  16.880 -10.677
 1192    HA   ASP 155           HA       ASP 155  -4.406  17.748 -11.360
 1193   1HB   ASP 155          2HB       ASP 155  -3.626  18.760  -9.257
 1194   2HB   ASP 155          1HB       ASP 155  -2.182  19.351 -10.072
 1195    H    LEU 156           H        LEU 156  -0.955  18.296 -11.863
 1196    HA   LEU 156           HA       LEU 156  -1.283  19.685 -14.336
 1197   1HB   LEU 156          2HB       LEU 156   1.134  18.249 -13.220
 1198   2HB   LEU 156          1HB       LEU 156   1.146  19.349 -14.583
 1199    HG   LEU 156           HG       LEU 156   1.928  20.721 -12.920
 1200   1HD1  LEU 156          1HD1      LEU 156  -0.250  21.582 -13.910
 1201   2HD1  LEU 156          2HD1      LEU 156   0.305  22.328 -12.412
 1202   3HD1  LEU 156          3HD1      LEU 156  -0.992  21.134 -12.374
 1203   1HD2  LEU 156          1HD2      LEU 156   0.045  19.376 -10.987
 1204   2HD2  LEU 156          2HD2      LEU 156   1.172  20.674 -10.587
 1205   3HD2  LEU 156          3HD2      LEU 156   1.785  19.108 -11.118
 1206    H    GLU 157           H        GLU 157   0.328  16.563 -13.747
 1207    HA   GLU 157           HA       GLU 157  -0.667  15.499 -16.247
 1208   1HB   GLU 157          2HB       GLU 157   1.158  14.517 -14.082
 1209   2HB   GLU 157          1HB       GLU 157   0.434  13.352 -15.185
 1210   1HG   GLU 157          2HG       GLU 157   1.563  14.181 -17.016
 1211   2HG   GLU 157          1HG       GLU 157   1.834  15.752 -16.262
 1212    H    HIS 158           H        HIS 158  -2.042  13.595 -16.349
 1213    HA   HIS 158           HA       HIS 158  -3.702  13.239 -13.947
 1214   1HB   HIS 158          2HB       HIS 158  -4.547  14.137 -16.657
 1215   2HB   HIS 158          1HB       HIS 158  -5.605  13.009 -15.813
 1216    HD1  HIS 158           1HD      HIS 158  -5.577  16.365 -16.421
 1217    HD2  HIS 158           2HD      HIS 158  -5.680  14.218 -12.857
 1218    HE1  HIS 158           1HE      HIS 158  -6.530  17.942 -14.702
 1219    HE2  HIS 158           2HE      HIS 158  -6.510  16.651 -12.534
  Start of MODEL    8
    1    H    MET   1           H        MET   1 -39.413  17.436-152.315
    2    HA   MET   1           HA       MET   1 -37.572  16.066-150.490
    3   1HB   MET   1          2HB       MET   1 -39.196  16.088-148.867
    4   2HB   MET   1          1HB       MET   1 -39.595  17.558-149.742
    5   1HG   MET   1          2HG       MET   1 -41.470  16.604-150.733
    6   2HG   MET   1          1HG       MET   1 -40.924  14.961-150.406
    7   1HE   MET   1          1HE       MET   1 -39.844  15.888-147.381
    8   2HE   MET   1          2HE       MET   1 -40.511  14.270-147.612
    9   3HE   MET   1          3HE       MET   1 -41.152  15.317-146.345
   10    H    ALA   2           H        ALA   2 -40.177  15.494-152.782
   11    HA   ALA   2           HA       ALA   2 -40.946  13.615-153.812
   12   1HB   ALA   2          1HB       ALA   2 -38.073  12.839-153.375
   13   2HB   ALA   2          2HB       ALA   2 -38.806  13.528-154.824
   14   3HB   ALA   2          3HB       ALA   2 -39.202  11.881-154.333
   15    H    ASP   3           H        ASP   3 -41.740  13.710-151.255
   16    HA   ASP   3           HA       ASP   3 -41.885  10.886-150.527
   17   1HB   ASP   3          2HB       ASP   3 -40.254  11.491-148.961
   18   2HB   ASP   3          1HB       ASP   3 -40.903  13.113-148.766
   19    H    LYS   4           H        LYS   4 -42.907  13.976-149.114
   20    HA   LYS   4           HA       LYS   4 -44.935  14.843-148.597
   21   1HB   LYS   4          2HB       LYS   4 -45.407  13.450-151.195
   22   2HB   LYS   4          1HB       LYS   4 -46.795  14.098-150.329
   23   1HG   LYS   4          2HG       LYS   4 -44.427  15.589-151.415
   24   2HG   LYS   4          1HG       LYS   4 -46.125  15.758-151.861
   25   1HD   LYS   4          2HD       LYS   4 -45.761  16.189-149.035
   26   2HD   LYS   4          1HD       LYS   4 -44.708  17.254-149.971
   27   1HE   LYS   4          2HE       LYS   4 -46.582  18.106-151.211
   28   2HE   LYS   4          1HE       LYS   4 -47.664  16.933-150.461
   29   1HZ   LYS   4          1HZ       LYS   4 -46.595  19.421-149.399
   30   2HZ   LYS   4          2HZ       LYS   4 -46.708  18.133-148.304
   31   3HZ   LYS   4          3HZ       LYS   4 -48.093  18.674-149.123
   32    H    MET   5           H        MET   5 -44.212  12.537-147.184
   33    HA   MET   5           HA       MET   5 -46.848  11.556-146.420
   34   1HB   MET   5          2HB       MET   5 -46.240   9.877-148.004
   35   2HB   MET   5          1HB       MET   5 -44.602   9.786-147.378
   36   1HG   MET   5          2HG       MET   5 -46.212   9.175-145.201
   37   2HG   MET   5          1HG       MET   5 -46.973   8.361-146.566
   38   1HE   MET   5          1HE       MET   5 -43.580   6.621-147.959
   39   2HE   MET   5          2HE       MET   5 -43.430   8.374-147.828
   40   3HE   MET   5          3HE       MET   5 -44.907   7.662-148.479
   41    H    ASP   6           H        ASP   6 -43.356  11.146-145.841
   42    HA   ASP   6           HA       ASP   6 -43.868  10.856-142.979
   43   1HB   ASP   6          2HB       ASP   6 -41.942   9.808-144.738
   44   2HB   ASP   6          1HB       ASP   6 -41.067  10.929-143.702
   45    H    MET   7           H        MET   7 -41.960  12.862-145.173
   46    HA   MET   7           HA       MET   7 -41.082  14.924-145.046
   47   1HB   MET   7          2HB       MET   7 -42.632  16.400-144.664
   48   2HB   MET   7          1HB       MET   7 -43.614  15.181-143.859
   49   1HG   MET   7          2HG       MET   7 -42.442  15.727-141.761
   50   2HG   MET   7          1HG       MET   7 -41.587  17.005-142.614
   51   1HE   MET   7          1HE       MET   7 -44.042  17.735-144.616
   52   2HE   MET   7          2HE       MET   7 -43.076  19.046-143.938
   53   3HE   MET   7          3HE       MET   7 -44.835  19.090-143.809
   54    H    SER   8           H        SER   8 -39.699  16.314-143.963
   55    HA   SER   8           HA       SER   8 -37.660  16.428-142.929
   56   1HB   SER   8          2HB       SER   8 -39.114  15.590-140.431
   57   2HB   SER   8          1HB       SER   8 -37.809  16.763-140.598
   58    HG   SER   8           HG       SER   8 -40.288  17.352-140.457
   59    H    LEU   9           H        LEU   9 -37.657  14.156-144.239
   60    HA   LEU   9           HA       LEU   9 -37.670  11.735-142.849
   61   1HB   LEU   9          2HB       LEU   9 -36.053  12.366-145.313
   62   2HB   LEU   9          1HB       LEU   9 -36.595  10.784-144.786
   63    HG   LEU   9           HG       LEU   9 -38.888  12.452-145.069
   64   1HD1  LEU   9          1HD1      LEU   9 -38.781  13.039-147.402
   65   2HD1  LEU   9          2HD1      LEU   9 -37.151  12.374-147.531
   66   3HD1  LEU   9          3HD1      LEU   9 -37.444  13.809-146.547
   67   1HD2  LEU   9          1HD2      LEU   9 -39.001  10.079-145.241
   68   2HD2  LEU   9          2HD2      LEU   9 -37.824  10.060-146.555
   69   3HD2  LEU   9          3HD2      LEU   9 -39.428  10.745-146.817
   70    H    ASP  10           H        ASP  10 -34.987  13.911-143.631
   71    HA   ASP  10           HA       ASP  10 -32.926  12.258-142.631
   72   1HB   ASP  10          2HB       ASP  10 -32.170  13.968-144.019
   73   2HB   ASP  10          1HB       ASP  10 -33.177  15.183-143.240
   74    H    ASP  11           H        ASP  11 -34.883  14.788-141.139
   75    HA   ASP  11           HA       ASP  11 -33.584  14.829-138.637
   76   1HB   ASP  11          2HB       ASP  11 -35.071  16.631-139.283
   77   2HB   ASP  11          1HB       ASP  11 -36.434  15.522-139.376
   78    H    ILE  12           H        ILE  12 -36.317  12.941-139.868
   79    HA   ILE  12           HA       ILE  12 -37.040  11.592-137.540
   80    HB   ILE  12           HB       ILE  12 -36.978  10.495-140.353
   81   1HG1  ILE  12          2HG1      ILE  12 -39.381  11.521-138.847
   82   2HG1  ILE  12          1HG1      ILE  12 -38.379  12.586-139.831
   83   1HG2  ILE  12          1HG2      ILE  12 -37.437   9.155-137.910
   84   2HG2  ILE  12          2HG2      ILE  12 -37.691   8.549-139.551
   85   3HG2  ILE  12          3HG2      ILE  12 -39.010   9.346-138.695
   86   1HD1  ILE  12          1HD1      ILE  12 -38.818  11.074-141.763
   87   2HD1  ILE  12          2HD1      ILE  12 -40.239  11.912-141.140
   88   3HD1  ILE  12          3HD1      ILE  12 -39.973  10.212-140.748
   89    H    ILE  13           H        ILE  13 -34.713  10.612-140.038
   90    HA   ILE  13           HA       ILE  13 -33.757   8.274-138.946
   91    HB   ILE  13           HB       ILE  13 -32.090  10.377-140.331
   92   1HG1  ILE  13          2HG1      ILE  13 -33.266   7.953-141.658
   93   2HG1  ILE  13          1HG1      ILE  13 -34.243   9.404-141.456
   94   1HG2  ILE  13          1HG2      ILE  13 -30.497   8.713-140.785
   95   2HG2  ILE  13          2HG2      ILE  13 -31.585   7.416-140.292
   96   3HG2  ILE  13          3HG2      ILE  13 -30.900   8.502-139.082
   97   1HD1  ILE  13          1HD1      ILE  13 -33.032   9.121-143.659
   98   2HD1  ILE  13          2HD1      ILE  13 -31.549   9.465-142.768
   99   3HD1  ILE  13          3HD1      ILE  13 -32.835  10.669-142.837
  100    H    LYS  14           H        LYS  14 -32.617  11.561-138.279
  101    HA   LYS  14           HA       LYS  14 -30.646  10.898-136.397
  102   1HB   LYS  14          2HB       LYS  14 -32.351  13.391-136.412
  103   2HB   LYS  14          1HB       LYS  14 -30.755  13.210-135.697
  104   1HG   LYS  14          2HG       LYS  14 -31.291  12.910-138.639
  105   2HG   LYS  14          1HG       LYS  14 -30.831  14.434-137.878
  106   1HD   LYS  14          2HD       LYS  14 -29.183  11.972-137.459
  107   2HD   LYS  14          1HD       LYS  14 -29.001  12.926-138.933
  108   1HE   LYS  14          2HE       LYS  14 -28.363  13.654-136.108
  109   2HE   LYS  14          1HE       LYS  14 -27.406  13.886-137.572
  110   1HZ   LYS  14          1HZ       LYS  14 -29.200  15.545-138.227
  111   2HZ   LYS  14          2HZ       LYS  14 -28.138  16.010-136.987
  112   3HZ   LYS  14          3HZ       LYS  14 -29.703  15.483-136.609
  113    H    LEU  15           H        LEU  15 -33.991  11.995-135.866
  114    HA   LEU  15           HA       LEU  15 -33.936  11.774-133.061
  115   1HB   LEU  15          2HB       LEU  15 -35.746  12.613-135.031
  116   2HB   LEU  15          1HB       LEU  15 -36.575  11.349-134.143
  117    HG   LEU  15           HG       LEU  15 -35.221  13.465-132.555
  118   1HD1  LEU  15          1HD1      LEU  15 -37.544  13.911-134.367
  119   2HD1  LEU  15          2HD1      LEU  15 -36.216  14.994-133.946
  120   3HD1  LEU  15          3HD1      LEU  15 -37.516  14.702-132.791
  121   1HD2  LEU  15          1HD2      LEU  15 -36.355  12.391-130.977
  122   2HD2  LEU  15          2HD2      LEU  15 -37.163  11.390-132.182
  123   3HD2  LEU  15          3HD2      LEU  15 -37.853  12.947-131.723
  124    H    ASN  16           H        ASN  16 -34.441   9.402-135.532
  125    HA   ASN  16           HA       ASN  16 -35.718   7.514-133.770
  126   1HB   ASN  16          2HB       ASN  16 -35.004   7.596-136.638
  127   2HB   ASN  16          1HB       ASN  16 -35.051   5.999-135.892
  128   1HD2  ASN  16          1HD2      ASN  16 -36.937   8.996-135.880
  129   2HD2  ASN  16          2HD2      ASN  16 -38.489   8.229-136.012
  130    H    ARG  17           H        ARG  17 -32.567   7.742-135.427
  131    HA   ARG  17           HA       ARG  17 -31.568   5.352-134.251
  132   1HB   ARG  17          2HB       ARG  17 -29.563   5.777-135.378
  133   2HB   ARG  17          1HB       ARG  17 -30.790   6.491-136.412
  134   1HG   ARG  17          2HG       ARG  17 -30.202   8.661-135.037
  135   2HG   ARG  17          1HG       ARG  17 -28.685   7.801-134.775
  136   1HD   ARG  17          2HD       ARG  17 -29.933   8.590-137.401
  137   2HD   ARG  17          1HD       ARG  17 -28.417   9.168-136.712
  138    HE   ARG  17           HE       ARG  17 -28.846   6.734-138.187
  139   1HH1  ARG  17          1HH1      ARG  17 -26.768   8.384-135.891
  140   2HH1  ARG  17          2HH1      ARG  17 -25.423   7.312-136.152
  141   1HH2  ARG  17          1HH2      ARG  17 -27.075   5.374-138.570
  142   2HH2  ARG  17          2HH2      ARG  17 -25.584   5.616-137.708
  143    H    ASN  18           H        ASN  18 -31.599   8.686-133.260
  144    HA   ASN  18           HA       ASN  18 -29.736   8.105-131.070
  145   1HB   ASN  18          2HB       ASN  18 -29.590  10.191-132.632
  146   2HB   ASN  18          1HB       ASN  18 -30.889  10.822-131.623
  147   1HD2  ASN  18          1HD2      ASN  18 -27.674   9.357-131.402
  148   2HD2  ASN  18          2HD2      ASN  18 -27.161  10.294-130.033
  149    H    GLN  19           H        GLN  19 -32.729   7.411-131.414
  150    HA   GLN  19           HA       GLN  19 -34.167   8.798-129.427
  151   1HB   GLN  19          2HB       GLN  19 -34.851   6.967-131.270
  152   2HB   GLN  19          1HB       GLN  19 -34.764   5.923-129.857
  153   1HG   GLN  19          2HG       GLN  19 -36.202   8.038-128.913
  154   2HG   GLN  19          1HG       GLN  19 -36.737   7.941-130.590
  155   1HE2  GLN  19          1HE2      GLN  19 -38.769   7.233-130.114
  156   2HE2  GLN  19          2HE2      GLN  19 -39.107   5.659-129.476
  157    H    ARG  20           H        ARG  20 -32.183   5.886-129.326
  158    HA   ARG  20           HA       ARG  20 -32.080   6.158-126.407
  159   1HB   ARG  20          2HB       ARG  20 -32.891   3.820-128.007
  160   2HB   ARG  20          1HB       ARG  20 -31.738   3.482-126.723
  161   1HG   ARG  20          2HG       ARG  20 -33.426   3.422-125.297
  162   2HG   ARG  20          1HG       ARG  20 -33.677   5.147-125.583
  163   1HD   ARG  20          2HD       ARG  20 -35.738   4.407-126.178
  164   2HD   ARG  20          1HD       ARG  20 -34.928   4.194-127.731
  165    HE   ARG  20           HE       ARG  20 -35.157   1.980-125.798
  166   1HH1  ARG  20          1HH1      ARG  20 -35.726   3.319-128.991
  167   2HH1  ARG  20          2HH1      ARG  20 -36.172   1.794-129.696
  168   1HH2  ARG  20          1HH2      ARG  20 -35.754  -0.029-126.714
  169   2HH2  ARG  20          2HH2      ARG  20 -36.199  -0.113-128.397
  170    H    ARG  21           H        ARG  21 -30.095   6.953-126.173
  171    HA   ARG  21           HA       ARG  21 -27.837   5.854-127.630
  172   1HB   ARG  21          2HB       ARG  21 -27.863   7.830-125.337
  173   2HB   ARG  21          1HB       ARG  21 -26.500   7.472-126.388
  174   1HG   ARG  21          2HG       ARG  21 -27.329   8.696-128.118
  175   2HG   ARG  21          1HG       ARG  21 -29.010   8.419-127.654
  176   1HD   ARG  21          2HD       ARG  21 -28.109   9.845-125.530
  177   2HD   ARG  21          1HD       ARG  21 -27.141  10.532-126.832
  178    HE   ARG  21           HE       ARG  21 -29.385  10.845-127.989
  179   1HH1  ARG  21          1HH1      ARG  21 -28.962  10.953-124.508
  180   2HH1  ARG  21          2HH1      ARG  21 -30.324  12.006-124.253
  181   1HH2  ARG  21          1HH2      ARG  21 -31.186  12.211-127.651
  182   2HH2  ARG  21          2HH2      ARG  21 -31.612  12.692-126.032
  183    H    VAL  22           H        VAL  22 -28.949   6.029-124.274
  184    HA   VAL  22           HA       VAL  22 -27.763   3.411-123.765
  185    HB   VAL  22           HB       VAL  22 -27.156   4.343-121.409
  186   1HG1  VAL  22          1HG1      VAL  22 -25.315   3.545-122.455
  187   2HG1  VAL  22          2HG1      VAL  22 -24.918   5.261-122.538
  188   3HG1  VAL  22          3HG1      VAL  22 -25.626   4.453-123.936
  189   1HG2  VAL  22          1HG2      VAL  22 -27.807   6.775-122.843
  190   2HG2  VAL  22          2HG2      VAL  22 -26.166   6.811-122.198
  191   3HG2  VAL  22          3HG2      VAL  22 -27.532   6.520-121.119
  192    H    ASN  23           H        ASN  23 -29.024   2.152-122.454
  193    HA   ASN  23           HA       ASN  23 -31.678   3.043-121.892
  194   1HB   ASN  23          2HB       ASN  23 -30.734   0.613-122.347
  195   2HB   ASN  23          1HB       ASN  23 -30.559   0.592-120.594
  196   1HD2  ASN  23          1HD2      ASN  23 -32.167  -0.590-119.824
  197   2HD2  ASN  23          2HD2      ASN  23 -33.833  -0.432-120.254
  198    H    ARG  24           H        ARG  24 -28.810   2.388-119.947
  199    HA   ARG  24           HA       ARG  24 -28.127   3.132-117.922
  200   1HB   ARG  24          2HB       ARG  24 -28.770   5.325-119.048
  201   2HB   ARG  24          1HB       ARG  24 -30.265   5.250-118.126
  202   1HG   ARG  24          2HG       ARG  24 -28.685   5.011-116.080
  203   2HG   ARG  24          1HG       ARG  24 -27.473   5.686-117.171
  204   1HD   ARG  24          2HD       ARG  24 -28.511   7.466-115.908
  205   2HD   ARG  24          1HD       ARG  24 -28.966   7.596-117.608
  206    HE   ARG  24           HE       ARG  24 -31.011   6.184-116.580
  207   1HH1  ARG  24          1HH1      ARG  24 -29.470   9.169-115.577
  208   2HH1  ARG  24          2HH1      ARG  24 -30.917   9.816-114.862
  209   1HH2  ARG  24          1HH2      ARG  24 -32.911   7.027-115.611
  210   2HH2  ARG  24          2HH2      ARG  24 -32.862   8.600-114.863
  211    H    GLY  25           H        GLY  25 -29.266   1.027-117.347
  212   1HA   GLY  25          2HA       GLY  25 -31.484   1.576-115.473
  213   2HA   GLY  25          1HA       GLY  25 -31.236   0.038-116.289
  214    H    GLY  26           H        GLY  26 -29.533  -1.319-115.620
  215   1HA   GLY  26          2HA       GLY  26 -28.018  -2.231-114.148
  216   2HA   GLY  26          1HA       GLY  26 -27.801  -0.628-113.458
  217    H    GLY  27           H        GLY  27 -28.651  -0.204-111.528
  218   1HA   GLY  27          2HA       GLY  27 -30.899  -1.723-110.502
  219   2HA   GLY  27          1HA       GLY  27 -29.371  -2.002-109.675
  220    HA   PRO  28           HA       PRO  28 -30.584   2.579-108.908
  221   1HB   PRO  28          2HB       PRO  28 -33.079   3.364-109.499
  222   2HB   PRO  28          1HB       PRO  28 -31.809   3.303-110.727
  223   1HG   PRO  28          2HG       PRO  28 -34.018   1.363-110.188
  224   2HG   PRO  28          1HG       PRO  28 -33.391   1.943-111.741
  225   1HD   PRO  28          2HD       PRO  28 -32.715  -0.466-110.594
  226   2HD   PRO  28          1HD       PRO  28 -31.703   0.403-111.765
  227    H    ARG  29           H        ARG  29 -30.694   0.631-107.069
  228    HA   ARG  29           HA       ARG  29 -32.695   1.648-105.215
  229   1HB   ARG  29          2HB       ARG  29 -33.089  -0.796-106.511
  230   2HB   ARG  29          1HB       ARG  29 -32.473  -1.228-104.922
  231   1HG   ARG  29          2HG       ARG  29 -34.783  -1.181-104.653
  232   2HG   ARG  29          1HG       ARG  29 -34.238   0.366-103.999
  233   1HD   ARG  29          2HD       ARG  29 -34.700   1.320-106.311
  234   2HD   ARG  29          1HD       ARG  29 -35.556  -0.183-106.642
  235    HE   ARG  29           HE       ARG  29 -36.826   0.499-104.473
  236   1HH1  ARG  29          1HH1      ARG  29 -35.678   2.655-106.982
  237   2HH1  ARG  29          2HH1      ARG  29 -36.979   3.792-106.784
  238   1HH2  ARG  29          1HH2      ARG  29 -38.521   2.003-104.182
  239   2HH2  ARG  29          2HH2      ARG  29 -38.572   3.443-105.161
  240    H    ARG  30           H        ARG  30 -32.154   1.250-102.994
  241    HA   ARG  30           HA       ARG  30 -29.501   0.134-102.492
  242   1HB   ARG  30          2HB       ARG  30 -30.205   2.963-102.388
  243   2HB   ARG  30          1HB       ARG  30 -29.535   2.375-100.873
  244   1HG   ARG  30          2HG       ARG  30 -27.821   1.307-102.703
  245   2HG   ARG  30          1HG       ARG  30 -28.243   2.853-103.442
  246   1HD   ARG  30          2HD       ARG  30 -27.792   3.803-101.059
  247   2HD   ARG  30          1HD       ARG  30 -26.889   2.303-100.834
  248    HE   ARG  30           HE       ARG  30 -26.099   4.578-102.375
  249   1HH1  ARG  30          1HH1      ARG  30 -25.770   1.106-102.037
  250   2HH1  ARG  30          2HH1      ARG  30 -24.328   1.015-103.009
  251   1HH2  ARG  30          1HH2      ARG  30 -24.203   4.475-103.647
  252   2HH2  ARG  30          2HH2      ARG  30 -23.439   2.933-103.936
  253    H    ASN  31           H        ASN  31 -29.272  -0.789-100.515
  254    HA   ASN  31           HA       ASN  31 -31.627  -1.049 -98.848
  255   1HB   ASN  31          2HB       ASN  31 -30.480  -2.785 -97.725
  256   2HB   ASN  31          1HB       ASN  31 -29.973  -2.938 -99.404
  257   1HD2  ASN  31          1HD2      ASN  31 -28.982  -2.433 -96.186
  258   2HD2  ASN  31          2HD2      ASN  31 -27.289  -2.228 -96.488
  259    H    ARG  32           H        ARG  32 -31.578  -0.628 -96.544
  260    HA   ARG  32           HA       ARG  32 -29.937   1.712 -95.888
  261   1HB   ARG  32          2HB       ARG  32 -32.318   0.520 -94.450
  262   2HB   ARG  32          1HB       ARG  32 -31.479   1.992 -93.981
  263   1HG   ARG  32          2HG       ARG  32 -32.261   3.167 -95.847
  264   2HG   ARG  32          1HG       ARG  32 -32.737   1.690 -96.685
  265   1HD   ARG  32          2HD       ARG  32 -34.764   1.759 -95.771
  266   2HD   ARG  32          1HD       ARG  32 -34.075   1.865 -94.151
  267    HE   ARG  32           HE       ARG  32 -34.535   4.211 -95.886
  268   1HH1  ARG  32          1HH1      ARG  32 -34.621   2.638 -92.750
  269   2HH1  ARG  32          2HH1      ARG  32 -35.118   4.079 -91.909
  270   1HH2  ARG  32          1HH2      ARG  32 -35.203   6.094 -94.782
  271   2HH2  ARG  32          2HH2      ARG  32 -35.462   6.029 -93.061
  272    HA   PRO  33           HA       PRO  33 -27.118  -0.487 -93.269
  273   1HB   PRO  33          2HB       PRO  33 -27.622   1.702 -91.309
  274   2HB   PRO  33          1HB       PRO  33 -26.090   1.097 -91.950
  275   1HG   PRO  33          2HG       PRO  33 -27.093   3.408 -92.804
  276   2HG   PRO  33          1HG       PRO  33 -26.290   2.294 -93.927
  277   1HD   PRO  33          2HD       PRO  33 -29.202   2.837 -93.549
  278   2HD   PRO  33          1HD       PRO  33 -28.302   2.489 -95.039
  279    H    ALA  34           H        ALA  34 -29.698   1.092 -91.378
  280    HA   ALA  34           HA       ALA  34 -31.154   0.331 -89.819
  281   1HB   ALA  34          1HB       ALA  34 -30.974  -2.501 -90.588
  282   2HB   ALA  34          2HB       ALA  34 -31.370  -1.386 -91.896
  283   3HB   ALA  34          3HB       ALA  34 -32.380  -1.444 -90.450
  284    H    ILE  35           H        ILE  35 -29.436   0.816 -88.279
  285    HA   ILE  35           HA       ILE  35 -28.115  -1.521 -87.107
  286    HB   ILE  35           HB       ILE  35 -27.839   1.390 -86.333
  287   1HG1  ILE  35          2HG1      ILE  35 -25.477   0.436 -87.551
  288   2HG1  ILE  35          1HG1      ILE  35 -26.803  -0.048 -88.603
  289   1HG2  ILE  35          1HG2      ILE  35 -27.172   0.036 -84.517
  290   2HG2  ILE  35          2HG2      ILE  35 -25.686   0.543 -85.323
  291   3HG2  ILE  35          3HG2      ILE  35 -26.314  -1.087 -85.572
  292   1HD1  ILE  35          1HD1      ILE  35 -26.065   2.056 -89.361
  293   2HD1  ILE  35          2HD1      ILE  35 -26.054   2.724 -87.729
  294   3HD1  ILE  35          3HD1      ILE  35 -27.587   2.344 -88.515
  295    H    ALA  36           H        ALA  36 -29.888   1.320 -85.922
  296    HA   ALA  36           HA       ALA  36 -31.398   1.637 -84.265
  297   1HB   ALA  36          1HB       ALA  36 -33.203   0.212 -84.189
  298   2HB   ALA  36          2HB       ALA  36 -32.207  -1.232 -84.381
  299   3HB   ALA  36          3HB       ALA  36 -32.512  -0.179 -85.764
  300    H    ARG  37           H        ARG  37 -29.080   1.520 -83.146
  301    HA   ARG  37           HA       ARG  37 -29.496  -0.184 -80.789
  302   1HB   ARG  37          2HB       ARG  37 -27.381  -0.441 -82.657
  303   2HB   ARG  37          1HB       ARG  37 -26.695   0.229 -81.182
  304   1HG   ARG  37          2HG       ARG  37 -26.503  -2.001 -80.756
  305   2HG   ARG  37          1HG       ARG  37 -28.085  -1.675 -80.040
  306   1HD   ARG  37          2HD       ARG  37 -28.540  -3.555 -81.287
  307   2HD   ARG  37          1HD       ARG  37 -28.962  -2.278 -82.429
  308    HE   ARG  37           HE       ARG  37 -27.285  -3.008 -83.784
  309   1HH1  ARG  37          1HH1      ARG  37 -26.696  -4.260 -80.557
  310   2HH1  ARG  37          2HH1      ARG  37 -25.265  -5.128 -81.026
  311   1HH2  ARG  37          1HH2      ARG  37 -25.447  -4.179 -84.401
  312   2HH2  ARG  37          2HH2      ARG  37 -24.567  -5.104 -83.215
  313    H    GLY  38           H        GLY  38 -29.690   1.008 -79.047
  314   1HA   GLY  38          2HA       GLY  38 -28.607   3.729 -79.037
  315   2HA   GLY  38          1HA       GLY  38 -29.754   3.061 -77.884
  316    H    GLY  39           H        GLY  39 -28.256   0.649 -77.400
  317   1HA   GLY  39          2HA       GLY  39 -26.157  -0.039 -76.498
  318   2HA   GLY  39          1HA       GLY  39 -25.756   1.650 -76.226
  319    H    ARG  40           H        ARG  40 -25.862  -0.799 -74.461
  320    HA   ARG  40           HA       ARG  40 -27.957  -0.214 -72.561
  321   1HB   ARG  40          2HB       ARG  40 -25.692  -2.186 -72.661
  322   2HB   ARG  40          1HB       ARG  40 -26.612  -1.948 -71.182
  323   1HG   ARG  40          2HG       ARG  40 -28.157  -2.426 -73.657
  324   2HG   ARG  40          1HG       ARG  40 -27.243  -3.784 -72.997
  325   1HD   ARG  40          2HD       ARG  40 -28.340  -3.128 -70.751
  326   2HD   ARG  40          1HD       ARG  40 -29.479  -2.226 -71.751
  327    HE   ARG  40           HE       ARG  40 -30.147  -4.301 -72.768
  328   1HH1  ARG  40          1HH1      ARG  40 -28.190  -4.566 -69.875
  329   2HH1  ARG  40          2HH1      ARG  40 -28.635  -6.215 -69.565
  330   1HH2  ARG  40          1HH2      ARG  40 -30.735  -6.481 -72.380
  331   2HH2  ARG  40          2HH2      ARG  40 -30.073  -7.310 -70.998
  332    H    ASN  41           H        ASN  41 -24.599   0.568 -72.996
  333    HA   ASN  41           HA       ASN  41 -24.742   2.259 -70.604
  334   1HB   ASN  41          2HB       ASN  41 -23.348   0.116 -70.268
  335   2HB   ASN  41          1HB       ASN  41 -22.191   0.848 -71.376
  336   1HD2  ASN  41          1HD2      ASN  41 -21.209   0.290 -69.018
  337   2HD2  ASN  41          2HD2      ASN  41 -21.045   1.705 -68.025
  338    H    ARG  42           H        ARG  42 -25.129   4.030 -71.782
  339    HA   ARG  42           HA       ARG  42 -22.988   5.382 -73.013
  340   1HB   ARG  42          2HB       ARG  42 -23.402   3.812 -74.841
  341   2HB   ARG  42          1HB       ARG  42 -25.096   4.274 -74.873
  342   1HG   ARG  42          2HG       ARG  42 -23.681   6.663 -75.167
  343   2HG   ARG  42          1HG       ARG  42 -22.829   5.489 -76.171
  344   1HD   ARG  42          2HD       ARG  42 -24.382   5.836 -77.727
  345   2HD   ARG  42          1HD       ARG  42 -25.525   5.015 -76.666
  346    HE   ARG  42           HE       ARG  42 -25.088   7.934 -76.535
  347   1HH1  ARG  42          1HH1      ARG  42 -27.211   5.164 -76.826
  348   2HH1  ARG  42          2HH1      ARG  42 -28.669   6.096 -76.625
  349   1HH2  ARG  42          1HH2      ARG  42 -26.981   9.166 -76.301
  350   2HH2  ARG  42          2HH2      ARG  42 -28.537   8.388 -76.313
  351    HA   PRO  43           HA       PRO  43 -27.062   7.981 -73.165
  352   1HB   PRO  43          2HB       PRO  43 -29.134   6.317 -71.958
  353   2HB   PRO  43          1HB       PRO  43 -29.166   7.203 -73.483
  354   1HG   PRO  43          2HG       PRO  43 -29.080   4.497 -73.350
  355   2HG   PRO  43          1HG       PRO  43 -28.371   5.424 -74.684
  356   1HD   PRO  43          2HD       PRO  43 -27.030   4.156 -72.333
  357   2HD   PRO  43          1HD       PRO  43 -26.493   4.263 -74.022
  358    H    ALA  44           H        ALA  44 -27.094   5.528 -70.591
  359    HA   ALA  44           HA       ALA  44 -26.947   5.637 -68.332
  360   1HB   ALA  44          1HB       ALA  44 -25.503   7.146 -67.395
  361   2HB   ALA  44          2HB       ALA  44 -26.116   8.497 -68.351
  362   3HB   ALA  44          3HB       ALA  44 -25.053   7.300 -69.095
  363    HA   PRO  45           HA       PRO  45 -30.696   7.416 -66.662
  364   1HB   PRO  45          2HB       PRO  45 -29.127   8.408 -64.338
  365   2HB   PRO  45          1HB       PRO  45 -30.563   7.378 -64.369
  366   1HG   PRO  45          2HG       PRO  45 -28.162   6.354 -63.827
  367   2HG   PRO  45          1HG       PRO  45 -29.341   5.458 -64.801
  368   1HD   PRO  45          2HD       PRO  45 -26.910   6.963 -65.675
  369   2HD   PRO  45          1HD       PRO  45 -27.576   5.438 -66.293
  370    H    TYR  46           H        TYR  46 -28.019   9.509 -65.614
  371    HA   TYR  46           HA       TYR  46 -28.782  11.583 -67.450
  372   1HB   TYR  46          2HB       TYR  46 -30.227  11.793 -65.275
  373   2HB   TYR  46          1HB       TYR  46 -28.743  12.424 -64.571
  374    HD1  TYR  46           1HD      TYR  46 -29.738  12.964 -68.080
  375    HD2  TYR  46           2HD      TYR  46 -29.531  14.645 -64.180
  376    HE1  TYR  46           1HE      TYR  46 -30.253  15.179 -69.013
  377    HE2  TYR  46           2HE      TYR  46 -30.046  16.862 -65.100
  378    HH   TYR  46           HH       TYR  46 -30.661  18.007 -66.892
  379    H    SER  47           H        SER  47 -26.929  10.908 -64.491
  380    HA   SER  47           HA       SER  47 -24.644  12.327 -65.632
  381   1HB   SER  47          2HB       SER  47 -24.410  10.990 -62.995
  382   2HB   SER  47          1HB       SER  47 -23.880  12.596 -63.497
  383    HG   SER  47           HG       SER  47 -25.944  13.362 -63.248
  384    H    ARG  48           H        ARG  48 -25.015   9.253 -63.855
  385    HA   ARG  48           HA       ARG  48 -23.635   7.778 -65.911
  386   1HB   ARG  48          2HB       ARG  48 -22.162   8.943 -63.733
  387   2HB   ARG  48          1HB       ARG  48 -22.130   7.191 -63.585
  388   1HG   ARG  48          2HG       ARG  48 -21.235   6.991 -65.826
  389   2HG   ARG  48          1HG       ARG  48 -21.332   8.740 -66.041
  390   1HD   ARG  48          2HD       ARG  48 -19.628   7.268 -64.036
  391   2HD   ARG  48          1HD       ARG  48 -19.062   8.079 -65.495
  392    HE   ARG  48           HE       ARG  48 -20.348  10.047 -64.127
  393   1HH1  ARG  48          1HH1      ARG  48 -17.814   7.770 -63.286
  394   2HH1  ARG  48          2HH1      ARG  48 -17.027   8.862 -62.190
  395   1HH2  ARG  48          1HH2      ARG  48 -19.332  11.476 -62.654
  396   2HH2  ARG  48          2HH2      ARG  48 -17.893  10.963 -61.811
  397    HA   PRO  49           HA       PRO  49 -25.917   4.455 -63.978
  398   1HB   PRO  49          2HB       PRO  49 -24.262   2.350 -64.562
  399   2HB   PRO  49          1HB       PRO  49 -25.393   3.059 -65.720
  400   1HG   PRO  49          2HG       PRO  49 -22.452   3.505 -65.425
  401   2HG   PRO  49          1HG       PRO  49 -23.421   3.340 -66.902
  402   1HD   PRO  49          2HD       PRO  49 -22.586   5.737 -65.978
  403   2HD   PRO  49          1HD       PRO  49 -24.128   5.533 -66.833
  404    H    LYS  50           H        LYS  50 -25.933   4.430 -61.831
  405    HA   LYS  50           HA       LYS  50 -23.460   4.392 -60.316
  406   1HB   LYS  50          2HB       LYS  50 -26.303   4.484 -59.296
  407   2HB   LYS  50          1HB       LYS  50 -24.845   4.850 -58.385
  408   1HG   LYS  50          2HG       LYS  50 -25.054   6.977 -58.951
  409   2HG   LYS  50          1HG       LYS  50 -24.836   6.534 -60.645
  410   1HD   LYS  50          2HD       LYS  50 -26.924   7.823 -60.185
  411   2HD   LYS  50          1HD       LYS  50 -27.197   6.253 -60.943
  412   1HE   LYS  50          2HE       LYS  50 -28.801   6.258 -59.283
  413   2HE   LYS  50          1HE       LYS  50 -27.468   5.420 -58.491
  414   1HZ   LYS  50          1HZ       LYS  50 -26.872   7.414 -57.343
  415   2HZ   LYS  50          2HZ       LYS  50 -28.530   7.146 -57.103
  416   3HZ   LYS  50          3HZ       LYS  50 -28.014   8.326 -58.207
  417    HA   PRO  51           HA       PRO  51 -23.953  -0.004 -59.689
  418   1HB   PRO  51          2HB       PRO  51 -21.499  -0.465 -58.724
  419   2HB   PRO  51          1HB       PRO  51 -21.763  -0.104 -60.433
  420   1HG   PRO  51          2HG       PRO  51 -20.732   1.656 -58.260
  421   2HG   PRO  51          1HG       PRO  51 -20.260   1.580 -59.967
  422   1HD   PRO  51          2HD       PRO  51 -22.003   3.445 -58.835
  423   2HD   PRO  51          1HD       PRO  51 -21.848   3.092 -60.567
  424    H    LEU  52           H        LEU  52 -23.424   2.480 -57.402
  425    HA   LEU  52           HA       LEU  52 -23.574   2.668 -55.146
  426   1HB   LEU  52          2HB       LEU  52 -25.505   0.406 -55.630
  427   2HB   LEU  52          1HB       LEU  52 -25.346   1.228 -54.089
  428    HG   LEU  52           HG       LEU  52 -25.739   3.259 -55.991
  429   1HD1  LEU  52          1HD1      LEU  52 -26.552   1.173 -57.345
  430   2HD1  LEU  52          2HD1      LEU  52 -27.488   2.668 -57.352
  431   3HD1  LEU  52          3HD1      LEU  52 -27.980   1.323 -56.320
  432   1HD2  LEU  52          1HD2      LEU  52 -27.034   3.915 -54.316
  433   2HD2  LEU  52          2HD2      LEU  52 -26.815   2.342 -53.548
  434   3HD2  LEU  52          3HD2      LEU  52 -28.167   2.604 -54.649
  435    HA   PRO  53           HA       PRO  53 -20.367  -0.662 -54.754
  436   1HB   PRO  53          2HB       PRO  53 -18.697   0.932 -53.238
  437   2HB   PRO  53          1HB       PRO  53 -18.648   0.802 -54.999
  438   1HG   PRO  53          2HG       PRO  53 -19.927   2.888 -53.286
  439   2HG   PRO  53          1HG       PRO  53 -19.031   3.076 -54.805
  440   1HD   PRO  53          2HD       PRO  53 -21.710   3.184 -54.734
  441   2HD   PRO  53          1HD       PRO  53 -20.847   2.445 -56.098
  442    H    ASP  54           H        ASP  54 -21.706   1.461 -52.280
  443    HA   ASP  54           HA       ASP  54 -22.161   1.198 -50.071
  444   1HB   ASP  54          2HB       ASP  54 -22.646  -1.437 -51.275
  445   2HB   ASP  54          1HB       ASP  54 -22.319  -1.498 -49.547
  446    H    LYS  55           H        LYS  55 -19.635   1.766 -50.397
  447    HA   LYS  55           HA       LYS  55 -17.895  -0.281 -49.311
  448   1HB   LYS  55          2HB       LYS  55 -17.346   1.541 -51.119
  449   2HB   LYS  55          1HB       LYS  55 -17.046   2.563 -49.718
  450   1HG   LYS  55          2HG       LYS  55 -15.017   1.470 -50.631
  451   2HG   LYS  55          1HG       LYS  55 -15.328   1.103 -48.931
  452   1HD   LYS  55          2HD       LYS  55 -15.596  -1.086 -49.341
  453   2HD   LYS  55          1HD       LYS  55 -16.573  -0.786 -50.780
  454   1HE   LYS  55          2HE       LYS  55 -13.636  -0.274 -50.876
  455   2HE   LYS  55          1HE       LYS  55 -14.221  -1.934 -50.966
  456   1HZ   LYS  55          1HZ       LYS  55 -15.498  -1.401 -52.895
  457   2HZ   LYS  55          2HZ       LYS  55 -13.914  -0.856 -53.156
  458   3HZ   LYS  55          3HZ       LYS  55 -15.133   0.253 -52.761
  459    H    TRP  56           H        TRP  56 -17.456  -0.539 -47.257
  460    HA   TRP  56           HA       TRP  56 -18.703   1.034 -45.255
  461   1HB   TRP  56          2HB       TRP  56 -16.472  -0.828 -44.570
  462   2HB   TRP  56          1HB       TRP  56 -18.031  -0.604 -43.780
  463    HD1  TRP  56           HD       TRP  56 -16.264  -2.829 -46.199
  464    HE1  TRP  56           1HE      TRP  56 -17.898  -4.563 -47.177
  465    HE3  TRP  56           3HE      TRP  56 -20.662  -0.812 -44.543
  466    HZ2  TRP  56           2HZ      TRP  56 -20.687  -5.011 -47.227
  467    HZ3  TRP  56           3HZ      TRP  56 -22.767  -1.955 -45.101
  468    HH2  TRP  56           HH       TRP  56 -22.777  -4.010 -46.415
  469    H    GLN  57           H        GLN  57 -17.553   2.015 -43.428
  470    HA   GLN  57           HA       GLN  57 -15.663   3.933 -44.412
  471   1HB   GLN  57          2HB       GLN  57 -17.451   4.492 -42.787
  472   2HB   GLN  57          1HB       GLN  57 -16.664   3.465 -41.596
  473   1HG   GLN  57          2HG       GLN  57 -15.972   5.589 -41.016
  474   2HG   GLN  57          1HG       GLN  57 -14.616   4.966 -41.959
  475   1HE2  GLN  57          1HE2      GLN  57 -16.615   7.545 -41.508
  476   2HE2  GLN  57          2HE2      GLN  57 -16.405   8.339 -43.036
  477    H    HIS  58           H        HIS  58 -15.569   1.597 -41.742
  478    HA   HIS  58           HA       HIS  58 -12.942   0.706 -42.305
  479   1HB   HIS  58          2HB       HIS  58 -12.553   3.048 -41.321
  480   2HB   HIS  58          1HB       HIS  58 -13.140   2.388 -39.799
  481    HD1  HIS  58           1HD      HIS  58 -10.383   3.420 -39.662
  482    HD2  HIS  58           2HD      HIS  58 -11.189  -0.459 -40.942
  483    HE1  HIS  58           1HE      HIS  58  -8.255   2.123 -39.300
  484    HE2  HIS  58           2HE      HIS  58  -8.788  -0.240 -40.004
  485    H    ASP  59           H        ASP  59 -13.765   1.219 -38.991
  486    HA   ASP  59           HA       ASP  59 -15.177  -1.300 -38.744
  487   1HB   ASP  59          2HB       ASP  59 -12.773  -1.931 -38.704
  488   2HB   ASP  59          1HB       ASP  59 -12.537  -0.853 -37.332
  489    H    LEU  60           H        LEU  60 -13.573   1.381 -37.093
  490    HA   LEU  60           HA       LEU  60 -14.336   2.909 -35.627
  491   1HB   LEU  60          2HB       LEU  60 -17.062   1.644 -35.695
  492   2HB   LEU  60          1HB       LEU  60 -16.642   3.287 -35.264
  493    HG   LEU  60           HG       LEU  60 -15.848   2.627 -37.989
  494   1HD1  LEU  60          1HD1      LEU  60 -18.767   2.488 -37.253
  495   2HD1  LEU  60          2HD1      LEU  60 -17.789   1.204 -37.968
  496   3HD1  LEU  60          3HD1      LEU  60 -18.143   2.664 -38.894
  497   1HD2  LEU  60          1HD2      LEU  60 -17.657   4.762 -36.866
  498   2HD2  LEU  60          2HD2      LEU  60 -16.898   4.750 -38.458
  499   3HD2  LEU  60          3HD2      LEU  60 -15.903   4.889 -37.008
  500    H    PHE  61           H        PHE  61 -16.128   2.664 -33.492
  501    HA   PHE  61           HA       PHE  61 -15.760   2.338 -31.277
  502   1HB   PHE  61          2HB       PHE  61 -16.994   0.315 -32.025
  503   2HB   PHE  61          1HB       PHE  61 -15.457  -0.529 -32.158
  504    HD1  PHE  61           1HD      PHE  61 -16.345   1.859 -29.493
  505    HD2  PHE  61           2HD      PHE  61 -15.839  -2.232 -30.550
  506    HE1  PHE  61           1HE      PHE  61 -16.511   1.230 -27.121
  507    HE2  PHE  61           2HE      PHE  61 -16.003  -2.868 -28.179
  508    HZ   PHE  61           HZ       PHE  61 -16.273  -1.164 -26.465
  509    H    ASP  62           H        ASP  62 -13.364   2.668 -33.095
  510    HA   ASP  62           HA       ASP  62 -11.120   2.877 -32.876
  511   1HB   ASP  62          2HB       ASP  62 -11.963   3.403 -30.399
  512   2HB   ASP  62          1HB       ASP  62 -11.094   1.911 -30.054
  513    H    SER  63           H        SER  63  -9.120   1.511 -31.919
  514    HA   SER  63           HA       SER  63  -9.718  -1.330 -32.410
  515   1HB   SER  63          2HB       SER  63  -7.038  -0.134 -33.054
  516   2HB   SER  63          1HB       SER  63  -7.805  -1.574 -33.726
  517    HG   SER  63           HG       SER  63  -9.381  -0.052 -34.660
  518    H    GLY  64           H        GLY  64  -8.601   0.980 -30.267
  519   1HA   GLY  64          2HA       GLY  64  -7.609  -1.115 -28.478
  520   2HA   GLY  64          1HA       GLY  64  -6.551   0.251 -28.805
  521    H    CYS  65           H        CYS  65 -10.005  -0.181 -28.079
  522    HA   CYS  65           HA       CYS  65 -10.071   2.237 -26.523
  523   1HB   CYS  65          2HB       CYS  65 -12.425   0.931 -25.991
  524   2HB   CYS  65          1HB       CYS  65 -12.163   2.026 -27.347
  525    HG   CYS  65           HG       CYS  65 -12.821   0.284 -29.107
  526    H    GLY  66           H        GLY  66  -9.876   2.431 -24.352
  527   1HA   GLY  66          2HA       GLY  66 -10.569   0.660 -22.382
  528   2HA   GLY  66          1HA       GLY  66  -8.942   0.183 -22.843
  529    H    GLY  67           H        GLY  67  -8.150   0.744 -20.776
  530   1HA   GLY  67          2HA       GLY  67  -7.037   3.304 -20.583
  531   2HA   GLY  67          1HA       GLY  67  -8.487   3.282 -19.589
  532    H    GLY  68           H        GLY  68  -7.567   3.365 -17.587
  533   1HA   GLY  68          2HA       GLY  68  -5.366   1.704 -16.820
  534   2HA   GLY  68          1HA       GLY  68  -6.397   2.633 -15.739
  535    H    GLU  69           H        GLU  69  -5.598  -0.447 -16.881
  536    HA   GLU  69           HA       GLU  69  -8.037  -1.817 -16.500
  537   1HB   GLU  69          2HB       GLU  69  -5.405  -3.149 -16.001
  538   2HB   GLU  69          1HB       GLU  69  -6.832  -3.776 -16.815
  539   1HG   GLU  69          2HG       GLU  69  -5.834  -3.340 -18.739
  540   2HG   GLU  69          1HG       GLU  69  -5.987  -1.621 -18.371
  541    H    GLY  70           H        GLY  70  -5.167  -2.332 -14.466
  542   1HA   GLY  70          2HA       GLY  70  -6.956  -2.333 -12.118
  543   2HA   GLY  70          1HA       GLY  70  -5.418  -3.186 -12.219
  544    H    VAL  71           H        VAL  71  -5.320  -0.176 -13.672
  545    HA   VAL  71           HA       VAL  71  -4.320   1.163 -11.289
  546    HB   VAL  71           HB       VAL  71  -2.645   1.984 -13.409
  547   1HG1  VAL  71          1HG1      VAL  71  -2.137   0.349 -10.933
  548   2HG1  VAL  71          2HG1      VAL  71  -2.013   2.099 -11.112
  549   3HG1  VAL  71          3HG1      VAL  71  -0.867   1.045 -11.942
  550   1HG2  VAL  71          1HG2      VAL  71  -1.959  -0.847 -13.106
  551   2HG2  VAL  71          2HG2      VAL  71  -1.909   0.188 -14.534
  552   3HG2  VAL  71          3HG2      VAL  71  -3.430  -0.559 -14.039
  553    H    GLU  72           H        GLU  72  -6.445   2.175 -11.601
  554    HA   GLU  72           HA       GLU  72  -6.743   3.948 -13.865
  555   1HB   GLU  72          2HB       GLU  72  -8.474   4.364 -11.505
  556   2HB   GLU  72          1HB       GLU  72  -8.899   4.242 -13.205
  557   1HG   GLU  72          2HG       GLU  72  -9.773   2.274 -12.668
  558   2HG   GLU  72          1HG       GLU  72  -8.110   1.692 -12.620
  559    H    THR  73           H        THR  73  -7.019   4.710 -10.403
  560    HA   THR  73           HA       THR  73  -5.012   6.796 -10.699
  561    HB   THR  73           HB       THR  73  -6.939   8.152  -9.274
  562    HG1  THR  73           1HG      THR  73  -8.513   6.563  -9.957
  563   1HG2  THR  73          1HG2      THR  73  -5.638   8.301 -11.856
  564   2HG2  THR  73          2HG2      THR  73  -6.087   9.598 -10.748
  565   3HG2  THR  73          3HG2      THR  73  -7.263   8.984 -11.909
  566    H    GLY  74           H        GLY  74  -3.731   6.832  -8.975
  567   1HA   GLY  74          2HA       GLY  74  -4.702   6.655  -6.308
  568   2HA   GLY  74          1HA       GLY  74  -3.936   5.149  -6.798
  569    H    ALA  75           H        ALA  75  -2.664   6.063  -4.829
  570    HA   ALA  75           HA       ALA  75  -0.509   7.829  -5.784
  571   1HB   ALA  75          1HB       ALA  75  -1.934   8.098  -3.532
  572   2HB   ALA  75          2HB       ALA  75  -0.246   8.595  -3.658
  573   3HB   ALA  75          3HB       ALA  75  -0.655   7.042  -2.930
  574    H    LYS  76           H        LYS  76   1.121   6.684  -6.646
  575    HA   LYS  76           HA       LYS  76   1.592   3.977  -5.645
  576   1HB   LYS  76          2HB       LYS  76   1.163   4.265  -8.038
  577   2HB   LYS  76          1HB       LYS  76   2.548   5.339  -8.163
  578   1HG   LYS  76          2HG       LYS  76   4.073   3.583  -7.783
  579   2HG   LYS  76          1HG       LYS  76   2.794   2.491  -7.248
  580   1HD   LYS  76          2HD       LYS  76   2.177   1.969  -9.359
  581   2HD   LYS  76          1HD       LYS  76   2.472   3.604  -9.957
  582   1HE   LYS  76          2HE       LYS  76   4.147   2.470 -11.029
  583   2HE   LYS  76          1HE       LYS  76   4.985   2.943  -9.550
  584   1HZ   LYS  76          1HZ       LYS  76   3.904   0.297 -10.287
  585   2HZ   LYS  76          2HZ       LYS  76   4.201   0.698  -8.666
  586   3HZ   LYS  76          3HZ       LYS  76   5.475   0.699  -9.790
  587    H    LEU  77           H        LEU  77   3.117   3.620  -4.286
  588    HA   LEU  77           HA       LEU  77   5.458   5.368  -4.105
  589   1HB   LEU  77          2HB       LEU  77   4.216   5.120  -2.080
  590   2HB   LEU  77          1HB       LEU  77   4.104   3.392  -2.276
  591    HG   LEU  77           HG       LEU  77   5.567   4.131  -0.420
  592   1HD1  LEU  77          1HD1      LEU  77   5.929   2.017  -2.062
  593   2HD1  LEU  77          2HD1      LEU  77   6.807   2.306  -0.560
  594   3HD1  LEU  77          3HD1      LEU  77   7.521   2.775  -2.104
  595   1HD2  LEU  77          1HD2      LEU  77   7.503   5.327  -0.685
  596   2HD2  LEU  77          2HD2      LEU  77   6.480   6.075  -1.911
  597   3HD2  LEU  77          3HD2      LEU  77   7.683   4.875  -2.380
  598    H    LEU  78           H        LEU  78   7.274   4.668  -5.056
  599    HA   LEU  78           HA       LEU  78   7.805   1.790  -5.158
  600   1HB   LEU  78          2HB       LEU  78   9.765   3.781  -6.183
  601   2HB   LEU  78          1HB       LEU  78   9.341   2.205  -6.819
  602    HG   LEU  78           HG       LEU  78   7.552   4.625  -7.032
  603   1HD1  LEU  78          1HD1      LEU  78   9.589   5.065  -8.251
  604   2HD1  LEU  78          2HD1      LEU  78   8.282   4.716  -9.383
  605   3HD1  LEU  78          3HD1      LEU  78   9.497   3.486  -9.032
  606   1HD2  LEU  78          1HD2      LEU  78   6.590   2.271  -7.153
  607   2HD2  LEU  78          2HD2      LEU  78   7.487   2.107  -8.664
  608   3HD2  LEU  78          3HD2      LEU  78   6.247   3.352  -8.505
  609    H    VAL  79           H        VAL  79   9.923   1.032  -4.443
  610    HA   VAL  79           HA       VAL  79  11.378   2.546  -2.513
  611    HB   VAL  79           HB       VAL  79   9.596   2.187  -1.009
  612   1HG1  VAL  79          1HG1      VAL  79   9.235  -0.246  -2.498
  613   2HG1  VAL  79          2HG1      VAL  79   8.081   0.687  -1.546
  614   3HG1  VAL  79          3HG1      VAL  79   9.111  -0.510  -0.758
  615   1HG2  VAL  79          1HG2      VAL  79  11.324  -0.164  -0.325
  616   2HG2  VAL  79          2HG2      VAL  79  10.504   0.964   0.756
  617   3HG2  VAL  79          3HG2      VAL  79  11.902   1.497  -0.176
  618    H    SER  80           H        SER  80  13.240   1.256  -1.665
  619    HA   SER  80           HA       SER  80  13.787  -1.281  -2.804
  620   1HB   SER  80          2HB       SER  80  15.728   0.617  -3.969
  621   2HB   SER  80          1HB       SER  80  15.037  -0.856  -4.652
  622    HG   SER  80           HG       SER  80  13.031   0.566  -4.762
  623    H    ASN  81           H        ASN  81  15.890  -2.061  -2.240
  624    HA   ASN  81           HA       ASN  81  17.577  -2.426  -0.783
  625   1HB   ASN  81          2HB       ASN  81  18.312  -0.171  -1.859
  626   2HB   ASN  81          1HB       ASN  81  17.867   0.524  -0.302
  627   1HD2  ASN  81          1HD2      ASN  81  20.446   0.620  -1.303
  628   2HD2  ASN  81          2HD2      ASN  81  21.474  -0.345  -0.294
  629    H    LEU  82           H        LEU  82  16.058  -3.346   0.633
  630    HA   LEU  82           HA       LEU  82  14.684  -2.004   2.655
  631   1HB   LEU  82          2HB       LEU  82  15.057  -4.307   3.908
  632   2HB   LEU  82          1HB       LEU  82  13.935  -4.144   2.578
  633    HG   LEU  82           HG       LEU  82  15.708  -5.073   1.059
  634   1HD1  LEU  82          1HD1      LEU  82  17.550  -4.486   2.794
  635   2HD1  LEU  82          2HD1      LEU  82  17.692  -5.961   1.838
  636   3HD1  LEU  82          3HD1      LEU  82  17.123  -6.041   3.504
  637   1HD2  LEU  82          1HD2      LEU  82  15.382  -7.164   3.084
  638   2HD2  LEU  82          2HD2      LEU  82  14.888  -7.129   1.392
  639   3HD2  LEU  82          3HD2      LEU  82  13.894  -6.340   2.618
  640    H    ASP  83           H        ASP  83  15.115  -1.686   4.859
  641    HA   ASP  83           HA       ASP  83  17.573  -0.658   5.582
  642   1HB   ASP  83          2HB       ASP  83  15.804  -0.034   6.968
  643   2HB   ASP  83          1HB       ASP  83  15.231  -1.687   7.148
  644    H    PHE  84           H        PHE  84  16.254  -3.796   6.633
  645    HA   PHE  84           HA       PHE  84  18.835  -5.029   6.179
  646   1HB   PHE  84          2HB       PHE  84  19.087  -4.331   8.491
  647   2HB   PHE  84          1HB       PHE  84  17.524  -5.025   8.907
  648    HD1  PHE  84           1HD      PHE  84  17.409  -7.183   9.729
  649    HD2  PHE  84           2HD      PHE  84  20.866  -5.965   7.568
  650    HE1  PHE  84           1HE      PHE  84  18.510  -9.305  10.300
  651    HE2  PHE  84           2HE      PHE  84  21.971  -8.088   8.132
  652    HZ   PHE  84           HZ       PHE  84  20.772  -9.786   9.450
  653    H    GLY  85           H        GLY  85  15.779  -5.744   7.867
  654   1HA   GLY  85          2HA       GLY  85  15.399  -7.979   5.978
  655   2HA   GLY  85          1HA       GLY  85  15.140  -8.183   7.706
  656    H    VAL  86           H        VAL  86  14.240  -5.528   5.543
  657    HA   VAL  86           HA       VAL  86  11.576  -5.491   6.649
  658    HB   VAL  86           HB       VAL  86  12.706  -3.867   4.358
  659   1HG1  VAL  86          1HG1      VAL  86  10.713  -2.902   4.161
  660   2HG1  VAL  86          2HG1      VAL  86  10.619  -2.611   5.898
  661   3HG1  VAL  86          3HG1      VAL  86  10.071  -4.148   5.230
  662   1HG2  VAL  86          1HG2      VAL  86  12.336  -2.398   6.795
  663   2HG2  VAL  86          2HG2      VAL  86  13.794  -2.602   5.822
  664   3HG2  VAL  86          3HG2      VAL  86  13.396  -3.780   7.074
  665    H    SER  87           H        SER  87  10.153  -6.954   5.990
  666    HA   SER  87           HA       SER  87  10.307  -7.986   3.263
  667   1HB   SER  87          2HB       SER  87   8.344  -9.097   5.188
  668   2HB   SER  87          1HB       SER  87   9.416  -9.928   4.064
  669    HG   SER  87           HG       SER  87  10.155  -8.720   6.536
  670    H    ASP  88           H        ASP  88   7.760  -8.872   2.911
  671    HA   ASP  88           HA       ASP  88   6.512  -6.674   1.710
  672   1HB   ASP  88          2HB       ASP  88   4.744  -8.933   2.359
  673   2HB   ASP  88          1HB       ASP  88   5.129  -8.217   0.800
  674    H    ALA  89           H        ALA  89   5.524  -8.533   4.582
  675    HA   ALA  89           HA       ALA  89   3.340  -6.831   5.213
  676   1HB   ALA  89          1HB       ALA  89   4.207  -9.279   6.085
  677   2HB   ALA  89          2HB       ALA  89   2.897  -8.342   6.806
  678   3HB   ALA  89          3HB       ALA  89   4.524  -8.245   7.478
  679    H    ASP  90           H        ASP  90   6.716  -6.748   5.885
  680    HA   ASP  90           HA       ASP  90   6.680  -5.035   8.138
  681   1HB   ASP  90          2HB       ASP  90   8.798  -5.690   6.105
  682   2HB   ASP  90          1HB       ASP  90   9.082  -4.514   7.384
  683    H    ILE  91           H        ILE  91   7.641  -4.217   4.779
  684    HA   ILE  91           HA       ILE  91   7.519  -1.461   5.105
  685    HB   ILE  91           HB       ILE  91   8.549  -2.641   3.163
  686   1HG1  ILE  91          2HG1      ILE  91   7.687  -0.924   1.440
  687   2HG1  ILE  91          1HG1      ILE  91   6.661  -0.336   2.745
  688   1HG2  ILE  91          1HG2      ILE  91   6.898  -2.936   1.186
  689   2HG2  ILE  91          2HG2      ILE  91   5.683  -3.092   2.456
  690   3HG2  ILE  91          3HG2      ILE  91   7.044  -4.211   2.395
  691   1HD1  ILE  91          1HD1      ILE  91   9.217  -0.516   3.842
  692   2HD1  ILE  91          2HD1      ILE  91   8.347   0.945   3.379
  693   3HD1  ILE  91          3HD1      ILE  91   9.438   0.169   2.233
  694    H    GLN  92           H        GLN  92   4.937  -3.739   4.522
  695    HA   GLN  92           HA       GLN  92   2.961  -1.836   3.786
  696   1HB   GLN  92          2HB       GLN  92   2.679  -4.213   3.305
  697   2HB   GLN  92          1HB       GLN  92   2.659  -4.577   5.024
  698   1HG   GLN  92          2HG       GLN  92   0.671  -2.612   4.490
  699   2HG   GLN  92          1HG       GLN  92   0.489  -3.935   3.337
  700   1HE2  GLN  92          1HE2      GLN  92  -0.546  -2.861   6.203
  701   2HE2  GLN  92          2HE2      GLN  92  -0.922  -4.360   6.989
  702    H    GLU  93           H        GLU  93   3.709  -3.451   6.869
  703    HA   GLU  93           HA       GLU  93   1.840  -2.088   8.447
  704   1HB   GLU  93          2HB       GLU  93   3.714  -4.043   8.882
  705   2HB   GLU  93          1HB       GLU  93   4.385  -2.689   9.780
  706   1HG   GLU  93          2HG       GLU  93   3.076  -3.858  11.317
  707   2HG   GLU  93          1HG       GLU  93   2.106  -2.459  10.856
  708    H    LEU  94           H        LEU  94   5.069  -1.238   7.406
  709    HA   LEU  94           HA       LEU  94   5.509   0.944   9.126
  710   1HB   LEU  94          2HB       LEU  94   6.673  -0.087   6.628
  711   2HB   LEU  94          1HB       LEU  94   6.859   1.640   6.859
  712    HG   LEU  94           HG       LEU  94   7.581  -0.101   9.150
  713   1HD1  LEU  94          1HD1      LEU  94   9.430   0.217   6.797
  714   2HD1  LEU  94          2HD1      LEU  94   8.490  -1.242   7.110
  715   3HD1  LEU  94          3HD1      LEU  94   9.705  -0.708   8.272
  716   1HD2  LEU  94          1HD2      LEU  94   9.090   1.603   9.639
  717   2HD2  LEU  94          2HD2      LEU  94   7.701   2.463   8.975
  718   3HD2  LEU  94          3HD2      LEU  94   9.126   2.182   7.974
  719    H    PHE  95           H        PHE  95   4.702   1.114   5.664
  720    HA   PHE  95           HA       PHE  95   3.819   3.721   5.665
  721   1HB   PHE  95          2HB       PHE  95   3.474   1.408   3.880
  722   2HB   PHE  95          1HB       PHE  95   2.323   2.725   3.668
  723    HD1  PHE  95           1HD      PHE  95   3.647   5.130   3.961
  724    HD2  PHE  95           2HD      PHE  95   5.222   1.494   2.416
  725    HE1  PHE  95           1HE      PHE  95   5.324   6.403   2.693
  726    HE2  PHE  95           2HE      PHE  95   6.902   2.759   1.146
  727    HZ   PHE  95           HZ       PHE  95   6.948   5.216   1.277
  728    H    ALA  96           H        ALA  96   2.052   0.951   6.835
  729    HA   ALA  96           HA       ALA  96  -0.505   2.230   6.878
  730   1HB   ALA  96          1HB       ALA  96  -0.002  -0.268   7.161
  731   2HB   ALA  96          2HB       ALA  96  -1.239   0.433   8.206
  732   3HB   ALA  96          3HB       ALA  96   0.379   0.127   8.838
  733    H    GLU  97           H        GLU  97   2.041   1.779   9.230
  734    HA   GLU  97           HA       GLU  97   1.176   3.539  11.231
  735   1HB   GLU  97          2HB       GLU  97   3.621   2.228  10.545
  736   2HB   GLU  97          1HB       GLU  97   3.982   3.902  10.941
  737   1HG   GLU  97          2HG       GLU  97   2.191   3.013  12.900
  738   2HG   GLU  97          1HG       GLU  97   3.365   1.716  12.677
  739    H    PHE  98           H        PHE  98   2.984   4.176   8.276
  740    HA   PHE  98           HA       PHE  98   3.172   6.976   8.529
  741   1HB   PHE  98          2HB       PHE  98   3.653   4.979   6.412
  742   2HB   PHE  98          1HB       PHE  98   3.323   6.618   5.855
  743    HD1  PHE  98           1HD      PHE  98   4.640   8.463   7.329
  744    HD2  PHE  98           2HD      PHE  98   5.847   4.431   6.696
  745    HE1  PHE  98           1HE      PHE  98   6.972   9.093   7.772
  746    HE2  PHE  98           2HE      PHE  98   8.183   5.055   7.152
  747    HZ   PHE  98           HZ       PHE  98   8.736   7.385   7.753
  748    H    GLY  99           H        GLY  99   0.376   5.383   8.358
  749   1HA   GLY  99          2HA       GLY  99  -1.548   6.975   8.020
  750   2HA   GLY  99          1HA       GLY  99  -0.839   7.298   6.449
  751    H    THR 100           H        THR 100  -1.793   6.298   4.791
  752    HA   THR 100           HA       THR 100  -3.455   3.958   5.432
  753    HB   THR 100           HB       THR 100  -4.296   5.356   3.046
  754    HG1  THR 100           1HG      THR 100  -3.784   7.304   3.851
  755   1HG2  THR 100          1HG2      THR 100  -6.323   4.728   3.789
  756   2HG2  THR 100          2HG2      THR 100  -6.036   5.368   5.407
  757   3HG2  THR 100          3HG2      THR 100  -5.417   3.777   4.966
  758    H    LEU 101           H        LEU 101  -2.519   2.193   4.609
  759    HA   LEU 101           HA       LEU 101  -1.343   2.400   1.925
  760   1HB   LEU 101          2HB       LEU 101   0.038   1.472   3.870
  761   2HB   LEU 101          1HB       LEU 101  -1.007   0.064   3.792
  762    HG   LEU 101           HG       LEU 101  -0.177  -0.604   1.714
  763   1HD1  LEU 101          1HD1      LEU 101   0.272   2.257   1.343
  764   2HD1  LEU 101          2HD1      LEU 101  -0.130   1.006   0.167
  765   3HD1  LEU 101          3HD1      LEU 101   1.545   1.236   0.674
  766   1HD2  LEU 101          1HD2      LEU 101   1.517  -1.024   3.324
  767   2HD2  LEU 101          2HD2      LEU 101   2.074   0.648   3.269
  768   3HD2  LEU 101          3HD2      LEU 101   2.324  -0.411   1.878
  769    H    LYS 102           H        LYS 102  -3.007   2.180   0.605
  770    HA   LYS 102           HA       LYS 102  -5.220   0.493   0.857
  771   1HB   LYS 102          2HB       LYS 102  -4.373   2.327  -1.013
  772   2HB   LYS 102          1HB       LYS 102  -4.277   0.814  -1.904
  773   1HG   LYS 102          2HG       LYS 102  -6.721   1.815  -0.458
  774   2HG   LYS 102          1HG       LYS 102  -6.429   1.965  -2.192
  775   1HD   LYS 102          2HD       LYS 102  -6.786  -0.259  -2.582
  776   2HD   LYS 102          1HD       LYS 102  -6.228  -0.740  -0.979
  777   1HE   LYS 102          2HE       LYS 102  -8.882   0.469  -1.724
  778   2HE   LYS 102          1HE       LYS 102  -8.576  -1.141  -1.074
  779   1HZ   LYS 102          1HZ       LYS 102  -7.674   0.051   0.950
  780   2HZ   LYS 102          2HZ       LYS 102  -9.352   0.126   0.714
  781   3HZ   LYS 102          3HZ       LYS 102  -8.383   1.464   0.326
  782    H    LYS 103           H        LYS 103  -2.424  -0.052  -1.284
  783    HA   LYS 103           HA       LYS 103  -2.417  -2.849  -0.453
  784   1HB   LYS 103          2HB       LYS 103  -2.698  -3.735  -2.533
  785   2HB   LYS 103          1HB       LYS 103  -3.632  -2.265  -2.750
  786   1HG   LYS 103          2HG       LYS 103  -2.373  -1.785  -4.503
  787   2HG   LYS 103          1HG       LYS 103  -0.987  -1.612  -3.424
  788   1HD   LYS 103          2HD       LYS 103  -0.355  -3.185  -5.082
  789   2HD   LYS 103          1HD       LYS 103  -0.677  -4.110  -3.615
  790   1HE   LYS 103          2HE       LYS 103  -2.956  -3.717  -5.454
  791   2HE   LYS 103          1HE       LYS 103  -1.660  -4.766  -6.025
  792   1HZ   LYS 103          1HZ       LYS 103  -2.589  -6.367  -4.827
  793   2HZ   LYS 103          2HZ       LYS 103  -3.677  -5.291  -4.090
  794   3HZ   LYS 103          3HZ       LYS 103  -2.136  -5.530  -3.420
  795    H    ALA 104           H        ALA 104  -0.370  -3.812  -0.467
  796    HA   ALA 104           HA       ALA 104   1.812  -2.057  -1.361
  797   1HB   ALA 104          1HB       ALA 104   2.650  -1.883   0.678
  798   2HB   ALA 104          2HB       ALA 104   2.781  -3.643   0.782
  799   3HB   ALA 104          3HB       ALA 104   1.306  -2.837   1.317
  800    H    ALA 105           H        ALA 105   2.850  -2.939  -2.920
  801    HA   ALA 105           HA       ALA 105   2.968  -5.855  -3.160
  802   1HB   ALA 105          1HB       ALA 105   3.721  -3.949  -5.346
  803   2HB   ALA 105          2HB       ALA 105   2.030  -4.344  -5.031
  804   3HB   ALA 105          3HB       ALA 105   3.168  -5.619  -5.465
  805    H    VAL 106           H        VAL 106   5.199  -6.279  -4.583
  806    HA   VAL 106           HA       VAL 106   7.384  -5.287  -3.041
  807    HB   VAL 106           HB       VAL 106   6.631  -8.168  -2.518
  808   1HG1  VAL 106          1HG1      VAL 106   9.086  -6.967  -2.362
  809   2HG1  VAL 106          2HG1      VAL 106   8.593  -8.393  -1.450
  810   3HG1  VAL 106          3HG1      VAL 106   8.482  -6.794  -0.715
  811   1HG2  VAL 106          1HG2      VAL 106   5.803  -7.563  -0.423
  812   2HG2  VAL 106          2HG2      VAL 106   5.131  -6.359  -1.530
  813   3HG2  VAL 106          3HG2      VAL 106   6.517  -5.948  -0.511
  814    H    ASP 107           H        ASP 107   9.341  -5.840  -3.888
  815    HA   ASP 107           HA       ASP 107   9.250  -7.536  -6.292
  816   1HB   ASP 107          2HB       ASP 107   9.369  -5.186  -6.920
  817   2HB   ASP 107          1HB       ASP 107  10.763  -4.950  -5.874
  818    H    TYR 108           H        TYR 108  10.894  -8.926  -6.599
  819    HA   TYR 108           HA       TYR 108  13.013  -9.026  -4.561
  820   1HB   TYR 108          2HB       TYR 108  11.254 -11.290  -5.513
  821   2HB   TYR 108          1HB       TYR 108  12.800 -11.566  -4.719
  822    HD1  TYR 108           1HD      TYR 108   9.315 -11.041  -4.240
  823    HD2  TYR 108           2HD      TYR 108  13.104 -10.520  -2.377
  824    HE1  TYR 108           1HE      TYR 108   8.211 -10.881  -2.048
  825    HE2  TYR 108           2HE      TYR 108  12.011 -10.361  -0.182
  826    HH   TYR 108           HH       TYR 108  10.049 -10.786   0.945
  827    H    ASP 109           H        ASP 109  14.780 -10.661  -5.327
  828    HA   ASP 109           HA       ASP 109  15.307  -9.994  -8.136
  829   1HB   ASP 109          2HB       ASP 109  16.931  -9.176  -6.421
  830   2HB   ASP 109          1HB       ASP 109  17.273 -10.854  -6.005
  831    H    ARG 110           H        ARG 110  16.268 -11.596  -9.482
  832    HA   ARG 110           HA       ARG 110  14.989 -14.109  -9.268
  833   1HB   ARG 110          2HB       ARG 110  16.701 -12.732 -11.184
  834   2HB   ARG 110          1HB       ARG 110  17.007 -14.462 -11.125
  835   1HG   ARG 110          2HG       ARG 110  15.382 -14.343 -12.735
  836   2HG   ARG 110          1HG       ARG 110  14.412 -14.645 -11.291
  837   1HD   ARG 110          2HD       ARG 110  14.970 -11.820 -12.018
  838   2HD   ARG 110          1HD       ARG 110  13.824 -12.712 -13.019
  839    HE   ARG 110           HE       ARG 110  13.495 -11.944 -10.228
  840   1HH1  ARG 110          1HH1      ARG 110  12.231 -13.643 -13.024
  841   2HH1  ARG 110          2HH1      ARG 110  10.633 -13.814 -12.344
  842   1HH2  ARG 110          1HH2      ARG 110  11.396 -12.189  -9.338
  843   2HH2  ARG 110          2HH2      ARG 110  10.174 -13.013 -10.249
  844    H    SER 111           H        SER 111  18.151 -12.975  -8.238
  845    HA   SER 111           HA       SER 111  18.798 -15.735  -7.444
  846   1HB   SER 111          2HB       SER 111  20.993 -13.827  -8.110
  847   2HB   SER 111          1HB       SER 111  20.946 -15.583  -8.261
  848    HG   SER 111           HG       SER 111  19.662 -15.374 -10.084
  849    H    GLY 112           H        GLY 112  18.907 -12.323  -6.703
  850   1HA   GLY 112          2HA       GLY 112  20.456 -12.714  -4.269
  851   2HA   GLY 112          1HA       GLY 112  19.837 -11.188  -4.878
  852    H    ARG 113           H        ARG 113  17.175 -12.730  -5.151
  853    HA   ARG 113           HA       ARG 113  15.276 -13.065  -4.013
  854   1HB   ARG 113          2HB       ARG 113  16.928 -14.510  -2.580
  855   2HB   ARG 113          1HB       ARG 113  16.671 -13.268  -1.370
  856   1HG   ARG 113          2HG       ARG 113  14.118 -13.811  -2.142
  857   2HG   ARG 113          1HG       ARG 113  14.891 -15.390  -2.299
  858   1HD   ARG 113          2HD       ARG 113  15.096 -15.638  -0.078
  859   2HD   ARG 113          1HD       ARG 113  15.579 -13.959   0.159
  860    HE   ARG 113           HE       ARG 113  12.825 -14.087  -0.470
  861   1HH1  ARG 113          1HH1      ARG 113  15.041 -14.841   2.144
  862   2HH1  ARG 113          2HH1      ARG 113  13.858 -14.573   3.384
  863   1HH2  ARG 113          1HH2      ARG 113  11.277 -13.726   1.164
  864   2HH2  ARG 113          2HH2      ARG 113  11.728 -13.915   2.836
  865    H    SER 114           H        SER 114  16.533 -11.564  -1.038
  866    HA   SER 114           HA       SER 114  14.455  -9.578  -1.477
  867   1HB   SER 114          2HB       SER 114  15.689  -9.609   1.162
  868   2HB   SER 114          1HB       SER 114  13.996  -9.809   0.707
  869    HG   SER 114           HG       SER 114  15.631 -11.670   1.565
  870    H    LEU 115           H        LEU 115  16.021  -8.461  -2.979
  871    HA   LEU 115           HA       LEU 115  18.016  -6.791  -1.827
  872   1HB   LEU 115          2HB       LEU 115  16.867  -5.268  -3.864
  873   2HB   LEU 115          1HB       LEU 115  18.306  -6.256  -3.970
  874    HG   LEU 115           HG       LEU 115  16.754  -8.177  -4.633
  875   1HD1  LEU 115          1HD1      LEU 115  14.630  -7.334  -3.975
  876   2HD1  LEU 115          2HD1      LEU 115  14.645  -7.362  -5.738
  877   3HD1  LEU 115          3HD1      LEU 115  14.873  -5.835  -4.877
  878   1HD2  LEU 115          1HD2      LEU 115  16.952  -7.628  -6.885
  879   2HD2  LEU 115          2HD2      LEU 115  18.237  -6.699  -6.110
  880   3HD2  LEU 115          3HD2      LEU 115  16.736  -5.903  -6.582
  881    H    GLY 116           H        GLY 116  14.572  -6.261  -2.526
  882   1HA   GLY 116          2HA       GLY 116  13.211  -5.676  -0.569
  883   2HA   GLY 116          1HA       GLY 116  14.511  -4.590  -0.103
  884    H    THR 117           H        THR 117  13.421  -4.974  -3.398
  885    HA   THR 117           HA       THR 117  12.477  -2.256  -3.534
  886    HB   THR 117           HB       THR 117  11.656  -3.953  -5.747
  887    HG1  THR 117           1HG      THR 117  13.476  -4.940  -6.224
  888   1HG2  THR 117          1HG2      THR 117  12.111  -2.082  -6.866
  889   2HG2  THR 117          2HG2      THR 117  13.793  -2.112  -6.340
  890   3HG2  THR 117          3HG2      THR 117  12.568  -1.344  -5.330
  891    H    ALA 118           H        ALA 118  10.260  -1.696  -3.999
  892    HA   ALA 118           HA       ALA 118   8.233  -3.698  -3.978
  893   1HB   ALA 118          1HB       ALA 118   7.182  -2.409  -1.851
  894   2HB   ALA 118          2HB       ALA 118   8.898  -2.322  -1.446
  895   3HB   ALA 118          3HB       ALA 118   8.137  -3.889  -1.721
  896    H    ASP 119           H        ASP 119   6.046  -2.685  -3.940
  897    HA   ASP 119           HA       ASP 119   5.984   0.076  -4.890
  898   1HB   ASP 119          2HB       ASP 119   6.090  -0.840  -7.009
  899   2HB   ASP 119          1HB       ASP 119   5.401  -2.372  -6.498
  900    H    VAL 120           H        VAL 120   4.632   0.899  -3.362
  901    HA   VAL 120           HA       VAL 120   2.267  -0.719  -2.688
  902    HB   VAL 120           HB       VAL 120   2.263   0.084  -0.493
  903   1HG1  VAL 120          1HG1      VAL 120   4.947   0.062  -0.003
  904   2HG1  VAL 120          2HG1      VAL 120   4.856  -0.765  -1.559
  905   3HG1  VAL 120          3HG1      VAL 120   3.938  -1.374  -0.181
  906   1HG2  VAL 120          1HG2      VAL 120   4.102   2.234  -1.478
  907   2HG2  VAL 120          2HG2      VAL 120   3.868   1.902   0.240
  908   3HG2  VAL 120          3HG2      VAL 120   2.501   2.408  -0.757
  909    H    HIS 121           H        HIS 121   0.321   0.544  -2.096
  910    HA   HIS 121           HA       HIS 121   0.121   2.977  -3.743
  911   1HB   HIS 121          2HB       HIS 121  -1.184   0.375  -4.075
  912   2HB   HIS 121          1HB       HIS 121  -2.316   1.722  -4.039
  913    HD1  HIS 121           1HD      HIS 121   0.213   0.070  -6.161
  914    HD2  HIS 121           2HD      HIS 121  -1.948   3.625  -6.141
  915    HE1  HIS 121           1HE      HIS 121   0.414   1.004  -8.490
  916    HE2  HIS 121           2HE      HIS 121  -1.056   3.056  -8.500
  917    H    PHE 122           H        PHE 122  -0.721   4.618  -2.594
  918    HA   PHE 122           HA       PHE 122  -2.572   3.985  -0.405
  919   1HB   PHE 122          2HB       PHE 122  -1.694   6.784  -0.943
  920   2HB   PHE 122          1HB       PHE 122  -1.996   5.980   0.593
  921    HD1  PHE 122           1HD      PHE 122  -0.278   4.179   1.301
  922    HD2  PHE 122           2HD      PHE 122   0.470   7.156  -1.645
  923    HE1  PHE 122           1HE      PHE 122   2.143   3.883   1.619
  924    HE2  PHE 122           2HE      PHE 122   2.891   6.865  -1.330
  925    HZ   PHE 122           HZ       PHE 122   3.730   5.229   0.306
  926    H    GLU 123           H        GLU 123  -4.557   5.210  -0.233
  927    HA   GLU 123           HA       GLU 123  -5.862   5.470  -2.781
  928   1HB   GLU 123          2HB       GLU 123  -7.470   6.474  -0.621
  929   2HB   GLU 123          1HB       GLU 123  -7.708   5.037  -1.604
  930   1HG   GLU 123          2HG       GLU 123  -6.116   3.843  -0.085
  931   2HG   GLU 123          1HG       GLU 123  -6.144   5.268   0.954
  932    H    ARG 124           H        ARG 124  -4.498   7.616  -0.408
  933    HA   ARG 124           HA       ARG 124  -5.675   9.952  -1.738
  934   1HB   ARG 124          2HB       ARG 124  -5.043   9.286   0.994
  935   2HB   ARG 124          1HB       ARG 124  -4.186  10.743   0.517
  936   1HG   ARG 124          2HG       ARG 124  -6.042  11.850   1.011
  937   2HG   ARG 124          1HG       ARG 124  -6.743  11.143  -0.447
  938   1HD   ARG 124          2HD       ARG 124  -6.802   9.373   1.879
  939   2HD   ARG 124          1HD       ARG 124  -7.730  10.856   2.089
  940    HE   ARG 124           HE       ARG 124  -8.804  10.207  -0.118
  941   1HH1  ARG 124          1HH1      ARG 124  -7.585   7.880   2.204
  942   2HH1  ARG 124          2HH1      ARG 124  -8.635   6.595   1.664
  943   1HH2  ARG 124          1HH2      ARG 124 -10.219   8.552  -0.801
  944   2HH2  ARG 124          2HH2      ARG 124 -10.150   6.988  -0.040
  945    H    ARG 125           H        ARG 125  -4.397  11.401  -2.827
  946    HA   ARG 125           HA       ARG 125  -1.767  10.695  -3.560
  947   1HB   ARG 125          2HB       ARG 125  -3.243  13.320  -3.805
  948   2HB   ARG 125          1HB       ARG 125  -1.695  12.977  -4.565
  949   1HG   ARG 125          2HG       ARG 125  -2.739  12.114  -6.303
  950   2HG   ARG 125          1HG       ARG 125  -3.474  10.892  -5.264
  951   1HD   ARG 125          2HD       ARG 125  -5.069  12.322  -6.611
  952   2HD   ARG 125          1HD       ARG 125  -5.383  12.224  -4.879
  953    HE   ARG 125           HE       ARG 125  -4.062  14.445  -4.845
  954   1HH1  ARG 125          1HH1      ARG 125  -6.232  13.403  -7.405
  955   2HH1  ARG 125          2HH1      ARG 125  -6.681  15.022  -7.851
  956   1HH2  ARG 125          1HH2      ARG 125  -4.637  16.557  -5.442
  957   2HH2  ARG 125          2HH2      ARG 125  -5.749  16.821  -6.753
  958    H    ALA 126           H        ALA 126  -3.077  12.814  -1.085
  959    HA   ALA 126           HA       ALA 126  -0.736  14.205  -0.413
  960   1HB   ALA 126          1HB       ALA 126  -3.298  13.622   0.938
  961   2HB   ALA 126          2HB       ALA 126  -2.496  15.163   0.636
  962   3HB   ALA 126          3HB       ALA 126  -1.949  14.129   1.957
  963    H    ASP 127           H        ASP 127  -1.828  10.999   0.426
  964    HA   ASP 127           HA       ASP 127  -0.016  10.529   2.551
  965   1HB   ASP 127          2HB       ASP 127  -1.708   8.820   0.790
  966   2HB   ASP 127          1HB       ASP 127  -0.388   8.039   1.657
  967    H    ALA 128           H        ALA 128   0.214  10.301  -0.923
  968    HA   ALA 128           HA       ALA 128   2.826   9.063  -0.904
  969   1HB   ALA 128          1HB       ALA 128   2.711   9.795  -3.387
  970   2HB   ALA 128          2HB       ALA 128   1.025  10.171  -3.031
  971   3HB   ALA 128          3HB       ALA 128   1.626   8.525  -2.824
  972    H    LEU 129           H        LEU 129   1.434  12.257  -1.383
  973    HA   LEU 129           HA       LEU 129   3.768  13.682  -1.982
  974   1HB   LEU 129          2HB       LEU 129   1.573  14.686  -2.200
  975   2HB   LEU 129          1HB       LEU 129   1.300  14.549  -0.473
  976    HG   LEU 129           HG       LEU 129   3.699  16.061  -0.966
  977   1HD1  LEU 129          1HD1      LEU 129   1.428  17.642  -1.942
  978   2HD1  LEU 129          2HD1      LEU 129   2.017  16.410  -3.056
  979   3HD1  LEU 129          3HD1      LEU 129   3.117  17.645  -2.445
  980   1HD2  LEU 129          1HD2      LEU 129   2.442  17.745   0.357
  981   2HD2  LEU 129          2HD2      LEU 129   2.498  16.150   1.109
  982   3HD2  LEU 129          3HD2      LEU 129   1.031  16.688   0.288
  983    H    LYS 130           H        LYS 130   2.259  12.933   1.127
  984    HA   LYS 130           HA       LYS 130   4.188  14.140   2.774
  985   1HB   LYS 130          2HB       LYS 130   2.353  13.612   4.017
  986   2HB   LYS 130          1HB       LYS 130   2.015  12.155   3.095
  987   1HG   LYS 130          2HG       LYS 130   4.329  11.503   4.411
  988   2HG   LYS 130          1HG       LYS 130   3.472  12.497   5.593
  989   1HD   LYS 130          2HD       LYS 130   2.250  10.155   4.135
  990   2HD   LYS 130          1HD       LYS 130   2.953  10.062   5.752
  991   1HE   LYS 130          2HE       LYS 130   1.338  11.680   6.571
  992   2HE   LYS 130          1HE       LYS 130   0.665  11.859   4.951
  993   1HZ   LYS 130          1HZ       LYS 130  -0.456   9.923   5.104
  994   2HZ   LYS 130          2HZ       LYS 130  -0.336  10.216   6.773
  995   3HZ   LYS 130          3HZ       LYS 130   0.749   9.156   6.021
  996    H    ALA 131           H        ALA 131   3.935  10.872   1.435
  997    HA   ALA 131           HA       ALA 131   6.146   9.790   2.813
  998   1HB   ALA 131          1HB       ALA 131   5.966   7.907   1.393
  999   2HB   ALA 131          2HB       ALA 131   5.188   8.852   0.121
 1000   3HB   ALA 131          3HB       ALA 131   4.321   8.509   1.618
 1001    H    MET 132           H        MET 132   5.916  11.515  -0.275
 1002    HA   MET 132           HA       MET 132   8.645  10.967  -0.955
 1003   1HB   MET 132          2HB       MET 132   8.276  12.151  -2.918
 1004   2HB   MET 132          1HB       MET 132   6.681  11.515  -2.553
 1005   1HG   MET 132          2HG       MET 132   5.960  13.638  -1.716
 1006   2HG   MET 132          1HG       MET 132   7.589  14.297  -1.860
 1007   1HE   MET 132          1HE       MET 132   4.324  13.389  -3.402
 1008   2HE   MET 132          2HE       MET 132   5.149  12.246  -4.463
 1009   3HE   MET 132          3HE       MET 132   4.465  13.731  -5.126
 1010    H    LYS 133           H        LYS 133   6.990  13.366   0.924
 1011    HA   LYS 133           HA       LYS 133   9.231  15.192   0.890
 1012   1HB   LYS 133          2HB       LYS 133   6.464  15.208   1.820
 1013   2HB   LYS 133          1HB       LYS 133   7.567  15.952   2.970
 1014   1HG   LYS 133          2HG       LYS 133   6.801  17.693   1.597
 1015   2HG   LYS 133          1HG       LYS 133   8.437  17.334   1.041
 1016   1HD   LYS 133          2HD       LYS 133   7.718  16.459  -0.943
 1017   2HD   LYS 133          1HD       LYS 133   6.182  15.907  -0.268
 1018   1HE   LYS 133          2HE       LYS 133   5.293  17.658  -1.341
 1019   2HE   LYS 133          1HE       LYS 133   5.971  18.621  -0.029
 1020   1HZ   LYS 133          1HZ       LYS 133   8.045  18.330  -1.776
 1021   2HZ   LYS 133          2HZ       LYS 133   7.067  19.704  -1.614
 1022   3HZ   LYS 133          3HZ       LYS 133   6.705  18.540  -2.795
 1023    H    GLN 134           H        GLN 134   7.704  12.980   3.186
 1024    HA   GLN 134           HA       GLN 134   9.704  13.619   5.197
 1025   1HB   GLN 134          2HB       GLN 134   7.025  12.454   5.173
 1026   2HB   GLN 134          1HB       GLN 134   8.128  11.634   6.270
 1027   1HG   GLN 134          2HG       GLN 134   6.735  13.554   7.195
 1028   2HG   GLN 134          1HG       GLN 134   8.459  13.541   7.561
 1029   1HE2  GLN 134          1HE2      GLN 134   5.935  15.052   5.686
 1030   2HE2  GLN 134          2HE2      GLN 134   6.820  16.487   5.294
 1031    H    TYR 135           H        TYR 135   8.564  10.681   3.508
 1032    HA   TYR 135           HA       TYR 135  10.560   9.066   4.802
 1033   1HB   TYR 135          2HB       TYR 135   8.162   8.468   3.738
 1034   2HB   TYR 135          1HB       TYR 135   9.191   8.043   2.376
 1035    HD1  TYR 135           1HD      TYR 135  11.344   7.450   4.872
 1036    HD2  TYR 135           2HD      TYR 135   7.636   5.917   3.462
 1037    HE1  TYR 135           1HE      TYR 135  11.850   5.285   5.919
 1038    HE2  TYR 135           2HE      TYR 135   8.127   3.748   4.511
 1039    HH   TYR 135           HH       TYR 135   9.471   2.725   6.077
 1040    H    LYS 136           H        LYS 136   9.996  10.015   1.404
 1041    HA   LYS 136           HA       LYS 136  12.367   8.857   0.430
 1042   1HB   LYS 136          2HB       LYS 136  10.485   9.460  -1.026
 1043   2HB   LYS 136          1HB       LYS 136  10.780  11.165  -0.709
 1044   1HG   LYS 136          2HG       LYS 136  13.183  10.550  -1.611
 1045   2HG   LYS 136          1HG       LYS 136  12.286   9.259  -2.412
 1046   1HD   LYS 136          2HD       LYS 136  10.727  11.497  -2.852
 1047   2HD   LYS 136          1HD       LYS 136  12.376  12.108  -3.000
 1048   1HE   LYS 136          2HE       LYS 136  12.259   9.624  -4.353
 1049   2HE   LYS 136          1HE       LYS 136  10.860  10.569  -4.862
 1050   1HZ   LYS 136          1HZ       LYS 136  12.169  12.177  -5.794
 1051   2HZ   LYS 136          2HZ       LYS 136  13.139  10.815  -6.072
 1052   3HZ   LYS 136          3HZ       LYS 136  13.497  11.863  -4.787
 1053    H    GLY 137           H        GLY 137  14.370   9.390   1.010
 1054   1HA   GLY 137          2HA       GLY 137  16.059  11.168   0.539
 1055   2HA   GLY 137          1HA       GLY 137  14.973  12.248   1.409
 1056    H    VAL 138           H        VAL 138  14.464   9.633   3.076
 1057    HA   VAL 138           HA       VAL 138  16.165  10.414   5.224
 1058    HB   VAL 138           HB       VAL 138  13.860   9.506   5.532
 1059   1HG1  VAL 138          1HG1      VAL 138  15.136   7.076   4.427
 1060   2HG1  VAL 138          2HG1      VAL 138  13.479   7.662   4.274
 1061   3HG1  VAL 138          3HG1      VAL 138  13.998   6.857   5.756
 1062   1HG2  VAL 138          1HG2      VAL 138  14.862   7.735   7.353
 1063   2HG2  VAL 138          2HG2      VAL 138  14.738   9.477   7.585
 1064   3HG2  VAL 138          3HG2      VAL 138  16.254   8.769   7.032
 1065    HA   PRO 139           HA       PRO 139  19.574   7.619   4.380
 1066   1HB   PRO 139          2HB       PRO 139  20.681   8.713   6.842
 1067   2HB   PRO 139          1HB       PRO 139  21.293   8.867   5.195
 1068   1HG   PRO 139          2HG       PRO 139  20.255  10.955   6.587
 1069   2HG   PRO 139          1HG       PRO 139  20.169  10.831   4.822
 1070   1HD   PRO 139          2HD       PRO 139  18.068  10.227   6.869
 1071   2HD   PRO 139          1HD       PRO 139  17.910  11.044   5.299
 1072    H    LEU 140           H        LEU 140  19.335   5.509   5.012
 1073    HA   LEU 140           HA       LEU 140  18.426   5.058   7.760
 1074   1HB   LEU 140          2HB       LEU 140  16.740   4.825   5.661
 1075   2HB   LEU 140          1HB       LEU 140  17.438   3.215   5.666
 1076    HG   LEU 140           HG       LEU 140  16.822   3.250   8.208
 1077   1HD1  LEU 140          1HD1      LEU 140  14.562   4.530   8.354
 1078   2HD1  LEU 140          2HD1      LEU 140  15.257   5.527   7.075
 1079   3HD1  LEU 140          3HD1      LEU 140  16.077   5.390   8.629
 1080   1HD2  LEU 140          1HD2      LEU 140  15.008   2.818   5.865
 1081   2HD2  LEU 140          2HD2      LEU 140  14.432   2.556   7.511
 1082   3HD2  LEU 140          3HD2      LEU 140  15.802   1.630   6.897
 1083    H    ASP 141           H        ASP 141  19.751   3.728   8.773
 1084    HA   ASP 141           HA       ASP 141  21.634   2.522   9.155
 1085   1HB   ASP 141          2HB       ASP 141  20.074   0.708   8.600
 1086   2HB   ASP 141          1HB       ASP 141  20.498   0.856   6.897
 1087    H    GLY 142           H        GLY 142  22.789   4.489   8.204
 1088   1HA   GLY 142          2HA       GLY 142  24.991   4.706   7.410
 1089   2HA   GLY 142          1HA       GLY 142  24.725   3.331   6.352
 1090    H    ARG 143           H        ARG 143  22.618   3.937   4.822
 1091    HA   ARG 143           HA       ARG 143  23.345   6.510   3.596
 1092   1HB   ARG 143          2HB       ARG 143  23.788   5.565   1.547
 1093   2HB   ARG 143          1HB       ARG 143  24.358   4.283   2.606
 1094   1HG   ARG 143          2HG       ARG 143  21.527   4.161   1.739
 1095   2HG   ARG 143          1HG       ARG 143  22.765   3.833   0.526
 1096   1HD   ARG 143          2HD       ARG 143  22.618   1.729   1.315
 1097   2HD   ARG 143          1HD       ARG 143  23.689   2.340   2.574
 1098    HE   ARG 143           HE       ARG 143  21.328   2.862   3.664
 1099   1HH1  ARG 143          1HH1      ARG 143  22.371  -0.015   1.958
 1100   2HH1  ARG 143          2HH1      ARG 143  21.391  -1.086   2.915
 1101   1HH2  ARG 143          1HH2      ARG 143  20.045   1.454   4.918
 1102   2HH2  ARG 143          2HH2      ARG 143  20.076  -0.251   4.588
 1103    HA   PRO 144           HA       PRO 144  19.004   7.330   3.063
 1104   1HB   PRO 144          2HB       PRO 144  19.683   8.015   0.247
 1105   2HB   PRO 144          1HB       PRO 144  18.833   8.972   1.466
 1106   1HG   PRO 144          2HG       PRO 144  21.351   9.537   0.808
 1107   2HG   PRO 144          1HG       PRO 144  20.800   9.656   2.490
 1108   1HD   PRO 144          2HD       PRO 144  22.449   7.537   1.178
 1109   2HD   PRO 144          1HD       PRO 144  22.576   8.216   2.814
 1110    H    MET 145           H        MET 145  17.422   5.921   2.717
 1111    HA   MET 145           HA       MET 145  17.863   3.619   1.045
 1112   1HB   MET 145          2HB       MET 145  15.843   2.748   1.942
 1113   2HB   MET 145          1HB       MET 145  16.650   3.578   3.264
 1114   1HG   MET 145          2HG       MET 145  15.174   5.491   2.981
 1115   2HG   MET 145          1HG       MET 145  14.382   4.689   1.626
 1116   1HE   MET 145          1HE       MET 145  13.652   1.814   2.300
 1117   2HE   MET 145          2HE       MET 145  12.562   3.087   1.748
 1118   3HE   MET 145          3HE       MET 145  12.120   2.089   3.134
 1119    H    ASP 146           H        ASP 146  15.937   2.918  -0.395
 1120    HA   ASP 146           HA       ASP 146  15.553   5.208  -2.200
 1121   1HB   ASP 146          2HB       ASP 146  16.672   2.841  -2.809
 1122   2HB   ASP 146          1HB       ASP 146  14.998   2.508  -3.250
 1123    H    ILE 147           H        ILE 147  13.708   6.060  -2.512
 1124    HA   ILE 147           HA       ILE 147  11.261   4.514  -2.526
 1125    HB   ILE 147           HB       ILE 147  10.422   6.690  -1.059
 1126   1HG1  ILE 147          2HG1      ILE 147  13.192   5.944  -0.240
 1127   2HG1  ILE 147          1HG1      ILE 147  12.389   7.509  -0.185
 1128   1HG2  ILE 147          1HG2      ILE 147  10.008   4.094  -0.971
 1129   2HG2  ILE 147          2HG2      ILE 147   9.627   5.127   0.408
 1130   3HG2  ILE 147          3HG2      ILE 147  11.123   4.190   0.393
 1131   1HD1  ILE 147          1HD1      ILE 147  10.972   6.157   1.671
 1132   2HD1  ILE 147          2HD1      ILE 147  12.395   7.139   2.021
 1133   3HD1  ILE 147          3HD1      ILE 147  12.553   5.392   1.835
 1134    H    GLN 148           H        GLN 148   9.612   5.563  -3.682
 1135    HA   GLN 148           HA       GLN 148  10.208   8.159  -4.873
 1136   1HB   GLN 148          2HB       GLN 148  10.023   5.588  -6.437
 1137   2HB   GLN 148          1HB       GLN 148   9.691   7.147  -7.176
 1138   1HG   GLN 148          2HG       GLN 148  12.087   7.635  -6.028
 1139   2HG   GLN 148          1HG       GLN 148  12.240   5.919  -6.406
 1140   1HE2  GLN 148          1HE2      GLN 148  12.949   5.449  -8.347
 1141   2HE2  GLN 148          2HE2      GLN 148  12.886   6.478  -9.738
 1142    H    LEU 149           H        LEU 149   8.342   9.267  -5.409
 1143    HA   LEU 149           HA       LEU 149   5.857   7.754  -4.970
 1144   1HB   LEU 149          2HB       LEU 149   6.758  10.385  -3.916
 1145   2HB   LEU 149          1HB       LEU 149   5.053  10.174  -4.265
 1146    HG   LEU 149           HG       LEU 149   5.295   9.681  -1.977
 1147   1HD1  LEU 149          1HD1      LEU 149   3.910   7.986  -2.316
 1148   2HD1  LEU 149          2HD1      LEU 149   5.319   6.924  -2.292
 1149   3HD1  LEU 149          3HD1      LEU 149   4.709   7.546  -3.825
 1150   1HD2  LEU 149          1HD2      LEU 149   7.468   9.379  -1.410
 1151   2HD2  LEU 149          2HD2      LEU 149   7.822   8.408  -2.839
 1152   3HD2  LEU 149          3HD2      LEU 149   6.987   7.683  -1.464
 1153    H    VAL 150           H        VAL 150   4.860   7.529  -6.810
 1154    HA   VAL 150           HA       VAL 150   4.825   9.806  -8.670
 1155    HB   VAL 150           HB       VAL 150   5.518   8.061  -9.999
 1156   1HG1  VAL 150          1HG1      VAL 150   3.999   6.358  -8.137
 1157   2HG1  VAL 150          2HG1      VAL 150   5.590   6.125  -8.862
 1158   3HG1  VAL 150          3HG1      VAL 150   4.135   5.782  -9.800
 1159   1HG2  VAL 150          1HG2      VAL 150   2.512   7.921 -10.190
 1160   2HG2  VAL 150          2HG2      VAL 150   3.639   7.323 -11.408
 1161   3HG2  VAL 150          3HG2      VAL 150   3.573   9.045 -11.040
 1162    H    ALA 151           H        ALA 151   3.272  11.076  -8.277
 1163    HA   ALA 151           HA       ALA 151   0.549  10.604  -8.400
 1164   1HB   ALA 151          1HB       ALA 151  -0.243  10.396  -6.223
 1165   2HB   ALA 151          2HB       ALA 151   1.259  10.983  -5.511
 1166   3HB   ALA 151          3HB       ALA 151   1.183   9.358  -6.191
 1167    H    SER 152           H        SER 152   2.368  12.440  -9.301
 1168    HA   SER 152           HA       SER 152   2.686  14.762  -7.730
 1169   1HB   SER 152          2HB       SER 152   2.661  15.316 -10.567
 1170   2HB   SER 152          1HB       SER 152   4.028  15.303  -9.449
 1171    HG   SER 152           HG       SER 152   3.878  13.683 -11.321
 1172    H    GLN 153           H        GLN 153   0.537  14.088 -10.469
 1173    HA   GLN 153           HA       GLN 153  -1.675  15.370  -9.167
 1174   1HB   GLN 153          2HB       GLN 153  -0.148  16.792 -11.231
 1175   2HB   GLN 153          1HB       GLN 153  -1.867  16.658 -11.581
 1176   1HG   GLN 153          2HG       GLN 153  -0.581  17.888  -9.167
 1177   2HG   GLN 153          1HG       GLN 153  -1.505  18.705 -10.426
 1178   1HE2  GLN 153          1HE2      GLN 153  -3.649  18.918 -10.178
 1179   2HE2  GLN 153          2HE2      GLN 153  -4.568  18.194  -8.893
 1180    H    ILE 154           H        ILE 154  -2.093  13.096  -9.410
 1181    HA   ILE 154           HA       ILE 154  -2.248  11.895 -12.001
 1182    HB   ILE 154           HB       ILE 154  -3.385   9.997 -10.694
 1183   1HG1  ILE 154          2HG1      ILE 154  -2.169  10.866  -8.201
 1184   2HG1  ILE 154          1HG1      ILE 154  -3.467  11.948  -8.697
 1185   1HG2  ILE 154          1HG2      ILE 154  -0.763  10.312  -9.462
 1186   2HG2  ILE 154          2HG2      ILE 154  -0.772  10.641 -11.194
 1187   3HG2  ILE 154          3HG2      ILE 154  -1.350   9.089 -10.587
 1188   1HD1  ILE 154          1HD1      ILE 154  -4.426  10.300  -7.302
 1189   2HD1  ILE 154          2HD1      ILE 154  -3.629   8.994  -8.182
 1190   3HD1  ILE 154          3HD1      ILE 154  -4.920   9.918  -8.952
 1191    H    ASP 155           H        ASP 155  -3.746  13.873 -12.494
 1192    HA   ASP 155           HA       ASP 155  -6.379  12.639 -12.804
 1193   1HB   ASP 155          2HB       ASP 155  -5.981  14.740 -11.033
 1194   2HB   ASP 155          1HB       ASP 155  -6.592  15.529 -12.484
 1195    H    LEU 156           H        LEU 156  -3.717  14.134 -14.125
 1196    HA   LEU 156           HA       LEU 156  -5.187  15.168 -16.442
 1197   1HB   LEU 156          2HB       LEU 156  -2.414  15.654 -15.380
 1198   2HB   LEU 156          1HB       LEU 156  -2.850  16.085 -17.024
 1199    HG   LEU 156           HG       LEU 156  -3.253  18.093 -16.054
 1200   1HD1  LEU 156          1HD1      LEU 156  -5.416  17.461 -16.879
 1201   2HD1  LEU 156          2HD1      LEU 156  -5.619  18.358 -15.375
 1202   3HD1  LEU 156          3HD1      LEU 156  -5.782  16.602 -15.384
 1203   1HD2  LEU 156          1HD2      LEU 156  -2.468  17.802 -13.901
 1204   2HD2  LEU 156          2HD2      LEU 156  -3.633  16.529 -13.537
 1205   3HD2  LEU 156          3HD2      LEU 156  -4.163  18.209 -13.631
 1206    H    GLU 157           H        GLU 157  -1.873  14.098 -16.402
 1207    HA   GLU 157           HA       GLU 157  -0.711  12.716 -17.772
 1208   1HB   GLU 157          2HB       GLU 157  -2.645  11.119 -16.213
 1209   2HB   GLU 157          1HB       GLU 157  -1.700  10.288 -17.448
 1210   1HG   GLU 157          2HG       GLU 157  -0.121  10.129 -15.896
 1211   2HG   GLU 157          1HG       GLU 157   0.180  11.827 -16.226
 1212    H    HIS 158           H        HIS 158  -1.312  13.696 -19.779
 1213    HA   HIS 158           HA       HIS 158  -2.958  11.887 -21.427
 1214   1HB   HIS 158          2HB       HIS 158  -2.392  14.834 -21.839
 1215   2HB   HIS 158          1HB       HIS 158  -3.239  13.809 -22.991
 1216    HD1  HIS 158           1HD      HIS 158  -3.951  16.232 -20.580
 1217    HD2  HIS 158           2HD      HIS 158  -5.597  12.514 -21.454
 1218    HE1  HIS 158           1HE      HIS 158  -6.258  16.257 -19.569
 1219    HE2  HIS 158           2HE      HIS 158  -7.180  13.946 -19.985
  Start of MODEL    9
    1    H    MET   1           H        MET   1 -67.588  90.853 -53.837
    2    HA   MET   1           HA       MET   1 -66.030  92.266 -55.908
    3   1HB   MET   1          2HB       MET   1 -65.120  91.433 -53.500
    4   2HB   MET   1          1HB       MET   1 -64.800  89.999 -54.464
    5   1HG   MET   1          2HG       MET   1 -63.700  91.681 -56.107
    6   2HG   MET   1          1HG       MET   1 -63.645  92.734 -54.696
    7   1HE   MET   1          1HE       MET   1 -63.609  90.722 -52.560
    8   2HE   MET   1          2HE       MET   1 -61.935  90.348 -52.150
    9   3HE   MET   1          3HE       MET   1 -62.928  89.152 -52.984
   10    H    ALA   2           H        ALA   2 -67.529  89.277 -54.928
   11    HA   ALA   2           HA       ALA   2 -68.111  87.378 -56.005
   12   1HB   ALA   2          1HB       ALA   2 -68.037  87.453 -58.592
   13   2HB   ALA   2          2HB       ALA   2 -67.694  89.168 -58.365
   14   3HB   ALA   2          3HB       ALA   2 -69.190  88.478 -57.736
   15    H    ASP   3           H        ASP   3 -65.210  88.378 -55.580
   16    HA   ASP   3           HA       ASP   3 -63.699  86.572 -57.282
   17   1HB   ASP   3          2HB       ASP   3 -63.112  88.969 -56.083
   18   2HB   ASP   3          1HB       ASP   3 -62.329  87.813 -55.013
   19    H    LYS   4           H        LYS   4 -65.188  86.622 -54.246
   20    HA   LYS   4           HA       LYS   4 -63.623  84.510 -53.068
   21   1HB   LYS   4          2HB       LYS   4 -66.344  85.369 -52.121
   22   2HB   LYS   4          1HB       LYS   4 -65.010  84.717 -51.181
   23   1HG   LYS   4          2HG       LYS   4 -63.765  86.862 -51.792
   24   2HG   LYS   4          1HG       LYS   4 -65.340  87.478 -52.297
   25   1HD   LYS   4          2HD       LYS   4 -66.219  87.317 -50.123
   26   2HD   LYS   4          1HD       LYS   4 -64.905  86.271 -49.581
   27   1HE   LYS   4          2HE       LYS   4 -63.631  88.016 -49.028
   28   2HE   LYS   4          1HE       LYS   4 -63.917  88.801 -50.579
   29   1HZ   LYS   4          1HZ       LYS   4 -66.101  89.532 -49.662
   30   2HZ   LYS   4          2HZ       LYS   4 -64.754  90.210 -48.887
   31   3HZ   LYS   4          3HZ       LYS   4 -65.611  88.950 -48.147
   32    H    MET   5           H        MET   5 -65.258  84.277 -55.676
   33    HA   MET   5           HA       MET   5 -67.343  82.413 -55.140
   34   1HB   MET   5          2HB       MET   5 -67.483  83.750 -57.126
   35   2HB   MET   5          1HB       MET   5 -65.904  83.206 -57.674
   36   1HG   MET   5          2HG       MET   5 -67.231  81.912 -58.980
   37   2HG   MET   5          1HG       MET   5 -67.055  80.852 -57.583
   38   1HE   MET   5          1HE       MET   5 -70.232  81.042 -55.681
   39   2HE   MET   5          2HE       MET   5 -68.497  80.725 -55.723
   40   3HE   MET   5          3HE       MET   5 -69.606  79.684 -56.615
   41    H    ASP   6           H        ASP   6 -64.072  82.103 -56.512
   42    HA   ASP   6           HA       ASP   6 -64.161  79.218 -56.359
   43   1HB   ASP   6          2HB       ASP   6 -62.381  81.246 -57.464
   44   2HB   ASP   6          1HB       ASP   6 -61.503  79.933 -56.689
   45    H    MET   7           H        MET   7 -63.456  81.784 -54.310
   46    HA   MET   7           HA       MET   7 -62.869  81.936 -52.128
   47   1HB   MET   7          2HB       MET   7 -63.468  79.049 -52.406
   48   2HB   MET   7          1HB       MET   7 -62.494  79.507 -51.016
   49   1HG   MET   7          2HG       MET   7 -64.235  81.108 -50.353
   50   2HG   MET   7          1HG       MET   7 -65.216  80.578 -51.718
   51   1HE   MET   7          1HE       MET   7 -66.323  77.256 -51.199
   52   2HE   MET   7          2HE       MET   7 -66.356  78.807 -52.040
   53   3HE   MET   7          3HE       MET   7 -67.401  78.538 -50.645
   54    H    SER   8           H        SER   8 -61.167  78.911 -52.255
   55    HA   SER   8           HA       SER   8 -58.647  80.269 -51.850
   56   1HB   SER   8          2HB       SER   8 -58.312  77.454 -52.168
   57   2HB   SER   8          1HB       SER   8 -58.237  78.398 -50.679
   58    HG   SER   8           HG       SER   8 -60.063  76.624 -51.365
   59    H    LEU   9           H        LEU   9 -59.360  81.095 -54.214
   60    HA   LEU   9           HA       LEU   9 -59.095  79.429 -56.437
   61   1HB   LEU   9          2HB       LEU   9 -58.757  81.532 -57.720
   62   2HB   LEU   9          1HB       LEU   9 -60.167  81.539 -56.678
   63    HG   LEU   9           HG       LEU   9 -57.947  82.640 -55.242
   64   1HD1  LEU   9          1HD1      LEU   9 -58.555  84.223 -57.707
   65   2HD1  LEU   9          2HD1      LEU   9 -57.238  83.050 -57.685
   66   3HD1  LEU   9          3HD1      LEU   9 -57.228  84.408 -56.561
   67   1HD2  LEU   9          1HD2      LEU   9 -60.434  83.956 -56.323
   68   2HD2  LEU   9          2HD2      LEU   9 -59.438  84.511 -54.977
   69   3HD2  LEU   9          3HD2      LEU   9 -60.360  83.014 -54.835
   70    H    ASP  10           H        ASP  10 -56.674  81.302 -54.676
   71    HA   ASP  10           HA       ASP  10 -54.574  80.986 -56.537
   72   1HB   ASP  10          2HB       ASP  10 -54.456  82.624 -54.719
   73   2HB   ASP  10          1HB       ASP  10 -54.425  81.323 -53.532
   74    H    ASP  11           H        ASP  11 -55.569  79.071 -53.741
   75    HA   ASP  11           HA       ASP  11 -53.452  77.191 -53.919
   76   1HB   ASP  11          2HB       ASP  11 -54.792  77.578 -51.861
   77   2HB   ASP  11          1HB       ASP  11 -56.174  76.824 -52.650
   78    H    ILE  12           H        ILE  12 -56.644  77.401 -55.368
   79    HA   ILE  12           HA       ILE  12 -56.693  74.802 -56.488
   80    HB   ILE  12           HB       ILE  12 -57.919  77.313 -57.634
   81   1HG1  ILE  12          2HG1      ILE  12 -59.343  75.215 -55.998
   82   2HG1  ILE  12          1HG1      ILE  12 -58.559  76.594 -55.235
   83   1HG2  ILE  12          1HG2      ILE  12 -58.947  76.041 -59.193
   84   2HG2  ILE  12          2HG2      ILE  12 -59.167  74.683 -58.090
   85   3HG2  ILE  12          3HG2      ILE  12 -57.610  74.926 -58.888
   86   1HD1  ILE  12          1HD1      ILE  12 -61.107  76.626 -55.890
   87   2HD1  ILE  12          2HD1      ILE  12 -60.455  77.126 -57.450
   88   3HD1  ILE  12          3HD1      ILE  12 -60.104  78.072 -56.004
   89    H    ILE  13           H        ILE  13 -55.710  77.938 -57.848
   90    HA   ILE  13           HA       ILE  13 -54.599  77.106 -60.245
   91    HB   ILE  13           HB       ILE  13 -53.579  79.250 -58.373
   92   1HG1  ILE  13          2HG1      ILE  13 -55.231  79.579 -60.879
   93   2HG1  ILE  13          1HG1      ILE  13 -55.953  79.411 -59.281
   94   1HG2  ILE  13          1HG2      ILE  13 -52.177  78.216 -60.468
   95   2HG2  ILE  13          2HG2      ILE  13 -52.005  79.859 -59.852
   96   3HG2  ILE  13          3HG2      ILE  13 -53.045  79.543 -61.240
   97   1HD1  ILE  13          1HD1      ILE  13 -53.873  81.481 -59.572
   98   2HD1  ILE  13          2HD1      ILE  13 -55.381  81.501 -58.658
   99   3HD1  ILE  13          3HD1      ILE  13 -55.402  81.766 -60.402
  100    H    LYS  14           H        LYS  14 -53.080  77.241 -57.048
  101    HA   LYS  14           HA       LYS  14 -50.565  76.242 -57.667
  102   1HB   LYS  14          2HB       LYS  14 -52.271  75.849 -55.211
  103   2HB   LYS  14          1HB       LYS  14 -50.592  75.337 -55.308
  104   1HG   LYS  14          2HG       LYS  14 -51.645  78.150 -55.493
  105   2HG   LYS  14          1HG       LYS  14 -50.708  77.443 -54.175
  106   1HD   LYS  14          2HD       LYS  14 -48.745  77.398 -55.434
  107   2HD   LYS  14          1HD       LYS  14 -49.613  77.535 -56.965
  108   1HE   LYS  14          2HE       LYS  14 -48.411  79.613 -56.262
  109   2HE   LYS  14          1HE       LYS  14 -50.137  79.826 -56.546
  110   1HZ   LYS  14          1HZ       LYS  14 -49.264  79.213 -53.819
  111   2HZ   LYS  14          2HZ       LYS  14 -50.555  80.179 -54.352
  112   3HZ   LYS  14          3HZ       LYS  14 -48.966  80.776 -54.411
  113    H    LEU  15           H        LEU  15 -53.375  74.364 -56.518
  114    HA   LEU  15           HA       LEU  15 -52.164  71.841 -56.907
  115   1HB   LEU  15          2HB       LEU  15 -54.513  72.800 -55.775
  116   2HB   LEU  15          1HB       LEU  15 -55.063  71.810 -57.113
  117    HG   LEU  15           HG       LEU  15 -53.392  70.047 -56.094
  118   1HD1  LEU  15          1HD1      LEU  15 -53.476  70.218 -53.586
  119   2HD1  LEU  15          2HD1      LEU  15 -53.964  71.900 -53.795
  120   3HD1  LEU  15          3HD1      LEU  15 -52.395  71.356 -54.390
  121   1HD2  LEU  15          1HD2      LEU  15 -55.665  69.502 -56.283
  122   2HD2  LEU  15          2HD2      LEU  15 -56.148  70.745 -55.130
  123   3HD2  LEU  15          3HD2      LEU  15 -55.297  69.306 -54.569
  124    H    ASN  16           H        ASN  16 -53.682  74.017 -59.073
  125    HA   ASN  16           HA       ASN  16 -54.473  72.201 -61.098
  126   1HB   ASN  16          2HB       ASN  16 -54.277  75.083 -60.763
  127   2HB   ASN  16          1HB       ASN  16 -53.792  74.583 -62.379
  128   1HD2  ASN  16          1HD2      ASN  16 -56.359  74.619 -60.043
  129   2HD2  ASN  16          2HD2      ASN  16 -57.649  74.305 -61.167
  130    H    ARG  17           H        ARG  17 -51.675  74.382 -60.884
  131    HA   ARG  17           HA       ARG  17 -50.319  73.142 -63.068
  132   1HB   ARG  17          2HB       ARG  17 -48.465  74.607 -62.509
  133   2HB   ARG  17          1HB       ARG  17 -49.974  75.508 -62.445
  134   1HG   ARG  17          2HG       ARG  17 -49.795  74.763 -59.878
  135   2HG   ARG  17          1HG       ARG  17 -48.081  74.821 -60.294
  136   1HD   ARG  17          2HD       ARG  17 -49.291  77.119 -61.401
  137   2HD   ARG  17          1HD       ARG  17 -49.875  76.973 -59.742
  138    HE   ARG  17           HE       ARG  17 -47.290  76.625 -59.337
  139   1HH1  ARG  17          1HH1      ARG  17 -48.893  78.912 -61.452
  140   2HH1  ARG  17          2HH1      ARG  17 -47.664  80.131 -61.279
  141   1HH2  ARG  17          1HH2      ARG  17 -45.636  78.197 -59.152
  142   2HH2  ARG  17          2HH2      ARG  17 -45.798  79.720 -59.982
  143    H    ASN  18           H        ASN  18 -50.433  72.648 -59.637
  144    HA   ASN  18           HA       ASN  18 -48.176  70.795 -59.743
  145   1HB   ASN  18          2HB       ASN  18 -48.845  72.536 -57.805
  146   2HB   ASN  18          1HB       ASN  18 -49.731  71.124 -57.235
  147   1HD2  ASN  18          1HD2      ASN  18 -48.366  69.056 -57.356
  148   2HD2  ASN  18          2HD2      ASN  18 -46.755  69.184 -56.715
  149    H    GLN  19           H        GLN  19 -50.905  70.403 -60.988
  150    HA   GLN  19           HA       GLN  19 -52.118  68.199 -59.695
  151   1HB   GLN  19          2HB       GLN  19 -52.514  69.675 -62.079
  152   2HB   GLN  19          1HB       GLN  19 -52.338  67.989 -62.555
  153   1HG   GLN  19          2HG       GLN  19 -54.090  67.405 -60.895
  154   2HG   GLN  19          1HG       GLN  19 -54.317  69.127 -60.597
  155   1HE2  GLN  19          1HE2      GLN  19 -56.020  66.931 -61.771
  156   2HE2  GLN  19          2HE2      GLN  19 -56.616  67.613 -63.254
  157    H    ARG  20           H        ARG  20 -49.385  68.594 -61.774
  158    HA   ARG  20           HA       ARG  20 -48.857  65.741 -61.925
  159   1HB   ARG  20          2HB       ARG  20 -46.929  67.915 -62.715
  160   2HB   ARG  20          1HB       ARG  20 -47.052  66.279 -63.344
  161   1HG   ARG  20          2HG       ARG  20 -48.118  67.193 -65.068
  162   2HG   ARG  20          1HG       ARG  20 -49.495  67.358 -63.977
  163   1HD   ARG  20          2HD       ARG  20 -48.457  69.591 -63.293
  164   2HD   ARG  20          1HD       ARG  20 -47.436  69.416 -64.719
  165    HE   ARG  20           HE       ARG  20 -50.138  69.050 -65.445
  166   1HH1  ARG  20          1HH1      ARG  20 -47.909  71.568 -64.451
  167   2HH1  ARG  20          2HH1      ARG  20 -48.744  72.826 -65.318
  168   1HH2  ARG  20          1HH2      ARG  20 -51.261  70.707 -66.550
  169   2HH2  ARG  20          2HH2      ARG  20 -50.661  72.339 -66.490
  170    H    ARG  21           H        ARG  21 -47.298  64.699 -60.739
  171    HA   ARG  21           HA       ARG  21 -45.829  64.264 -59.056
  172   1HB   ARG  21          2HB       ARG  21 -45.395  67.179 -59.380
  173   2HB   ARG  21          1HB       ARG  21 -44.941  66.497 -57.826
  174   1HG   ARG  21          2HG       ARG  21 -43.000  66.436 -59.136
  175   2HG   ARG  21          1HG       ARG  21 -43.610  64.779 -59.121
  176   1HD   ARG  21          2HD       ARG  21 -44.747  66.273 -61.310
  177   2HD   ARG  21          1HD       ARG  21 -42.986  66.343 -61.356
  178    HE   ARG  21           HE       ARG  21 -44.656  64.050 -61.848
  179   1HH1  ARG  21          1HH1      ARG  21 -41.462  65.145 -60.923
  180   2HH1  ARG  21          2HH1      ARG  21 -40.680  63.650 -61.341
  181   1HH2  ARG  21          1HH2      ARG  21 -43.637  62.076 -62.419
  182   2HH2  ARG  21          2HH2      ARG  21 -41.921  61.906 -62.198
  183    H    VAL  22           H        VAL  22 -47.756  67.129 -58.241
  184    HA   VAL  22           HA       VAL  22 -49.500  67.404 -56.827
  185    HB   VAL  22           HB       VAL  22 -49.464  64.576 -57.188
  186   1HG1  VAL  22          1HG1      VAL  22 -48.999  64.077 -54.965
  187   2HG1  VAL  22          2HG1      VAL  22 -50.762  64.051 -55.036
  188   3HG1  VAL  22          3HG1      VAL  22 -49.926  65.451 -54.362
  189   1HG2  VAL  22          1HG2      VAL  22 -51.180  66.584 -57.571
  190   2HG2  VAL  22          2HG2      VAL  22 -51.848  65.913 -56.083
  191   3HG2  VAL  22          3HG2      VAL  22 -51.672  64.891 -57.510
  192    H    ASN  23           H        ASN  23 -49.700  68.180 -54.800
  193    HA   ASN  23           HA       ASN  23 -47.403  68.009 -53.054
  194   1HB   ASN  23          2HB       ASN  23 -48.676  70.149 -53.416
  195   2HB   ASN  23          1HB       ASN  23 -50.036  69.427 -52.562
  196   1HD2  ASN  23          1HD2      ASN  23 -47.279  71.272 -52.250
  197   2HD2  ASN  23          2HD2      ASN  23 -47.088  71.190 -50.533
  198    H    ARG  24           H        ARG  24 -47.407  65.860 -52.422
  199    HA   ARG  24           HA       ARG  24 -49.036  65.246 -50.162
  200   1HB   ARG  24          2HB       ARG  24 -50.078  64.467 -52.654
  201   2HB   ARG  24          1HB       ARG  24 -49.397  63.008 -51.950
  202   1HG   ARG  24          2HG       ARG  24 -50.928  62.927 -50.289
  203   2HG   ARG  24          1HG       ARG  24 -51.066  64.683 -50.180
  204   1HD   ARG  24          2HD       ARG  24 -52.123  63.133 -52.527
  205   2HD   ARG  24          1HD       ARG  24 -53.085  63.406 -51.076
  206    HE   ARG  24           HE       ARG  24 -52.553  65.878 -51.581
  207   1HH1  ARG  24          1HH1      ARG  24 -53.077  63.386 -53.994
  208   2HH1  ARG  24          2HH1      ARG  24 -53.706  64.500 -55.175
  209   1HH2  ARG  24          1HH2      ARG  24 -53.363  67.335 -53.150
  210   2HH2  ARG  24          2HH2      ARG  24 -53.878  66.720 -54.701
  211    H    GLY  25           H        GLY  25 -48.080  63.739 -48.886
  212   1HA   GLY  25          2HA       GLY  25 -45.903  62.140 -50.036
  213   2HA   GLY  25          1HA       GLY  25 -45.569  63.161 -48.642
  214    H    GLY  26           H        GLY  26 -44.961  60.790 -48.035
  215   1HA   GLY  26          2HA       GLY  26 -47.029  59.946 -46.190
  216   2HA   GLY  26          1HA       GLY  26 -46.610  58.759 -47.420
  217    H    GLY  27           H        GLY  27 -46.214  58.008 -44.879
  218   1HA   GLY  27          2HA       GLY  27 -43.279  58.199 -44.609
  219   2HA   GLY  27          1HA       GLY  27 -44.324  58.351 -43.207
  220    HA   PRO  28           HA       PRO  28 -44.496  53.764 -44.239
  221   1HB   PRO  28          2HB       PRO  28 -43.629  52.990 -46.787
  222   2HB   PRO  28          1HB       PRO  28 -45.302  53.254 -46.295
  223   1HG   PRO  28          2HG       PRO  28 -43.816  54.787 -48.145
  224   2HG   PRO  28          1HG       PRO  28 -45.412  55.172 -47.483
  225   1HD   PRO  28          2HD       PRO  28 -42.734  56.189 -46.684
  226   2HD   PRO  28          1HD       PRO  28 -44.321  56.984 -46.610
  227    H    ARG  29           H        ARG  29 -42.135  53.326 -46.682
  228    HA   ARG  29           HA       ARG  29 -39.975  52.646 -46.695
  229   1HB   ARG  29          2HB       ARG  29 -40.051  54.850 -44.732
  230   2HB   ARG  29          1HB       ARG  29 -38.644  53.800 -44.628
  231   1HG   ARG  29          2HG       ARG  29 -37.739  54.661 -46.469
  232   2HG   ARG  29          1HG       ARG  29 -39.260  54.572 -47.360
  233   1HD   ARG  29          2HD       ARG  29 -38.755  56.857 -47.268
  234   2HD   ARG  29          1HD       ARG  29 -39.972  56.616 -46.016
  235    HE   ARG  29           HE       ARG  29 -38.426  57.198 -44.431
  236   1HH1  ARG  29          1HH1      ARG  29 -36.751  56.501 -47.437
  237   2HH1  ARG  29          2HH1      ARG  29 -35.216  57.089 -46.867
  238   1HH2  ARG  29          1HH2      ARG  29 -36.407  57.978 -43.678
  239   2HH2  ARG  29          2HH2      ARG  29 -35.019  57.920 -44.733
  240    H    ARG  30           H        ARG  30 -41.063  50.574 -46.012
  241    HA   ARG  30           HA       ARG  30 -40.525  49.757 -43.270
  242   1HB   ARG  30          2HB       ARG  30 -42.137  48.734 -45.526
  243   2HB   ARG  30          1HB       ARG  30 -41.432  47.509 -44.481
  244   1HG   ARG  30          2HG       ARG  30 -42.909  47.902 -42.868
  245   2HG   ARG  30          1HG       ARG  30 -42.674  49.647 -42.968
  246   1HD   ARG  30          2HD       ARG  30 -44.980  48.439 -43.601
  247   2HD   ARG  30          1HD       ARG  30 -44.441  49.942 -44.349
  248    HE   ARG  30           HE       ARG  30 -43.828  47.351 -45.604
  249   1HH1  ARG  30          1HH1      ARG  30 -45.445  50.462 -45.698
  250   2HH1  ARG  30          2HH1      ARG  30 -45.768  50.386 -47.408
  251   1HH2  ARG  30          1HH2      ARG  30 -44.250  47.253 -47.849
  252   2HH2  ARG  30          2HH2      ARG  30 -45.097  48.556 -48.625
  253    H    ASN  31           H        ASN  31 -38.160  50.308 -44.258
  254    HA   ASN  31           HA       ASN  31 -36.973  47.777 -45.157
  255   1HB   ASN  31          2HB       ASN  31 -35.095  48.981 -45.870
  256   2HB   ASN  31          1HB       ASN  31 -36.433  50.064 -46.242
  257   1HD2  ASN  31          1HD2      ASN  31 -33.434  49.866 -44.911
  258   2HD2  ASN  31          2HD2      ASN  31 -33.463  51.303 -43.933
  259    H    ARG  32           H        ARG  32 -37.631  49.491 -42.387
  260    HA   ARG  32           HA       ARG  32 -35.358  48.903 -40.810
  261   1HB   ARG  32          2HB       ARG  32 -38.207  49.451 -39.963
  262   2HB   ARG  32          1HB       ARG  32 -36.817  49.427 -38.887
  263   1HG   ARG  32          2HG       ARG  32 -35.875  51.346 -39.923
  264   2HG   ARG  32          1HG       ARG  32 -37.050  51.285 -41.238
  265   1HD   ARG  32          2HD       ARG  32 -38.261  52.731 -40.054
  266   2HD   ARG  32          1HD       ARG  32 -38.615  51.389 -38.965
  267    HE   ARG  32           HE       ARG  32 -36.170  52.493 -38.190
  268   1HH1  ARG  32          1HH1      ARG  32 -39.554  53.420 -38.340
  269   2HH1  ARG  32          2HH1      ARG  32 -39.439  54.519 -36.991
  270   1HH2  ARG  32          1HH2      ARG  32 -36.029  53.931 -36.418
  271   2HH2  ARG  32          2HH2      ARG  32 -37.427  54.833 -35.927
  272    HA   PRO  33           HA       PRO  33 -37.799  44.952 -39.431
  273   1HB   PRO  33          2HB       PRO  33 -39.786  44.085 -41.064
  274   2HB   PRO  33          1HB       PRO  33 -40.075  45.159 -39.691
  275   1HG   PRO  33          2HG       PRO  33 -39.804  45.829 -42.596
  276   2HG   PRO  33          1HG       PRO  33 -40.979  46.435 -41.413
  277   1HD   PRO  33          2HD       PRO  33 -38.800  47.853 -42.146
  278   2HD   PRO  33          1HD       PRO  33 -39.484  47.940 -40.510
  279    H    ALA  34           H        ALA  34 -35.571  44.865 -40.595
  280    HA   ALA  34           HA       ALA  34 -35.768  42.921 -42.803
  281   1HB   ALA  34          1HB       ALA  34 -34.440  44.280 -43.964
  282   2HB   ALA  34          2HB       ALA  34 -33.166  43.958 -42.789
  283   3HB   ALA  34          3HB       ALA  34 -34.234  45.345 -42.574
  284    H    ILE  35           H        ILE  35 -35.766  42.613 -39.844
  285    HA   ILE  35           HA       ILE  35 -33.249  41.509 -39.070
  286    HB   ILE  35           HB       ILE  35 -35.980  41.172 -37.813
  287   1HG1  ILE  35          2HG1      ILE  35 -34.566  42.806 -36.154
  288   2HG1  ILE  35          1HG1      ILE  35 -33.949  43.311 -37.724
  289   1HG2  ILE  35          1HG2      ILE  35 -34.735  40.543 -35.785
  290   2HG2  ILE  35          2HG2      ILE  35 -33.235  40.589 -36.713
  291   3HG2  ILE  35          3HG2      ILE  35 -34.485  39.409 -37.113
  292   1HD1  ILE  35          1HD1      ILE  35 -36.264  43.705 -38.469
  293   2HD1  ILE  35          2HD1      ILE  35 -35.804  44.701 -37.087
  294   3HD1  ILE  35          3HD1      ILE  35 -36.829  43.285 -36.852
  295    H    ALA  36           H        ALA  36 -36.432  40.088 -39.721
  296    HA   ALA  36           HA       ALA  36 -37.120  38.075 -40.494
  297   1HB   ALA  36          1HB       ALA  36 -35.216  36.692 -41.712
  298   2HB   ALA  36          2HB       ALA  36 -34.400  38.256 -41.673
  299   3HB   ALA  36          3HB       ALA  36 -35.970  38.100 -42.462
  300    H    ARG  37           H        ARG  37 -33.805  37.082 -39.790
  301    HA   ARG  37           HA       ARG  37 -34.668  35.743 -37.350
  302   1HB   ARG  37          2HB       ARG  37 -34.214  34.376 -39.856
  303   2HB   ARG  37          1HB       ARG  37 -33.041  33.852 -38.656
  304   1HG   ARG  37          2HG       ARG  37 -34.551  32.588 -37.651
  305   2HG   ARG  37          1HG       ARG  37 -35.662  33.950 -37.490
  306   1HD   ARG  37          2HD       ARG  37 -36.953  33.171 -39.123
  307   2HD   ARG  37          1HD       ARG  37 -35.575  33.033 -40.214
  308    HE   ARG  37           HE       ARG  37 -35.608  30.902 -38.332
  309   1HH1  ARG  37          1HH1      ARG  37 -37.189  32.025 -41.254
  310   2HH1  ARG  37          2HH1      ARG  37 -37.588  30.419 -41.799
  311   1HH2  ARG  37          1HH2      ARG  37 -36.140  28.817 -39.025
  312   2HH2  ARG  37          2HH2      ARG  37 -37.006  28.586 -40.519
  313    H    GLY  38           H        GLY  38 -32.897  37.975 -38.255
  314   1HA   GLY  38          2HA       GLY  38 -30.920  38.877 -37.486
  315   2HA   GLY  38          1HA       GLY  38 -30.665  37.407 -36.553
  316    H    GLY  39           H        GLY  39 -29.097  36.088 -37.189
  317   1HA   GLY  39          2HA       GLY  39 -28.103  36.375 -39.956
  318   2HA   GLY  39          1HA       GLY  39 -27.098  35.914 -38.586
  319    H    ARG  40           H        ARG  40 -30.212  34.577 -38.555
  320    HA   ARG  40           HA       ARG  40 -29.130  31.938 -38.786
  321   1HB   ARG  40          2HB       ARG  40 -31.931  32.973 -38.390
  322   2HB   ARG  40          1HB       ARG  40 -31.556  31.258 -38.507
  323   1HG   ARG  40          2HG       ARG  40 -30.087  31.445 -36.569
  324   2HG   ARG  40          1HG       ARG  40 -30.467  33.165 -36.451
  325   1HD   ARG  40          2HD       ARG  40 -32.772  32.682 -35.992
  326   2HD   ARG  40          1HD       ARG  40 -32.517  30.962 -36.294
  327    HE   ARG  40           HE       ARG  40 -31.848  32.444 -33.904
  328   1HH1  ARG  40          1HH1      ARG  40 -31.343  29.521 -35.764
  329   2HH1  ARG  40          2HH1      ARG  40 -30.691  28.618 -34.433
  330   1HH2  ARG  40          1HH2      ARG  40 -30.989  31.272 -32.141
  331   2HH2  ARG  40          2HH2      ARG  40 -30.500  29.612 -32.363
  332    H    ASN  41           H        ASN  41 -28.631  31.114 -40.635
  333    HA   ASN  41           HA       ASN  41 -28.689  30.389 -42.768
  334   1HB   ASN  41          2HB       ASN  41 -30.918  29.499 -41.665
  335   2HB   ASN  41          1HB       ASN  41 -31.663  30.570 -42.848
  336   1HD2  ASN  41          1HD2      ASN  41 -32.557  28.650 -43.766
  337   2HD2  ASN  41          2HD2      ASN  41 -31.604  27.680 -44.842
  338    H    ARG  42           H        ARG  42 -27.768  32.458 -43.340
  339    HA   ARG  42           HA       ARG  42 -29.097  33.531 -45.606
  340   1HB   ARG  42          2HB       ARG  42 -30.339  34.865 -44.116
  341   2HB   ARG  42          1HB       ARG  42 -28.939  35.166 -43.096
  342   1HG   ARG  42          2HG       ARG  42 -29.329  37.179 -44.239
  343   2HG   ARG  42          1HG       ARG  42 -27.966  36.434 -45.075
  344   1HD   ARG  42          2HD       ARG  42 -29.507  35.559 -46.776
  345   2HD   ARG  42          1HD       ARG  42 -30.852  36.344 -45.948
  346    HE   ARG  42           HE       ARG  42 -28.794  37.617 -47.564
  347   1HH1  ARG  42          1HH1      ARG  42 -31.504  38.008 -45.367
  348   2HH1  ARG  42          2HH1      ARG  42 -31.757  39.682 -45.777
  349   1HH2  ARG  42          1HH2      ARG  42 -29.157  39.798 -48.132
  350   2HH2  ARG  42          2HH2      ARG  42 -30.429  40.689 -47.354
  351    HA   PRO  43           HA       PRO  43 -24.618  35.223 -45.253
  352   1HB   PRO  43          2HB       PRO  43 -23.546  34.338 -42.689
  353   2HB   PRO  43          1HB       PRO  43 -23.573  35.963 -43.379
  354   1HG   PRO  43          2HG       PRO  43 -25.076  35.245 -41.240
  355   2HG   PRO  43          1HG       PRO  43 -25.579  36.486 -42.402
  356   1HD   PRO  43          2HD       PRO  43 -26.445  33.628 -42.184
  357   2HD   PRO  43          1HD       PRO  43 -27.404  35.076 -42.551
  358    H    ALA  44           H        ALA  44 -24.771  32.478 -43.022
  359    HA   ALA  44           HA       ALA  44 -23.945  30.374 -43.055
  360   1HB   ALA  44          1HB       ALA  44 -25.126  30.832 -45.674
  361   2HB   ALA  44          2HB       ALA  44 -25.287  29.460 -44.577
  362   3HB   ALA  44          3HB       ALA  44 -23.909  29.554 -45.675
  363    HA   PRO  45           HA       PRO  45 -19.628  31.777 -44.214
  364   1HB   PRO  45          2HB       PRO  45 -19.234  30.622 -41.506
  365   2HB   PRO  45          1HB       PRO  45 -18.589  32.118 -42.193
  366   1HG   PRO  45          2HG       PRO  45 -20.537  32.198 -40.393
  367   2HG   PRO  45          1HG       PRO  45 -20.554  33.297 -41.785
  368   1HD   PRO  45          2HD       PRO  45 -22.109  30.774 -41.345
  369   2HD   PRO  45          1HD       PRO  45 -22.649  32.324 -42.026
  370    H    TYR  46           H        TYR  46 -21.080  28.925 -42.832
  371    HA   TYR  46           HA       TYR  46 -19.256  27.242 -44.401
  372   1HB   TYR  46          2HB       TYR  46 -19.140  27.376 -41.671
  373   2HB   TYR  46          1HB       TYR  46 -20.287  26.063 -41.893
  374    HD1  TYR  46           1HD      TYR  46 -16.826  27.147 -42.336
  375    HD2  TYR  46           2HD      TYR  46 -19.583  23.963 -42.921
  376    HE1  TYR  46           1HE      TYR  46 -14.953  25.603 -42.718
  377    HE2  TYR  46           2HE      TYR  46 -17.717  22.409 -43.304
  378    HH   TYR  46           HH       TYR  46 -15.451  22.351 -43.869
  379    H    SER  47           H        SER  47 -20.941  24.956 -43.067
  380    HA   SER  47           HA       SER  47 -22.975  24.672 -44.956
  381   1HB   SER  47          2HB       SER  47 -23.744  23.464 -42.457
  382   2HB   SER  47          1HB       SER  47 -23.149  22.680 -43.922
  383    HG   SER  47           HG       SER  47 -21.387  22.304 -42.855
  384    H    ARG  48           H        ARG  48 -22.930  26.107 -41.758
  385    HA   ARG  48           HA       ARG  48 -25.064  27.903 -42.467
  386   1HB   ARG  48          2HB       ARG  48 -26.606  27.310 -40.783
  387   2HB   ARG  48          1HB       ARG  48 -26.142  25.775 -41.503
  388   1HG   ARG  48          2HG       ARG  48 -24.728  25.249 -39.662
  389   2HG   ARG  48          1HG       ARG  48 -24.896  26.875 -38.996
  390   1HD   ARG  48          2HD       ARG  48 -26.274  25.172 -37.828
  391   2HD   ARG  48          1HD       ARG  48 -27.213  26.499 -38.508
  392    HE   ARG  48           HE       ARG  48 -28.204  25.030 -39.980
  393   1HH1  ARG  48          1HH1      ARG  48 -25.546  23.439 -38.344
  394   2HH1  ARG  48          2HH1      ARG  48 -25.986  21.855 -38.913
  395   1HH2  ARG  48          1HH2      ARG  48 -28.773  22.972 -40.738
  396   2HH2  ARG  48          2HH2      ARG  48 -27.812  21.586 -40.292
  397    HA   PRO  49           HA       PRO  49 -22.818  30.639 -39.718
  398   1HB   PRO  49          2HB       PRO  49 -25.436  31.314 -38.479
  399   2HB   PRO  49          1HB       PRO  49 -24.221  32.380 -39.191
  400   1HG   PRO  49          2HG       PRO  49 -26.486  31.859 -40.482
  401   2HG   PRO  49          1HG       PRO  49 -24.947  31.982 -41.358
  402   1HD   PRO  49          2HD       PRO  49 -26.495  29.545 -40.578
  403   2HD   PRO  49          1HD       PRO  49 -25.591  29.880 -42.069
  404    H    LYS  50           H        LYS  50 -21.668  29.669 -38.170
  405    HA   LYS  50           HA       LYS  50 -23.002  28.055 -36.141
  406   1HB   LYS  50          2HB       LYS  50 -20.099  28.400 -36.894
  407   2HB   LYS  50          1HB       LYS  50 -20.629  27.444 -35.517
  408   1HG   LYS  50          2HG       LYS  50 -21.709  26.895 -38.250
  409   2HG   LYS  50          1HG       LYS  50 -20.136  26.265 -37.756
  410   1HD   LYS  50          2HD       LYS  50 -22.202  25.832 -35.752
  411   2HD   LYS  50          1HD       LYS  50 -22.585  25.077 -37.300
  412   1HE   LYS  50          2HE       LYS  50 -20.338  24.025 -37.284
  413   2HE   LYS  50          1HE       LYS  50 -20.072  24.698 -35.675
  414   1HZ   LYS  50          1HZ       LYS  50 -22.194  22.764 -36.440
  415   2HZ   LYS  50          2HZ       LYS  50 -22.009  23.450 -34.898
  416   3HZ   LYS  50          3HZ       LYS  50 -20.808  22.425 -35.517
  417    HA   PRO  51           HA       PRO  51 -22.680  31.579 -33.410
  418   1HB   PRO  51          2HB       PRO  51 -24.027  29.863 -31.468
  419   2HB   PRO  51          1HB       PRO  51 -24.596  31.349 -32.225
  420   1HG   PRO  51          2HG       PRO  51 -25.648  28.918 -32.796
  421   2HG   PRO  51          1HG       PRO  51 -25.580  30.239 -33.976
  422   1HD   PRO  51          2HD       PRO  51 -23.799  27.848 -33.701
  423   2HD   PRO  51          1HD       PRO  51 -24.449  28.607 -35.170
  424    H    LEU  52           H        LEU  52 -22.736  28.682 -31.374
  425    HA   LEU  52           HA       LEU  52 -21.475  28.174 -29.545
  426   1HB   LEU  52          2HB       LEU  52 -19.579  28.395 -31.830
  427   2HB   LEU  52          1HB       LEU  52 -18.910  28.172 -30.224
  428    HG   LEU  52           HG       LEU  52 -21.040  26.285 -30.689
  429   1HD1  LEU  52          1HD1      LEU  52 -20.066  26.812 -33.066
  430   2HD1  LEU  52          2HD1      LEU  52 -20.380  25.151 -32.566
  431   3HD1  LEU  52          3HD1      LEU  52 -18.739  25.792 -32.510
  432   1HD2  LEU  52          1HD2      LEU  52 -19.138  26.239 -29.016
  433   2HD2  LEU  52          2HD2      LEU  52 -18.099  25.759 -30.358
  434   3HD2  LEU  52          3HD2      LEU  52 -19.454  24.735 -29.885
  435    HA   PRO  53           HA       PRO  53 -20.136  32.593 -28.843
  436   1HB   PRO  53          2HB       PRO  53 -22.484  33.408 -27.521
  437   2HB   PRO  53          1HB       PRO  53 -22.037  33.767 -29.188
  438   1HG   PRO  53          2HG       PRO  53 -24.183  32.161 -28.344
  439   2HG   PRO  53          1HG       PRO  53 -23.546  32.284 -29.991
  440   1HD   PRO  53          2HD       PRO  53 -23.046  30.206 -27.913
  441   2HD   PRO  53          1HD       PRO  53 -23.121  30.046 -29.683
  442    H    ASP  54           H        ASP  54 -22.493  31.532 -26.408
  443    HA   ASP  54           HA       ASP  54 -20.635  32.295 -24.319
  444   1HB   ASP  54          2HB       ASP  54 -22.579  31.982 -22.812
  445   2HB   ASP  54          1HB       ASP  54 -22.913  33.102 -24.126
  446    H    LYS  55           H        LYS  55 -19.412  30.285 -25.307
  447    HA   LYS  55           HA       LYS  55 -20.187  27.775 -24.113
  448   1HB   LYS  55          2HB       LYS  55 -18.421  28.553 -26.152
  449   2HB   LYS  55          1HB       LYS  55 -17.394  27.922 -24.873
  450   1HG   LYS  55          2HG       LYS  55 -19.786  26.386 -25.804
  451   2HG   LYS  55          1HG       LYS  55 -18.264  26.318 -26.692
  452   1HD   LYS  55          2HD       LYS  55 -17.290  25.017 -25.143
  453   2HD   LYS  55          1HD       LYS  55 -17.956  25.958 -23.806
  454   1HE   LYS  55          2HE       LYS  55 -20.071  24.805 -24.001
  455   2HE   LYS  55          1HE       LYS  55 -19.501  23.934 -25.425
  456   1HZ   LYS  55          1HZ       LYS  55 -18.700  23.592 -22.605
  457   2HZ   LYS  55          2HZ       LYS  55 -17.678  23.081 -23.860
  458   3HZ   LYS  55          3HZ       LYS  55 -19.234  22.422 -23.714
  459    H    TRP  56           H        TRP  56 -20.408  28.539 -21.941
  460    HA   TRP  56           HA       TRP  56 -18.251  29.739 -20.538
  461   1HB   TRP  56          2HB       TRP  56 -20.759  28.386 -19.530
  462   2HB   TRP  56          1HB       TRP  56 -19.641  29.295 -18.519
  463    HD1  TRP  56           HD       TRP  56 -22.742  29.737 -20.399
  464    HE1  TRP  56           1HE      TRP  56 -23.266  32.231 -20.761
  465    HE3  TRP  56           3HE      TRP  56 -18.200  31.706 -19.128
  466    HZ2  TRP  56           2HZ      TRP  56 -21.926  34.704 -20.529
  467    HZ3  TRP  56           3HZ      TRP  56 -17.905  34.146 -19.224
  468    HH2  TRP  56           HH       TRP  56 -19.731  35.612 -19.911
  469    H    GLN  57           H        GLN  57 -16.421  28.578 -20.513
  470    HA   GLN  57           HA       GLN  57 -16.450  25.810 -19.612
  471   1HB   GLN  57          2HB       GLN  57 -13.925  27.359 -20.021
  472   2HB   GLN  57          1HB       GLN  57 -14.254  25.664 -20.343
  473   1HG   GLN  57          2HG       GLN  57 -15.797  27.513 -22.000
  474   2HG   GLN  57          1HG       GLN  57 -14.052  27.621 -22.224
  475   1HE2  GLN  57          1HE2      GLN  57 -14.026  26.736 -24.247
  476   2HE2  GLN  57          2HE2      GLN  57 -14.404  25.077 -24.570
  477    H    HIS  58           H        HIS  58 -15.546  25.129 -17.637
  478    HA   HIS  58           HA       HIS  58 -15.499  27.170 -15.577
  479   1HB   HIS  58          2HB       HIS  58 -16.377  24.642 -15.473
  480   2HB   HIS  58          1HB       HIS  58 -14.718  24.366 -14.949
  481    HD1  HIS  58           1HD      HIS  58 -14.048  25.189 -12.619
  482    HD2  HIS  58           2HD      HIS  58 -17.948  26.184 -13.698
  483    HE1  HIS  58           1HE      HIS  58 -15.137  26.075 -10.525
  484    HE2  HIS  58           2HE      HIS  58 -17.461  26.770 -11.224
  485    H    ASP  59           H        ASP  59 -13.660  28.165 -16.749
  486    HA   ASP  59           HA       ASP  59 -11.490  28.782 -16.868
  487   1HB   ASP  59          2HB       ASP  59 -11.812  28.089 -14.271
  488   2HB   ASP  59          1HB       ASP  59 -10.527  26.979 -14.737
  489    H    LEU  60           H        LEU  60 -12.533  26.200 -18.073
  490    HA   LEU  60           HA       LEU  60 -11.798  24.675 -19.566
  491   1HB   LEU  60          2HB       LEU  60  -9.276  26.324 -19.404
  492   2HB   LEU  60          1HB       LEU  60  -9.546  25.051 -20.579
  493    HG   LEU  60           HG       LEU  60 -11.736  26.544 -21.046
  494   1HD1  LEU  60          1HD1      LEU  60 -11.543  28.750 -20.592
  495   2HD1  LEU  60          2HD1      LEU  60  -9.786  28.739 -20.735
  496   3HD1  LEU  60          3HD1      LEU  60 -10.554  28.154 -19.258
  497   1HD2  LEU  60          1HD2      LEU  60  -9.227  27.498 -22.313
  498   2HD2  LEU  60          2HD2      LEU  60 -10.761  27.029 -23.046
  499   3HD2  LEU  60          3HD2      LEU  60  -9.641  25.792 -22.474
  500    H    PHE  61           H        PHE  61  -8.564  25.026 -18.222
  501    HA   PHE  61           HA       PHE  61  -8.420  22.209 -17.698
  502   1HB   PHE  61          2HB       PHE  61  -6.452  23.423 -18.493
  503   2HB   PHE  61          1HB       PHE  61  -6.482  24.449 -17.066
  504    HD1  PHE  61           1HD      PHE  61  -6.552  20.774 -17.758
  505    HD2  PHE  61           2HD      PHE  61  -4.848  23.983 -15.542
  506    HE1  PHE  61           1HE      PHE  61  -5.088  19.181 -16.585
  507    HE2  PHE  61           2HE      PHE  61  -3.379  22.398 -14.366
  508    HZ   PHE  61           HZ       PHE  61  -3.498  19.993 -14.888
  509    H    ASP  62           H        ASP  62  -9.243  25.031 -15.910
  510    HA   ASP  62           HA       ASP  62  -9.889  25.390 -13.753
  511   1HB   ASP  62          2HB       ASP  62 -11.339  23.356 -14.530
  512   2HB   ASP  62          1HB       ASP  62 -10.312  22.422 -13.450
  513    H    SER  63           H        SER  63  -9.607  23.193 -11.690
  514    HA   SER  63           HA       SER  63  -6.759  23.568 -11.125
  515   1HB   SER  63          2HB       SER  63  -8.524  22.240  -9.145
  516   2HB   SER  63          1HB       SER  63  -7.311  23.498  -8.905
  517    HG   SER  63           HG       SER  63  -9.856  23.935 -10.117
  518    H    GLY  64           H        GLY  64  -7.606  21.800 -13.180
  519   1HA   GLY  64          2HA       GLY  64  -6.575  19.728 -13.774
  520   2HA   GLY  64          1HA       GLY  64  -6.682  19.233 -12.089
  521    H    CYS  65           H        CYS  65  -8.795  20.206 -14.787
  522    HA   CYS  65           HA       CYS  65 -11.119  18.990 -13.763
  523   1HB   CYS  65          2HB       CYS  65 -11.816  19.058 -16.261
  524   2HB   CYS  65          1HB       CYS  65 -11.535  20.577 -15.418
  525    HG   CYS  65           HG       CYS  65 -10.213  21.363 -17.504
  526    H    GLY  66           H        GLY  66 -11.417  16.910 -13.406
  527   1HA   GLY  66          2HA       GLY  66 -11.767  14.762 -14.653
  528   2HA   GLY  66          1HA       GLY  66 -10.111  14.978 -15.212
  529    H    GLY  67           H        GLY  67  -9.549  12.947 -14.281
  530   1HA   GLY  67          2HA       GLY  67  -8.641  13.236 -11.563
  531   2HA   GLY  67          1HA       GLY  67  -9.916  12.040 -11.745
  532    H    GLY  68           H        GLY  68  -8.027  10.759 -10.853
  533   1HA   GLY  68          2HA       GLY  68  -6.133   9.942 -12.927
  534   2HA   GLY  68          1HA       GLY  68  -6.076   9.489 -11.227
  535    H    GLU  69           H        GLU  69  -6.762   8.455 -14.286
  536    HA   GLU  69           HA       GLU  69  -7.633   6.580 -15.191
  537   1HB   GLU  69          2HB       GLU  69  -6.627   5.805 -12.644
  538   2HB   GLU  69          1HB       GLU  69  -8.128   4.933 -12.916
  539   1HG   GLU  69          2HG       GLU  69  -6.062   3.761 -13.677
  540   2HG   GLU  69          1HG       GLU  69  -7.310   3.955 -14.906
  541    H    GLY  70           H        GLY  70  -9.340   5.865 -12.223
  542   1HA   GLY  70          2HA       GLY  70 -11.778   7.135 -12.976
  543   2HA   GLY  70          1HA       GLY  70 -11.788   5.429 -13.400
  544    H    VAL  71           H        VAL  71 -10.702   7.371 -10.626
  545    HA   VAL  71           HA       VAL  71 -12.534   6.121  -8.850
  546    HB   VAL  71           HB       VAL  71 -11.086   4.242  -8.872
  547   1HG1  VAL  71          1HG1      VAL  71  -8.715   5.976  -8.235
  548   2HG1  VAL  71          2HG1      VAL  71  -9.143   5.502  -9.878
  549   3HG1  VAL  71          3HG1      VAL  71  -8.733   4.271  -8.685
  550   1HG2  VAL  71          1HG2      VAL  71 -10.714   5.981  -6.461
  551   2HG2  VAL  71          2HG2      VAL  71 -10.028   4.357  -6.541
  552   3HG2  VAL  71          3HG2      VAL  71 -11.773   4.586  -6.672
  553    H    GLU  72           H        GLU  72  -9.463   7.755  -9.083
  554    HA   GLU  72           HA       GLU  72 -10.256  10.163  -7.951
  555   1HB   GLU  72          2HB       GLU  72 -10.337   8.583  -5.893
  556   2HB   GLU  72          1HB       GLU  72  -8.581   8.619  -5.980
  557   1HG   GLU  72          2HG       GLU  72  -8.466  10.858  -5.422
  558   2HG   GLU  72          1HG       GLU  72 -10.131  11.169  -5.914
  559    H    THR  73           H        THR  73  -7.358   8.423  -7.017
  560    HA   THR  73           HA       THR  73  -5.828   8.997  -9.322
  561    HB   THR  73           HB       THR  73  -4.293  10.361  -7.345
  562    HG1  THR  73           1HG      THR  73  -6.918  11.414  -7.724
  563   1HG2  THR  73          1HG2      THR  73  -5.494  11.010 -10.004
  564   2HG2  THR  73          2HG2      THR  73  -3.799  10.811  -9.561
  565   3HG2  THR  73          3HG2      THR  73  -4.671  12.264  -9.076
  566    H    GLY  74           H        GLY  74  -4.406   7.380  -9.413
  567   1HA   GLY  74          2HA       GLY  74  -3.960   5.729  -7.092
  568   2HA   GLY  74          1HA       GLY  74  -3.304   5.471  -8.703
  569    H    ALA  75           H        ALA  75  -2.514   6.212  -5.575
  570    HA   ALA  75           HA       ALA  75  -0.172   7.810  -6.318
  571   1HB   ALA  75          1HB       ALA  75  -0.115   8.576  -4.140
  572   2HB   ALA  75          2HB       ALA  75  -0.855   7.111  -3.492
  573   3HB   ALA  75          3HB       ALA  75  -1.848   8.300  -4.339
  574    H    LYS  76           H        LYS  76   1.451   6.532  -6.984
  575    HA   LYS  76           HA       LYS  76   1.785   3.916  -5.720
  576   1HB   LYS  76          2HB       LYS  76   3.513   4.051  -7.888
  577   2HB   LYS  76          1HB       LYS  76   1.941   3.271  -7.841
  578   1HG   LYS  76          2HG       LYS  76   0.904   4.967  -8.972
  579   2HG   LYS  76          1HG       LYS  76   2.076   6.177  -8.444
  580   1HD   LYS  76          2HD       LYS  76   3.699   5.413  -9.984
  581   2HD   LYS  76          1HD       LYS  76   2.788   3.939 -10.323
  582   1HE   LYS  76          2HE       LYS  76   1.309   6.412 -10.838
  583   2HE   LYS  76          1HE       LYS  76   2.743   6.205 -11.845
  584   1HZ   LYS  76          1HZ       LYS  76   0.315   4.555 -11.702
  585   2HZ   LYS  76          2HZ       LYS  76   1.779   3.831 -12.160
  586   3HZ   LYS  76          3HZ       LYS  76   1.156   5.123 -13.063
  587    H    LEU  77           H        LEU  77   3.278   3.657  -4.273
  588    HA   LEU  77           HA       LEU  77   5.668   5.357  -4.254
  589   1HB   LEU  77          2HB       LEU  77   4.416   5.395  -2.210
  590   2HB   LEU  77          1HB       LEU  77   4.277   3.655  -2.187
  591    HG   LEU  77           HG       LEU  77   5.832   4.742  -0.498
  592   1HD1  LEU  77          1HD1      LEU  77   7.405   2.941  -0.551
  593   2HD1  LEU  77          2HD1      LEU  77   7.001   2.595  -2.233
  594   3HD1  LEU  77          3HD1      LEU  77   5.794   2.356  -0.968
  595   1HD2  LEU  77          1HD2      LEU  77   6.974   6.319  -1.905
  596   2HD2  LEU  77          2HD2      LEU  77   7.551   5.025  -2.956
  597   3HD2  LEU  77          3HD2      LEU  77   8.140   5.145  -1.298
  598    H    LEU  78           H        LEU  78   7.457   4.501  -5.092
  599    HA   LEU  78           HA       LEU  78   7.817   1.581  -5.004
  600   1HB   LEU  78          2HB       LEU  78   9.471   3.486  -6.633
  601   2HB   LEU  78          1HB       LEU  78   9.259   1.760  -6.859
  602    HG   LEU  78           HG       LEU  78   7.011   3.725  -7.253
  603   1HD1  LEU  78          1HD1      LEU  78   7.696   4.251  -9.315
  604   2HD1  LEU  78          2HD1      LEU  78   8.256   2.613  -9.650
  605   3HD1  LEU  78          3HD1      LEU  78   9.288   3.735  -8.762
  606   1HD2  LEU  78          1HD2      LEU  78   7.452   0.894  -8.198
  607   2HD2  LEU  78          2HD2      LEU  78   6.056   1.902  -8.580
  608   3HD2  LEU  78          3HD2      LEU  78   6.354   1.404  -6.915
  609    H    VAL  79           H        VAL  79   8.854   1.101  -3.129
  610    HA   VAL  79           HA       VAL  79  11.161   2.717  -2.355
  611    HB   VAL  79           HB       VAL  79  11.105   0.837  -0.439
  612   1HG1  VAL  79          1HG1      VAL  79   9.526   3.377  -0.651
  613   2HG1  VAL  79          2HG1      VAL  79  11.077   3.105   0.144
  614   3HG1  VAL  79          3HG1      VAL  79   9.600   2.433   0.837
  615   1HG2  VAL  79          1HG2      VAL  79   8.300   1.022  -1.487
  616   2HG2  VAL  79          2HG2      VAL  79   8.691   0.484   0.146
  617   3HG2  VAL  79          3HG2      VAL  79   9.278  -0.426  -1.247
  618    H    SER  80           H        SER  80  13.034   1.445  -1.434
  619    HA   SER  80           HA       SER  80  13.634  -1.078  -2.648
  620   1HB   SER  80          2HB       SER  80  15.277   1.326  -3.506
  621   2HB   SER  80          1HB       SER  80  15.590  -0.358  -3.932
  622    HG   SER  80           HG       SER  80  13.049   0.392  -4.546
  623    H    ASN  81           H        ASN  81  14.617  -2.118  -1.077
  624    HA   ASN  81           HA       ASN  81  15.864  -0.528   1.056
  625   1HB   ASN  81          2HB       ASN  81  15.154  -2.136   2.604
  626   2HB   ASN  81          1HB       ASN  81  13.812  -2.022   1.475
  627   1HD2  ASN  81          1HD2      ASN  81  13.647  -3.707  -0.175
  628   2HD2  ASN  81          2HD2      ASN  81  14.232  -5.298   0.191
  629    H    LEU  82           H        LEU  82  16.761  -2.315  -1.512
  630    HA   LEU  82           HA       LEU  82  18.679  -3.259  -2.226
  631   1HB   LEU  82          2HB       LEU  82  19.489  -1.405  -0.202
  632   2HB   LEU  82          1HB       LEU  82  20.516  -2.824  -0.115
  633    HG   LEU  82           HG       LEU  82  21.249  -2.542  -2.371
  634   1HD1  LEU  82          1HD1      LEU  82  20.032  -1.585  -3.960
  635   2HD1  LEU  82          2HD1      LEU  82  19.972  -0.064  -3.071
  636   3HD1  LEU  82          3HD1      LEU  82  18.769  -1.315  -2.760
  637   1HD2  LEU  82          1HD2      LEU  82  21.494  -0.440  -0.416
  638   2HD2  LEU  82          2HD2      LEU  82  21.626   0.201  -2.053
  639   3HD2  LEU  82          3HD2      LEU  82  22.701  -1.092  -1.522
  640    H    ASP  83           H        ASP  83  19.635  -3.741   1.117
  641    HA   ASP  83           HA       ASP  83  18.687  -6.499   1.050
  642   1HB   ASP  83          2HB       ASP  83  21.176  -6.200   0.226
  643   2HB   ASP  83          1HB       ASP  83  21.507  -6.054   1.949
  644    H    PHE  84           H        PHE  84  17.481  -4.654   2.480
  645    HA   PHE  84           HA       PHE  84  18.603  -4.582   5.174
  646   1HB   PHE  84          2HB       PHE  84  16.967  -2.847   3.663
  647   2HB   PHE  84          1HB       PHE  84  15.961  -3.449   4.976
  648    HD1  PHE  84           1HD      PHE  84  19.494  -2.309   4.572
  649    HD2  PHE  84           2HD      PHE  84  15.878  -2.078   6.799
  650    HE1  PHE  84           1HE      PHE  84  20.547  -0.701   6.106
  651    HE2  PHE  84           2HE      PHE  84  16.923  -0.470   8.337
  652    HZ   PHE  84           HZ       PHE  84  19.242   0.246   7.980
  653    H    GLY  85           H        GLY  85  16.139  -6.173   3.316
  654   1HA   GLY  85          2HA       GLY  85  15.230  -8.268   3.961
  655   2HA   GLY  85          1HA       GLY  85  15.551  -7.863   5.642
  656    H    VAL  86           H        VAL  86  14.059  -5.507   3.595
  657    HA   VAL  86           HA       VAL  86  11.716  -5.498   5.277
  658    HB   VAL  86           HB       VAL  86  12.353  -3.818   2.843
  659   1HG1  VAL  86          1HG1      VAL  86   9.891  -4.176   3.881
  660   2HG1  VAL  86          2HG1      VAL  86  10.430  -2.672   3.134
  661   3HG1  VAL  86          3HG1      VAL  86  10.465  -2.847   4.889
  662   1HG2  VAL  86          1HG2      VAL  86  13.769  -3.734   5.074
  663   2HG2  VAL  86          2HG2      VAL  86  12.411  -2.749   5.616
  664   3HG2  VAL  86          3HG2      VAL  86  13.340  -2.266   4.197
  665    H    SER  87           H        SER  87  10.114  -6.871   4.952
  666    HA   SER  87           HA       SER  87   9.689  -8.092   2.368
  667   1HB   SER  87          2HB       SER  87   7.822  -8.530   4.657
  668   2HB   SER  87          1HB       SER  87   8.454  -9.685   3.480
  669    HG   SER  87           HG       SER  87   9.810  -8.551   5.715
  670    H    ASP  88           H        ASP  88   7.266  -8.438   1.849
  671    HA   ASP  88           HA       ASP  88   6.280  -5.962   0.922
  672   1HB   ASP  88          2HB       ASP  88   4.293  -7.216   0.155
  673   2HB   ASP  88          1HB       ASP  88   5.802  -7.975  -0.311
  674    H    ALA  89           H        ALA  89   5.146  -8.069   3.525
  675    HA   ALA  89           HA       ALA  89   3.117  -6.213   4.343
  676   1HB   ALA  89          1HB       ALA  89   3.472  -7.875   6.486
  677   2HB   ALA  89          2HB       ALA  89   4.010  -8.873   5.134
  678   3HB   ALA  89          3HB       ALA  89   2.391  -8.173   5.125
  679    H    ASP  90           H        ASP  90   6.453  -6.736   5.105
  680    HA   ASP  90           HA       ASP  90   6.688  -5.358   7.525
  681   1HB   ASP  90          2HB       ASP  90   8.581  -5.651   5.200
  682   2HB   ASP  90          1HB       ASP  90   9.013  -4.697   6.612
  683    H    ILE  91           H        ILE  91   7.310  -4.048   4.269
  684    HA   ILE  91           HA       ILE  91   7.266  -1.359   5.049
  685    HB   ILE  91           HB       ILE  91   8.174  -2.358   2.881
  686   1HG1  ILE  91          2HG1      ILE  91   7.440  -0.212   1.587
  687   2HG1  ILE  91          1HG1      ILE  91   6.653   0.216   3.103
  688   1HG2  ILE  91          1HG2      ILE  91   6.131  -3.505   2.175
  689   2HG2  ILE  91          2HG2      ILE  91   6.701  -2.368   0.952
  690   3HG2  ILE  91          3HG2      ILE  91   5.328  -1.946   1.977
  691   1HD1  ILE  91          1HD1      ILE  91   9.392   0.470   2.357
  692   2HD1  ILE  91          2HD1      ILE  91   9.261  -0.593   3.758
  693   3HD1  ILE  91          3HD1      ILE  91   8.576   1.032   3.815
  694    H    GLN  92           H        GLN  92   4.676  -3.564   4.327
  695    HA   GLN  92           HA       GLN  92   2.631  -1.651   3.914
  696   1HB   GLN  92          2HB       GLN  92   2.534  -4.150   3.429
  697   2HB   GLN  92          1HB       GLN  92   2.238  -4.371   5.148
  698   1HG   GLN  92          2HG       GLN  92   0.101  -3.821   4.947
  699   2HG   GLN  92          1HG       GLN  92   0.481  -2.378   4.009
  700   1HE2  GLN  92          1HE2      GLN  92  -1.650  -3.271   3.078
  701   2HE2  GLN  92          2HE2      GLN  92  -1.478  -4.306   1.696
  702    H    GLU  93           H        GLU  93   3.578  -3.513   6.798
  703    HA   GLU  93           HA       GLU  93   1.878  -2.227   8.625
  704   1HB   GLU  93          2HB       GLU  93   3.085  -4.336   9.088
  705   2HB   GLU  93          1HB       GLU  93   4.603  -3.450   9.122
  706   1HG   GLU  93          2HG       GLU  93   4.323  -2.961  11.257
  707   2HG   GLU  93          1HG       GLU  93   2.750  -2.237  10.928
  708    H    LEU  94           H        LEU  94   5.033  -1.424   7.377
  709    HA   LEU  94           HA       LEU  94   5.677   0.657   9.169
  710   1HB   LEU  94          2HB       LEU  94   6.703  -0.416   6.666
  711   2HB   LEU  94          1HB       LEU  94   6.865   1.327   6.748
  712    HG   LEU  94           HG       LEU  94   8.311   1.235   8.589
  713   1HD1  LEU  94          1HD1      LEU  94   6.928  -1.285   9.153
  714   2HD1  LEU  94          2HD1      LEU  94   7.631  -0.101  10.256
  715   3HD1  LEU  94          3HD1      LEU  94   8.660  -1.310   9.485
  716   1HD2  LEU  94          1HD2      LEU  94   8.860  -1.078   6.746
  717   2HD2  LEU  94          2HD2      LEU  94  10.009  -0.520   7.962
  718   3HD2  LEU  94          3HD2      LEU  94   9.506   0.561   6.661
  719    H    PHE  95           H        PHE  95   4.699   1.013   5.758
  720    HA   PHE  95           HA       PHE  95   3.938   3.670   5.874
  721   1HB   PHE  95          2HB       PHE  95   3.403   1.416   4.053
  722   2HB   PHE  95          1HB       PHE  95   2.277   2.768   3.950
  723    HD1  PHE  95           1HD      PHE  95   3.166   5.057   3.500
  724    HD2  PHE  95           2HD      PHE  95   5.562   1.561   3.164
  725    HE1  PHE  95           1HE      PHE  95   4.783   6.302   2.127
  726    HE2  PHE  95           2HE      PHE  95   7.184   2.798   1.793
  727    HZ   PHE  95           HZ       PHE  95   6.797   5.184   1.293
  728    H    ALA  96           H        ALA  96   2.103   0.918   7.025
  729    HA   ALA  96           HA       ALA  96  -0.393   2.289   7.204
  730   1HB   ALA  96          1HB       ALA  96   0.478   0.061   9.031
  731   2HB   ALA  96          2HB       ALA  96   0.006  -0.232   7.354
  732   3HB   ALA  96          3HB       ALA  96  -1.152   0.464   8.491
  733    H    GLU  97           H        GLU  97   2.073   1.545   9.602
  734    HA   GLU  97           HA       GLU  97   1.342   3.338  11.610
  735   1HB   GLU  97          2HB       GLU  97   3.251   1.682  11.691
  736   2HB   GLU  97          1HB       GLU  97   4.201   2.838  10.765
  737   1HG   GLU  97          2HG       GLU  97   4.100   4.440  12.530
  738   2HG   GLU  97          1HG       GLU  97   2.949   3.451  13.427
  739    H    PHE  98           H        PHE  98   3.210   3.875   8.704
  740    HA   PHE  98           HA       PHE  98   3.682   6.636   8.976
  741   1HB   PHE  98          2HB       PHE  98   4.718   4.809   7.422
  742   2HB   PHE  98          1HB       PHE  98   3.440   5.288   6.313
  743    HD1  PHE  98           1HD      PHE  98   4.010   6.771   4.730
  744    HD2  PHE  98           2HD      PHE  98   5.979   6.954   8.488
  745    HE1  PHE  98           1HE      PHE  98   5.391   8.642   3.907
  746    HE2  PHE  98           2HE      PHE  98   7.365   8.819   7.683
  747    HZ   PHE  98           HZ       PHE  98   7.077   9.665   5.387
  748    H    GLY  99           H        GLY  99   0.726   5.338   8.821
  749   1HA   GLY  99          2HA       GLY  99  -0.987   7.195   8.421
  750   2HA   GLY  99          1HA       GLY  99  -0.306   7.253   6.809
  751    H    THR 100           H        THR 100  -1.370   6.199   5.296
  752    HA   THR 100           HA       THR 100  -3.155   4.001   6.094
  753    HB   THR 100           HB       THR 100  -4.515   5.373   4.063
  754    HG1  THR 100           1HG      THR 100  -3.244   7.237   4.548
  755   1HG2  THR 100          1HG2      THR 100  -5.109   5.612   7.003
  756   2HG2  THR 100          2HG2      THR 100  -5.345   4.106   6.116
  757   3HG2  THR 100          3HG2      THR 100  -6.245   5.552   5.656
  758    H    LEU 101           H        LEU 101  -2.539   2.270   4.979
  759    HA   LEU 101           HA       LEU 101  -1.515   2.665   2.257
  760   1HB   LEU 101          2HB       LEU 101  -0.040   1.618   4.065
  761   2HB   LEU 101          1HB       LEU 101  -1.079   0.213   3.936
  762    HG   LEU 101           HG       LEU 101  -0.341  -0.304   1.786
  763   1HD1  LEU 101          1HD1      LEU 101   0.171   2.589   1.602
  764   2HD1  LEU 101          2HD1      LEU 101  -0.431   1.458   0.388
  765   3HD1  LEU 101          3HD1      LEU 101   1.299   1.548   0.730
  766   1HD2  LEU 101          1HD2      LEU 101   1.432  -0.874   3.179
  767   2HD2  LEU 101          2HD2      LEU 101   1.894   0.808   3.438
  768   3HD2  LEU 101          3HD2      LEU 101   2.199   0.038   1.879
  769    H    LYS 102           H        LYS 102  -3.035   2.356   0.854
  770    HA   LYS 102           HA       LYS 102  -5.271   0.660   1.090
  771   1HB   LYS 102          2HB       LYS 102  -4.979   2.531  -0.587
  772   2HB   LYS 102          1HB       LYS 102  -3.956   1.442  -1.514
  773   1HG   LYS 102          2HG       LYS 102  -5.856   0.932  -2.573
  774   2HG   LYS 102          1HG       LYS 102  -6.156  -0.096  -1.171
  775   1HD   LYS 102          2HD       LYS 102  -7.149   2.161  -0.198
  776   2HD   LYS 102          1HD       LYS 102  -7.364   2.517  -1.914
  777   1HE   LYS 102          2HE       LYS 102  -8.518   0.297  -2.125
  778   2HE   LYS 102          1HE       LYS 102  -8.467   0.180  -0.366
  779   1HZ   LYS 102          1HZ       LYS 102  -9.716   2.453  -1.811
  780   2HZ   LYS 102          2HZ       LYS 102  -9.838   2.080  -0.159
  781   3HZ   LYS 102          3HZ       LYS 102 -10.579   1.078  -1.311
  782    H    LYS 103           H        LYS 103  -2.385   0.144  -0.968
  783    HA   LYS 103           HA       LYS 103  -2.325  -2.635  -0.094
  784   1HB   LYS 103          2HB       LYS 103  -1.967  -3.344  -2.510
  785   2HB   LYS 103          1HB       LYS 103  -3.610  -2.923  -2.048
  786   1HG   LYS 103          2HG       LYS 103  -2.306  -0.573  -2.983
  787   2HG   LYS 103          1HG       LYS 103  -2.049  -1.871  -4.150
  788   1HD   LYS 103          2HD       LYS 103  -4.775  -1.823  -3.167
  789   2HD   LYS 103          1HD       LYS 103  -4.313  -0.289  -3.909
  790   1HE   LYS 103          2HE       LYS 103  -3.789  -1.322  -5.959
  791   2HE   LYS 103          1HE       LYS 103  -3.795  -2.932  -5.240
  792   1HZ   LYS 103          1HZ       LYS 103  -6.215  -1.225  -5.408
  793   2HZ   LYS 103          2HZ       LYS 103  -6.133  -2.874  -5.027
  794   3HZ   LYS 103          3HZ       LYS 103  -5.790  -2.354  -6.605
  795    H    ALA 104           H        ALA 104  -0.276  -3.672  -0.382
  796    HA   ALA 104           HA       ALA 104   1.848  -2.226  -1.700
  797   1HB   ALA 104          1HB       ALA 104   2.688  -1.218   0.100
  798   2HB   ALA 104          2HB       ALA 104   3.076  -2.820   0.733
  799   3HB   ALA 104          3HB       ALA 104   1.551  -2.050   1.166
  800    H    ALA 105           H        ALA 105   3.665  -3.484  -2.113
  801    HA   ALA 105           HA       ALA 105   3.993  -6.146  -1.113
  802   1HB   ALA 105          1HB       ALA 105   3.666  -6.226  -4.036
  803   2HB   ALA 105          2HB       ALA 105   2.172  -6.024  -3.119
  804   3HB   ALA 105          3HB       ALA 105   3.213  -7.414  -2.812
  805    H    VAL 106           H        VAL 106   6.012  -7.111  -2.029
  806    HA   VAL 106           HA       VAL 106   7.786  -4.969  -2.887
  807    HB   VAL 106           HB       VAL 106   9.628  -6.585  -2.387
  808   1HG1  VAL 106          1HG1      VAL 106   7.757  -6.094  -0.077
  809   2HG1  VAL 106          2HG1      VAL 106   8.827  -4.881  -0.782
  810   3HG1  VAL 106          3HG1      VAL 106   9.506  -6.311  -0.005
  811   1HG2  VAL 106          1HG2      VAL 106   7.424  -8.407  -2.195
  812   2HG2  VAL 106          2HG2      VAL 106   8.308  -8.368  -0.669
  813   3HG2  VAL 106          3HG2      VAL 106   9.158  -8.738  -2.171
  814    H    ASP 107           H        ASP 107   9.625  -5.641  -4.269
  815    HA   ASP 107           HA       ASP 107   8.827  -7.344  -6.504
  816   1HB   ASP 107          2HB       ASP 107   8.317  -4.693  -6.683
  817   2HB   ASP 107          1HB       ASP 107   9.994  -4.709  -7.225
  818    H    TYR 108           H        TYR 108  10.725  -7.567  -8.034
  819    HA   TYR 108           HA       TYR 108  13.320  -7.075  -6.900
  820   1HB   TYR 108          2HB       TYR 108  11.987  -9.622  -6.464
  821   2HB   TYR 108          1HB       TYR 108  13.501  -9.820  -7.340
  822    HD1  TYR 108           1HD      TYR 108  15.629  -8.875  -6.315
  823    HD2  TYR 108           2HD      TYR 108  11.972  -9.192  -4.147
  824    HE1  TYR 108           1HE      TYR 108  16.868  -8.685  -4.206
  825    HE2  TYR 108           2HE      TYR 108  13.210  -9.001  -2.030
  826    HH   TYR 108           HH       TYR 108  15.325  -8.164  -1.193
  827    H    ASP 109           H        ASP 109  14.933  -8.565  -8.337
  828    HA   ASP 109           HA       ASP 109  14.403  -7.566 -11.017
  829   1HB   ASP 109          2HB       ASP 109  16.579  -7.010 -10.628
  830   2HB   ASP 109          1HB       ASP 109  16.786  -8.267  -9.414
  831    H    ARG 110           H        ARG 110  14.965  -9.078 -12.875
  832    HA   ARG 110           HA       ARG 110  13.323 -11.271 -12.961
  833   1HB   ARG 110          2HB       ARG 110  15.348 -10.098 -14.632
  834   2HB   ARG 110          1HB       ARG 110  15.436 -11.851 -14.722
  835   1HG   ARG 110          2HG       ARG 110  12.703 -11.031 -14.875
  836   2HG   ARG 110          1HG       ARG 110  13.661 -10.136 -16.057
  837   1HD   ARG 110          2HD       ARG 110  12.928 -12.111 -17.140
  838   2HD   ARG 110          1HD       ARG 110  14.635 -12.345 -16.770
  839    HE   ARG 110           HE       ARG 110  12.382 -13.592 -15.327
  840   1HH1  ARG 110          1HH1      ARG 110  15.777 -13.486 -16.216
  841   2HH1  ARG 110          2HH1      ARG 110  16.150 -15.005 -15.449
  842   1HH2  ARG 110          1HH2      ARG 110  12.864 -15.604 -14.352
  843   2HH2  ARG 110          2HH2      ARG 110  14.487 -16.227 -14.430
  844    H    SER 111           H        SER 111  16.785 -11.253 -12.167
  845    HA   SER 111           HA       SER 111  16.703 -14.127 -11.650
  846   1HB   SER 111          2HB       SER 111  19.239 -13.283 -10.985
  847   2HB   SER 111          1HB       SER 111  18.750 -13.886 -12.568
  848    HG   SER 111           HG       SER 111  18.537 -11.148 -11.826
  849    H    GLY 112           H        GLY 112  15.746 -11.577  -9.965
  850   1HA   GLY 112          2HA       GLY 112  15.493 -11.079  -7.735
  851   2HA   GLY 112          1HA       GLY 112  15.967 -12.741  -7.402
  852    H    ARG 113           H        ARG 113  17.682 -10.021  -8.885
  853    HA   ARG 113           HA       ARG 113  20.188 -10.732  -7.887
  854   1HB   ARG 113          2HB       ARG 113  19.029  -8.328  -9.187
  855   2HB   ARG 113          1HB       ARG 113  20.582  -8.137  -8.386
  856   1HG   ARG 113          2HG       ARG 113  20.907 -10.444  -9.826
  857   2HG   ARG 113          1HG       ARG 113  19.922  -9.445 -10.893
  858   1HD   ARG 113          2HD       ARG 113  22.174  -8.955 -11.419
  859   2HD   ARG 113          1HD       ARG 113  21.582  -7.589 -10.472
  860    HE   ARG 113           HE       ARG 113  23.266  -9.751  -9.369
  861   1HH1  ARG 113          1HH1      ARG 113  22.337  -6.386  -9.614
  862   2HH1  ARG 113          2HH1      ARG 113  23.458  -5.846  -8.396
  863   1HH2  ARG 113          1HH2      ARG 113  24.740  -9.062  -7.755
  864   2HH2  ARG 113          2HH2      ARG 113  24.829  -7.372  -7.343
  865    H    SER 114           H        SER 114  19.106  -7.501  -7.097
  866    HA   SER 114           HA       SER 114  19.023  -7.774  -4.306
  867   1HB   SER 114          2HB       SER 114  21.396  -6.340  -4.288
  868   2HB   SER 114          1HB       SER 114  21.216  -8.031  -3.823
  869    HG   SER 114           HG       SER 114  22.722  -7.125  -5.724
  870    H    LEU 115           H        LEU 115  17.415  -6.298  -4.349
  871    HA   LEU 115           HA       LEU 115  18.152  -3.536  -4.439
  872   1HB   LEU 115          2HB       LEU 115  16.106  -3.168  -6.105
  873   2HB   LEU 115          1HB       LEU 115  17.756  -3.342  -6.671
  874    HG   LEU 115           HG       LEU 115  16.773  -5.954  -6.580
  875   1HD1  LEU 115          1HD1      LEU 115  14.790  -5.031  -8.335
  876   2HD1  LEU 115          2HD1      LEU 115  14.591  -4.121  -6.836
  877   3HD1  LEU 115          3HD1      LEU 115  14.572  -5.886  -6.807
  878   1HD2  LEU 115          1HD2      LEU 115  18.304  -4.949  -8.234
  879   2HD2  LEU 115          2HD2      LEU 115  16.936  -4.091  -8.945
  880   3HD2  LEU 115          3HD2      LEU 115  16.987  -5.853  -8.983
  881    H    GLY 116           H        GLY 116  15.368  -5.701  -4.697
  882   1HA   GLY 116          2HA       GLY 116  13.676  -6.130  -3.183
  883   2HA   GLY 116          1HA       GLY 116  14.606  -5.233  -1.989
  884    H    THR 117           H        THR 117  12.839  -4.560  -4.997
  885    HA   THR 117           HA       THR 117  12.070  -1.943  -4.144
  886    HB   THR 117           HB       THR 117  10.359  -2.899  -6.220
  887    HG1  THR 117           1HG      THR 117  11.889  -3.678  -7.696
  888   1HG2  THR 117          1HG2      THR 117  12.221  -0.767  -5.712
  889   2HG2  THR 117          2HG2      THR 117  10.843  -0.807  -6.813
  890   3HG2  THR 117          3HG2      THR 117  12.422  -1.374  -7.356
  891    H    ALA 118           H        ALA 118   9.755  -1.309  -3.942
  892    HA   ALA 118           HA       ALA 118   7.834  -3.434  -3.631
  893   1HB   ALA 118          1HB       ALA 118   7.302  -3.264  -1.429
  894   2HB   ALA 118          2HB       ALA 118   7.823  -1.581  -1.313
  895   3HB   ALA 118          3HB       ALA 118   9.022  -2.877  -1.321
  896    H    ASP 119           H        ASP 119   5.857  -2.827  -4.119
  897    HA   ASP 119           HA       ASP 119   5.436  -0.018  -4.861
  898   1HB   ASP 119          2HB       ASP 119   5.186  -1.562  -6.724
  899   2HB   ASP 119          1HB       ASP 119   4.099  -2.577  -5.786
  900    H    VAL 120           H        VAL 120   4.575   0.963  -3.099
  901    HA   VAL 120           HA       VAL 120   2.208  -0.342  -1.948
  902    HB   VAL 120           HB       VAL 120   2.540   0.589   0.084
  903   1HG1  VAL 120          1HG1      VAL 120   5.038  -0.005  -1.168
  904   2HG1  VAL 120          2HG1      VAL 120   4.526  -0.264   0.500
  905   3HG1  VAL 120          3HG1      VAL 120   5.252   1.275   0.029
  906   1HG2  VAL 120          1HG2      VAL 120   4.099   2.944  -0.901
  907   2HG2  VAL 120          2HG2      VAL 120   3.189   2.759   0.597
  908   3HG2  VAL 120          3HG2      VAL 120   2.337   2.922  -0.937
  909    H    HIS 121           H        HIS 121   0.278   0.757  -1.881
  910    HA   HIS 121           HA       HIS 121   0.147   3.072  -3.690
  911   1HB   HIS 121          2HB       HIS 121  -0.957   0.385  -3.990
  912   2HB   HIS 121          1HB       HIS 121  -2.181   1.644  -4.135
  913    HD1  HIS 121           1HD      HIS 121   0.725   0.150  -5.911
  914    HD2  HIS 121           2HD      HIS 121  -1.789   3.437  -6.315
  915    HE1  HIS 121           1HE      HIS 121   1.027   0.949  -8.268
  916    HE2  HIS 121           2HE      HIS 121  -0.673   2.783  -8.555
  917    H    PHE 122           H        PHE 122  -0.900   4.722  -2.804
  918    HA   PHE 122           HA       PHE 122  -2.992   4.129  -0.822
  919   1HB   PHE 122          2HB       PHE 122  -2.107   6.930  -1.125
  920   2HB   PHE 122          1HB       PHE 122  -2.440   6.006   0.332
  921    HD1  PHE 122           1HD      PHE 122  -0.707   5.045   1.590
  922    HD2  PHE 122           2HD      PHE 122   0.128   6.685  -2.247
  923    HE1  PHE 122           1HE      PHE 122   1.700   4.894   2.051
  924    HE2  PHE 122           2HE      PHE 122   2.536   6.532  -1.792
  925    HZ   PHE 122           HZ       PHE 122   3.325   5.636   0.359
  926    H    GLU 123           H        GLU 123  -5.000   5.260  -1.012
  927    HA   GLU 123           HA       GLU 123  -5.785   5.648  -3.757
  928   1HB   GLU 123          2HB       GLU 123  -7.162   4.620  -1.795
  929   2HB   GLU 123          1HB       GLU 123  -7.554   6.293  -1.425
  930   1HG   GLU 123          2HG       GLU 123  -9.194   6.177  -2.901
  931   2HG   GLU 123          1HG       GLU 123  -7.980   6.020  -4.170
  932    H    ARG 124           H        ARG 124  -4.530   7.638  -1.338
  933    HA   ARG 124           HA       ARG 124  -5.602  10.031  -2.667
  934   1HB   ARG 124          2HB       ARG 124  -5.346   9.320   0.140
  935   2HB   ARG 124          1HB       ARG 124  -4.587  10.862  -0.234
  936   1HG   ARG 124          2HG       ARG 124  -6.615  11.750   0.005
  937   2HG   ARG 124          1HG       ARG 124  -6.995  11.021  -1.557
  938   1HD   ARG 124          2HD       ARG 124  -7.250   9.068   0.527
  939   2HD   ARG 124          1HD       ARG 124  -8.192  10.502   0.933
  940    HE   ARG 124           HE       ARG 124  -8.836   9.988  -1.677
  941   1HH1  ARG 124          1HH1      ARG 124  -8.936   8.144   1.314
  942   2HH1  ARG 124          2HH1      ARG 124 -10.310   7.191   0.823
  943   1HH2  ARG 124          1HH2      ARG 124 -10.624   8.727  -2.325
  944   2HH2  ARG 124          2HH2      ARG 124 -11.256   7.504  -1.251
  945    H    ARG 125           H        ARG 125  -4.227  11.555  -3.371
  946    HA   ARG 125           HA       ARG 125  -1.565  10.856  -3.937
  947   1HB   ARG 125          2HB       ARG 125  -3.185  13.367  -4.158
  948   2HB   ARG 125          1HB       ARG 125  -1.461  13.400  -4.490
  949   1HG   ARG 125          2HG       ARG 125  -1.662  12.149  -6.395
  950   2HG   ARG 125          1HG       ARG 125  -3.147  11.364  -5.853
  951   1HD   ARG 125          2HD       ARG 125  -3.125  13.274  -7.714
  952   2HD   ARG 125          1HD       ARG 125  -4.471  13.046  -6.599
  953    HE   ARG 125           HE       ARG 125  -2.403  15.131  -6.402
  954   1HH1  ARG 125          1HH1      ARG 125  -5.506  13.827  -5.450
  955   2HH1  ARG 125          2HH1      ARG 125  -6.002  15.259  -4.602
  956   1HH2  ARG 125          1HH2      ARG 125  -3.040  17.034  -5.306
  957   2HH2  ARG 125          2HH2      ARG 125  -4.591  17.087  -4.521
  958    H    ALA 126           H        ALA 126  -3.002  12.898  -1.442
  959    HA   ALA 126           HA       ALA 126  -0.688  14.223  -0.599
  960   1HB   ALA 126          1HB       ALA 126  -1.991  14.319   1.643
  961   2HB   ALA 126          2HB       ALA 126  -3.298  13.606   0.694
  962   3HB   ALA 126          3HB       ALA 126  -2.611  15.161   0.222
  963    H    ASP 127           H        ASP 127  -1.986  11.098   0.354
  964    HA   ASP 127           HA       ASP 127  -0.224  10.587   2.487
  965   1HB   ASP 127          2HB       ASP 127  -2.283   9.188   1.346
  966   2HB   ASP 127          1HB       ASP 127  -0.887   8.226   0.862
  967    H    ALA 128           H        ALA 128   0.127  10.281  -0.970
  968    HA   ALA 128           HA       ALA 128   2.701   8.975  -0.800
  969   1HB   ALA 128          1HB       ALA 128   1.418   8.360  -2.682
  970   2HB   ALA 128          2HB       ALA 128   2.697   9.408  -3.300
  971   3HB   ALA 128          3HB       ALA 128   1.064  10.040  -3.086
  972    H    LEU 129           H        LEU 129   1.393  12.185  -1.419
  973    HA   LEU 129           HA       LEU 129   3.758  13.546  -2.024
  974   1HB   LEU 129          2HB       LEU 129   1.653  14.660  -2.270
  975   2HB   LEU 129          1HB       LEU 129   1.256  14.418  -0.579
  976    HG   LEU 129           HG       LEU 129   3.702  15.980  -0.988
  977   1HD1  LEU 129          1HD1      LEU 129   2.842  17.107  -2.762
  978   2HD1  LEU 129          2HD1      LEU 129   2.054  18.006  -1.466
  979   3HD1  LEU 129          3HD1      LEU 129   1.172  16.745  -2.327
  980   1HD2  LEU 129          1HD2      LEU 129   1.265  16.921   0.444
  981   2HD2  LEU 129          2HD2      LEU 129   2.968  17.111   0.866
  982   3HD2  LEU 129          3HD2      LEU 129   2.168  15.555   1.101
  983    H    LYS 130           H        LYS 130   2.213  12.914   1.102
  984    HA   LYS 130           HA       LYS 130   4.202  14.023   2.737
  985   1HB   LYS 130          2HB       LYS 130   2.202  13.563   3.835
  986   2HB   LYS 130          1HB       LYS 130   2.060  11.963   3.122
  987   1HG   LYS 130          2HG       LYS 130   4.405  11.997   4.712
  988   2HG   LYS 130          1HG       LYS 130   3.090  12.695   5.661
  989   1HD   LYS 130          2HD       LYS 130   3.135  10.000   4.306
  990   2HD   LYS 130          1HD       LYS 130   3.126  10.323   6.041
  991   1HE   LYS 130          2HE       LYS 130   0.900  11.393   5.769
  992   2HE   LYS 130          1HE       LYS 130   0.913  10.907   4.076
  993   1HZ   LYS 130          1HZ       LYS 130   0.591   8.726   4.596
  994   2HZ   LYS 130          2HZ       LYS 130  -0.231   9.444   5.896
  995   3HZ   LYS 130          3HZ       LYS 130   1.341   8.846   6.116
  996    H    ALA 131           H        ALA 131   3.846  10.826   1.297
  997    HA   ALA 131           HA       ALA 131   5.990   9.585   2.639
  998   1HB   ALA 131          1HB       ALA 131   4.137   8.536   1.178
  999   2HB   ALA 131          2HB       ALA 131   5.742   7.802   1.176
 1000   3HB   ALA 131          3HB       ALA 131   5.244   8.841  -0.161
 1001    H    MET 132           H        MET 132   5.930  11.483  -0.381
 1002    HA   MET 132           HA       MET 132   8.661  10.991  -0.985
 1003   1HB   MET 132          2HB       MET 132   8.187  12.051  -2.904
 1004   2HB   MET 132          1HB       MET 132   6.525  12.074  -2.341
 1005   1HG   MET 132          2HG       MET 132   6.597  14.296  -1.784
 1006   2HG   MET 132          1HG       MET 132   8.344  14.292  -1.549
 1007   1HE   MET 132          1HE       MET 132   9.714  15.763  -4.512
 1008   2HE   MET 132          2HE       MET 132  10.078  14.089  -4.090
 1009   3HE   MET 132          3HE       MET 132   9.795  15.278  -2.818
 1010    H    LYS 133           H        LYS 133   6.970  13.369   0.960
 1011    HA   LYS 133           HA       LYS 133   9.280  15.043   1.275
 1012   1HB   LYS 133          2HB       LYS 133   6.487  15.014   2.221
 1013   2HB   LYS 133          1HB       LYS 133   7.641  15.750   3.324
 1014   1HG   LYS 133          2HG       LYS 133   7.254  17.607   2.150
 1015   2HG   LYS 133          1HG       LYS 133   8.355  16.894   0.967
 1016   1HD   LYS 133          2HD       LYS 133   6.215  15.749   0.047
 1017   2HD   LYS 133          1HD       LYS 133   5.364  17.007   0.945
 1018   1HE   LYS 133          2HE       LYS 133   7.535  17.548  -1.073
 1019   2HE   LYS 133          1HE       LYS 133   5.812  17.556  -1.452
 1020   1HZ   LYS 133          1HZ       LYS 133   5.751  19.220   0.548
 1021   2HZ   LYS 133          2HZ       LYS 133   6.158  19.749  -1.010
 1022   3HZ   LYS 133          3HZ       LYS 133   7.379  19.463   0.132
 1023    H    GLN 134           H        GLN 134   7.568  12.688   3.293
 1024    HA   GLN 134           HA       GLN 134   9.466  13.091   5.453
 1025   1HB   GLN 134          2HB       GLN 134   6.783  12.041   5.183
 1026   2HB   GLN 134          1HB       GLN 134   7.793  10.971   6.146
 1027   1HG   GLN 134          2HG       GLN 134   7.042  12.319   7.795
 1028   2HG   GLN 134          1HG       GLN 134   8.452  13.259   7.307
 1029   1HE2  GLN 134          1HE2      GLN 134   7.882  14.738   5.342
 1030   2HE2  GLN 134          2HE2      GLN 134   6.456  15.701   5.553
 1031    H    TYR 135           H        TYR 135   8.342  10.262   3.554
 1032    HA   TYR 135           HA       TYR 135  10.280   8.539   4.705
 1033   1HB   TYR 135          2HB       TYR 135   8.064   8.215   3.021
 1034   2HB   TYR 135          1HB       TYR 135   9.444   7.649   2.083
 1035    HD1  TYR 135           1HD      TYR 135   9.853   5.404   2.213
 1036    HD2  TYR 135           2HD      TYR 135   8.232   7.359   5.619
 1037    HE1  TYR 135           1HE      TYR 135   9.824   3.263   3.406
 1038    HE2  TYR 135           2HE      TYR 135   8.192   5.220   6.834
 1039    HH   TYR 135           HH       TYR 135   8.679   2.218   5.286
 1040    H    LYS 136           H        LYS 136  10.091   9.975   1.428
 1041    HA   LYS 136           HA       LYS 136  12.636   9.076   0.644
 1042   1HB   LYS 136          2HB       LYS 136  10.736  10.087  -0.801
 1043   2HB   LYS 136          1HB       LYS 136  11.457  11.639  -0.393
 1044   1HG   LYS 136          2HG       LYS 136  13.538   9.912  -1.234
 1045   2HG   LYS 136          1HG       LYS 136  12.223   9.796  -2.407
 1046   1HD   LYS 136          2HD       LYS 136  12.290  12.097  -2.871
 1047   2HD   LYS 136          1HD       LYS 136  13.241  12.446  -1.425
 1048   1HE   LYS 136          2HE       LYS 136  14.240  10.809  -3.750
 1049   2HE   LYS 136          1HE       LYS 136  14.526  12.538  -3.569
 1050   1HZ   LYS 136          1HZ       LYS 136  15.494  11.892  -1.304
 1051   2HZ   LYS 136          2HZ       LYS 136  16.417  11.567  -2.685
 1052   3HZ   LYS 136          3HZ       LYS 136  15.568  10.314  -1.926
 1053    H    GLY 137           H        GLY 137  14.526   9.576   1.468
 1054   1HA   GLY 137          2HA       GLY 137  16.077  11.495   1.905
 1055   2HA   GLY 137          1HA       GLY 137  14.777  12.136   2.905
 1056    H    VAL 138           H        VAL 138  14.213   9.184   3.606
 1057    HA   VAL 138           HA       VAL 138  15.675   9.141   6.045
 1058    HB   VAL 138           HB       VAL 138  13.447   8.150   5.901
 1059   1HG1  VAL 138          1HG1      VAL 138  14.492   6.813   3.633
 1060   2HG1  VAL 138          2HG1      VAL 138  12.843   6.795   4.265
 1061   3HG1  VAL 138          3HG1      VAL 138  14.015   5.595   4.817
 1062   1HG2  VAL 138          1HG2      VAL 138  14.380   5.730   6.750
 1063   2HG2  VAL 138          2HG2      VAL 138  14.267   7.186   7.739
 1064   3HG2  VAL 138          3HG2      VAL 138  15.790   6.769   6.956
 1065    HA   PRO 139           HA       PRO 139  19.382   7.172   4.589
 1066   1HB   PRO 139          2HB       PRO 139  20.513   7.073   7.073
 1067   2HB   PRO 139          1HB       PRO 139  20.561   8.514   6.051
 1068   1HG   PRO 139          2HG       PRO 139  18.738   7.872   8.333
 1069   2HG   PRO 139          1HG       PRO 139  19.533   9.405   7.931
 1070   1HD   PRO 139          2HD       PRO 139  16.936   8.929   7.358
 1071   2HD   PRO 139          1HD       PRO 139  17.966   9.942   6.325
 1072    H    LEU 140           H        LEU 140  19.897   5.028   4.592
 1073    HA   LEU 140           HA       LEU 140  18.589   3.335   6.554
 1074   1HB   LEU 140          2HB       LEU 140  17.455   3.696   4.040
 1075   2HB   LEU 140          1HB       LEU 140  18.344   2.193   3.884
 1076    HG   LEU 140           HG       LEU 140  17.091   1.640   6.163
 1077   1HD1  LEU 140          1HD1      LEU 140  14.928   3.186   4.829
 1078   2HD1  LEU 140          2HD1      LEU 140  16.041   4.032   5.906
 1079   3HD1  LEU 140          3HD1      LEU 140  15.083   2.679   6.512
 1080   1HD2  LEU 140          1HD2      LEU 140  16.601   0.067   4.641
 1081   2HD2  LEU 140          2HD2      LEU 140  16.473   1.236   3.326
 1082   3HD2  LEU 140          3HD2      LEU 140  15.111   0.985   4.419
 1083    H    ASP 141           H        ASP 141  20.587   2.816   7.329
 1084    HA   ASP 141           HA       ASP 141  22.559   1.658   7.494
 1085   1HB   ASP 141          2HB       ASP 141  21.600   0.154   5.570
 1086   2HB   ASP 141          1HB       ASP 141  22.637   1.118   4.529
 1087    H    GLY 142           H        GLY 142  24.652   1.872   5.406
 1088   1HA   GLY 142          2HA       GLY 142  25.710   4.315   6.202
 1089   2HA   GLY 142          1HA       GLY 142  26.266   3.389   4.823
 1090    H    ARG 143           H        ARG 143  23.247   3.906   3.853
 1091    HA   ARG 143           HA       ARG 143  23.572   6.678   3.005
 1092   1HB   ARG 143          2HB       ARG 143  24.467   4.589   1.402
 1093   2HB   ARG 143          1HB       ARG 143  22.864   4.936   0.770
 1094   1HG   ARG 143          2HG       ARG 143  24.376   6.240  -0.480
 1095   2HG   ARG 143          1HG       ARG 143  23.563   7.349   0.626
 1096   1HD   ARG 143          2HD       ARG 143  25.687   8.029   1.007
 1097   2HD   ARG 143          1HD       ARG 143  25.653   6.686   2.151
 1098    HE   ARG 143           HE       ARG 143  26.653   6.305  -0.587
 1099   1HH1  ARG 143          1HH1      ARG 143  27.146   6.200   2.881
 1100   2HH1  ARG 143          2HH1      ARG 143  28.670   5.371   2.766
 1101   1HH2  ARG 143          1HH2      ARG 143  28.643   5.216  -0.743
 1102   2HH2  ARG 143          2HH2      ARG 143  29.530   4.828   0.705
 1103    HA   PRO 144           HA       PRO 144  19.114   6.803   3.301
 1104   1HB   PRO 144          2HB       PRO 144  19.176   8.139   0.641
 1105   2HB   PRO 144          1HB       PRO 144  18.401   8.656   2.143
 1106   1HG   PRO 144          2HG       PRO 144  20.645   9.814   1.316
 1107   2HG   PRO 144          1HG       PRO 144  20.382   9.471   3.037
 1108   1HD   PRO 144          2HD       PRO 144  22.091   8.029   1.053
 1109   2HD   PRO 144          1HD       PRO 144  22.393   8.367   2.769
 1110    H    MET 145           H        MET 145  17.234   5.919   2.386
 1111    HA   MET 145           HA       MET 145  17.812   3.684   0.603
 1112   1HB   MET 145          2HB       MET 145  16.107   2.561   1.566
 1113   2HB   MET 145          1HB       MET 145  16.338   3.735   2.850
 1114   1HG   MET 145          2HG       MET 145  14.297   4.555   2.577
 1115   2HG   MET 145          1HG       MET 145  14.512   4.715   0.835
 1116   1HE   MET 145          1HE       MET 145  13.459   2.582   3.790
 1117   2HE   MET 145          2HE       MET 145  12.181   1.585   3.095
 1118   3HE   MET 145          3HE       MET 145  12.004   3.340   3.142
 1119    H    ASP 146           H        ASP 146  15.892   3.116  -0.893
 1120    HA   ASP 146           HA       ASP 146  15.606   5.509  -2.584
 1121   1HB   ASP 146          2HB       ASP 146  16.600   3.131  -3.297
 1122   2HB   ASP 146          1HB       ASP 146  14.907   2.861  -3.706
 1123    H    ILE 147           H        ILE 147  13.794   6.474  -2.862
 1124    HA   ILE 147           HA       ILE 147  11.255   5.064  -2.465
 1125    HB   ILE 147           HB       ILE 147  11.041   7.739  -1.451
 1126   1HG1  ILE 147          2HG1      ILE 147  13.509   6.410  -0.750
 1127   2HG1  ILE 147          1HG1      ILE 147  12.961   8.026  -0.329
 1128   1HG2  ILE 147          1HG2      ILE 147   9.757   6.750   0.151
 1129   2HG2  ILE 147          2HG2      ILE 147  10.817   5.346   0.294
 1130   3HG2  ILE 147          3HG2      ILE 147   9.725   5.492  -1.086
 1131   1HD1  ILE 147          1HD1      ILE 147  13.514   6.644   1.622
 1132   2HD1  ILE 147          2HD1      ILE 147  12.235   5.518   1.166
 1133   3HD1  ILE 147          3HD1      ILE 147  11.833   7.175   1.619
 1134    H    GLN 148           H        GLN 148   9.982   5.428  -4.142
 1135    HA   GLN 148           HA       GLN 148  10.242   7.993  -5.579
 1136   1HB   GLN 148          2HB       GLN 148   9.550   5.314  -6.804
 1137   2HB   GLN 148          1HB       GLN 148   9.726   6.841  -7.662
 1138   1HG   GLN 148          2HG       GLN 148  12.122   6.526  -6.297
 1139   2HG   GLN 148          1HG       GLN 148  11.727   4.913  -6.892
 1140   1HE2  GLN 148          1HE2      GLN 148  13.198   4.747  -8.484
 1141   2HE2  GLN 148          2HE2      GLN 148  13.250   5.783  -9.878
 1142    H    LEU 149           H        LEU 149   8.440   9.168  -5.581
 1143    HA   LEU 149           HA       LEU 149   5.903   7.789  -5.041
 1144   1HB   LEU 149          2HB       LEU 149   6.991  10.427  -4.160
 1145   2HB   LEU 149          1HB       LEU 149   5.260  10.267  -4.387
 1146    HG   LEU 149           HG       LEU 149   5.648   9.884  -2.095
 1147   1HD1  LEU 149          1HD1      LEU 149   4.877   7.656  -3.788
 1148   2HD1  LEU 149          2HD1      LEU 149   4.136   8.267  -2.308
 1149   3HD1  LEU 149          3HD1      LEU 149   5.488   7.138  -2.217
 1150   1HD2  LEU 149          1HD2      LEU 149   7.266   7.909  -1.506
 1151   2HD2  LEU 149          2HD2      LEU 149   7.894   9.535  -1.778
 1152   3HD2  LEU 149          3HD2      LEU 149   7.999   8.325  -3.055
 1153    H    VAL 150           H        VAL 150   4.955   7.501  -6.957
 1154    HA   VAL 150           HA       VAL 150   5.215   9.628  -8.973
 1155    HB   VAL 150           HB       VAL 150   4.122   6.901  -9.580
 1156   1HG1  VAL 150          1HG1      VAL 150   4.424   7.464 -11.749
 1157   2HG1  VAL 150          2HG1      VAL 150   5.902   8.370 -11.422
 1158   3HG1  VAL 150          3HG1      VAL 150   4.330   9.102 -11.102
 1159   1HG2  VAL 150          1HG2      VAL 150   6.627   7.225  -8.445
 1160   2HG2  VAL 150          2HG2      VAL 150   6.950   7.165 -10.177
 1161   3HG2  VAL 150          3HG2      VAL 150   6.079   5.844  -9.396
 1162    H    ALA 151           H        ALA 151   3.559  10.872  -9.371
 1163    HA   ALA 151           HA       ALA 151   1.461  11.711  -9.555
 1164   1HB   ALA 151          1HB       ALA 151   0.884   8.803  -9.601
 1165   2HB   ALA 151          2HB       ALA 151   0.395  10.074 -10.722
 1166   3HB   ALA 151          3HB       ALA 151  -0.454   9.875  -9.189
 1167    H    SER 152           H        SER 152   2.694  12.245  -7.357
 1168    HA   SER 152           HA       SER 152   1.023  11.407  -5.088
 1169   1HB   SER 152          2HB       SER 152   3.171  12.136  -3.807
 1170   2HB   SER 152          1HB       SER 152   3.187  10.591  -4.660
 1171    HG   SER 152           HG       SER 152   4.668  11.342  -5.967
 1172    H    GLN 153           H        GLN 153   3.295  14.018  -5.873
 1173    HA   GLN 153           HA       GLN 153   1.645  15.931  -4.466
 1174   1HB   GLN 153          2HB       GLN 153   3.578  17.435  -5.664
 1175   2HB   GLN 153          1HB       GLN 153   3.738  16.682  -4.085
 1176   1HG   GLN 153          2HG       GLN 153   5.666  15.971  -5.038
 1177   2HG   GLN 153          1HG       GLN 153   4.603  14.651  -5.524
 1178   1HE2  GLN 153          1HE2      GLN 153   6.319  14.398  -7.148
 1179   2HE2  GLN 153          2HE2      GLN 153   6.181  15.280  -8.634
 1180    H    ILE 154           H        ILE 154   2.469  15.070  -7.740
 1181    HA   ILE 154           HA       ILE 154   2.188  16.115  -9.752
 1182    HB   ILE 154           HB       ILE 154  -0.207  16.276 -10.409
 1183   1HG1  ILE 154          2HG1      ILE 154  -1.293  14.908  -8.118
 1184   2HG1  ILE 154          1HG1      ILE 154  -0.639  16.466  -7.624
 1185   1HG2  ILE 154          1HG2      ILE 154   0.008  14.125 -10.879
 1186   2HG2  ILE 154          2HG2      ILE 154  -0.252  13.677  -9.194
 1187   3HG2  ILE 154          3HG2      ILE 154   1.372  14.069  -9.763
 1188   1HD1  ILE 154          1HD1      ILE 154  -2.617  16.059  -9.856
 1189   2HD1  ILE 154          2HD1      ILE 154  -2.024  17.602  -9.238
 1190   3HD1  ILE 154          3HD1      ILE 154  -3.022  16.567  -8.215
 1191    H    ASP 155           H        ASP 155   3.006  17.986  -7.941
 1192    HA   ASP 155           HA       ASP 155   1.616  20.396  -8.902
 1193   1HB   ASP 155          2HB       ASP 155   1.383  19.766  -6.370
 1194   2HB   ASP 155          1HB       ASP 155   3.037  20.364  -6.260
 1195    H    LEU 156           H        LEU 156   4.581  18.893  -7.804
 1196    HA   LEU 156           HA       LEU 156   6.342  20.924  -8.737
 1197   1HB   LEU 156          2HB       LEU 156   6.609  18.031  -7.985
 1198   2HB   LEU 156          1HB       LEU 156   7.945  18.847  -8.780
 1199    HG   LEU 156           HG       LEU 156   7.689  20.600  -6.868
 1200   1HD1  LEU 156          1HD1      LEU 156   5.554  19.554  -6.055
 1201   2HD1  LEU 156          2HD1      LEU 156   6.788  19.814  -4.821
 1202   3HD1  LEU 156          3HD1      LEU 156   6.527  18.198  -5.480
 1203   1HD2  LEU 156          1HD2      LEU 156   9.676  19.348  -7.041
 1204   2HD2  LEU 156          2HD2      LEU 156   8.864  17.849  -6.589
 1205   3HD2  LEU 156          3HD2      LEU 156   9.112  19.116  -5.386
 1206    H    GLU 157           H        GLU 157   4.918  18.014 -10.033
 1207    HA   GLU 157           HA       GLU 157   5.709  18.846 -12.742
 1208   1HB   GLU 157          2HB       GLU 157   5.221  16.007 -11.838
 1209   2HB   GLU 157          1HB       GLU 157   5.850  16.540 -13.394
 1210   1HG   GLU 157          2HG       GLU 157   7.916  16.523 -12.633
 1211   2HG   GLU 157          1HG       GLU 157   7.484  17.562 -11.280
 1212    H    HIS 158           H        HIS 158   3.916  19.694 -13.639
 1213    HA   HIS 158           HA       HIS 158   1.299  18.724 -12.786
 1214   1HB   HIS 158          2HB       HIS 158   2.302  21.175 -14.150
 1215   2HB   HIS 158          1HB       HIS 158   0.654  20.668 -14.505
 1216    HD1  HIS 158           1HD      HIS 158  -0.221  22.826 -13.301
 1217    HD2  HIS 158           2HD      HIS 158   1.875  20.193 -10.854
 1218    HE1  HIS 158           1HE      HIS 158  -0.713  23.552 -10.941
 1219    HE2  HIS 158           2HE      HIS 158   0.680  22.038  -9.482
  Start of MODEL   10
    1    H    MET   1           H        MET   1 -34.073   3.935-103.042
    2    HA   MET   1           HA       MET   1 -36.587   4.002-101.581
    3   1HB   MET   1          2HB       MET   1 -36.299   1.849-102.313
    4   2HB   MET   1          1HB       MET   1 -34.546   1.957-102.272
    5   1HG   MET   1          2HG       MET   1 -35.549   2.085 -99.607
    6   2HG   MET   1          1HG       MET   1 -36.263   0.701-100.436
    7   1HE   MET   1          1HE       MET   1 -35.174  -1.494-100.634
    8   2HE   MET   1          2HE       MET   1 -35.154  -1.087 -98.918
    9   3HE   MET   1          3HE       MET   1 -33.743  -1.839 -99.662
   10    H    ALA   2           H        ALA   2 -33.116   3.837-100.969
   11    HA   ALA   2           HA       ALA   2 -31.804   4.568 -99.277
   12   1HB   ALA   2          1HB       ALA   2 -32.684   6.494 -97.912
   13   2HB   ALA   2          2HB       ALA   2 -34.175   6.357 -98.843
   14   3HB   ALA   2          3HB       ALA   2 -32.657   6.726 -99.661
   15    H    ASP   3           H        ASP   3 -33.671   2.309 -98.804
   16    HA   ASP   3           HA       ASP   3 -33.882   2.397 -95.881
   17   1HB   ASP   3          2HB       ASP   3 -35.771   1.456 -97.206
   18   2HB   ASP   3          1HB       ASP   3 -34.695   0.209 -97.810
   19    H    LYS   4           H        LYS   4 -32.421   0.586 -98.506
   20    HA   LYS   4           HA       LYS   4 -30.731  -1.066 -96.981
   21   1HB   LYS   4          2HB       LYS   4 -31.225  -0.583 -99.704
   22   2HB   LYS   4          1HB       LYS   4 -29.517  -0.241 -99.476
   23   1HG   LYS   4          2HG       LYS   4 -29.248  -2.432 -99.802
   24   2HG   LYS   4          1HG       LYS   4 -29.769  -2.582 -98.124
   25   1HD   LYS   4          2HD       LYS   4 -32.111  -2.813 -98.939
   26   2HD   LYS   4          1HD       LYS   4 -31.486  -2.828-100.590
   27   1HE   LYS   4          2HE       LYS   4 -30.678  -4.934-100.408
   28   2HE   LYS   4          1HE       LYS   4 -30.225  -4.725 -98.718
   29   1HZ   LYS   4          1HZ       LYS   4 -33.080  -4.819 -99.354
   30   2HZ   LYS   4          2HZ       LYS   4 -32.250  -5.407 -97.993
   31   3HZ   LYS   4          3HZ       LYS   4 -32.210  -6.272 -99.448
   32    H    MET   5           H        MET   5 -30.470   2.222 -98.107
   33    HA   MET   5           HA       MET   5 -27.747   2.626 -97.418
   34   1HB   MET   5          2HB       MET   5 -29.548   4.054 -98.841
   35   2HB   MET   5          1HB       MET   5 -29.601   4.933 -97.319
   36   1HG   MET   5          2HG       MET   5 -27.343   5.518 -97.445
   37   2HG   MET   5          1HG       MET   5 -27.014   4.309 -98.685
   38   1HE   MET   5          1HE       MET   5 -26.109   6.268-101.022
   39   2HE   MET   5          2HE       MET   5 -27.525   5.607-101.838
   40   3HE   MET   5          3HE       MET   5 -26.648   4.629-100.663
   41    H    ASP   6           H        ASP   6 -26.962   2.551 -95.468
   42    HA   ASP   6           HA       ASP   6 -26.578   2.999 -93.277
   43   1HB   ASP   6          2HB       ASP   6 -28.472   5.016 -93.938
   44   2HB   ASP   6          1HB       ASP   6 -28.916   4.351 -92.368
   45    H    MET   7           H        MET   7 -29.649   1.785 -94.296
   46    HA   MET   7           HA       MET   7 -30.873   0.001 -93.632
   47   1HB   MET   7          2HB       MET   7 -28.696  -1.102 -93.175
   48   2HB   MET   7          1HB       MET   7 -28.750  -0.474 -91.534
   49   1HG   MET   7          2HG       MET   7 -31.159  -1.726 -91.727
   50   2HG   MET   7          1HG       MET   7 -30.133  -2.753 -92.727
   51   1HE   MET   7          1HE       MET   7 -30.838  -1.748 -88.803
   52   2HE   MET   7          2HE       MET   7 -30.833  -3.503 -88.627
   53   3HE   MET   7          3HE       MET   7 -31.783  -2.748 -89.907
   54    H    SER   8           H        SER   8 -29.502   1.352 -90.630
   55    HA   SER   8           HA       SER   8 -32.081   1.198 -89.339
   56   1HB   SER   8          2HB       SER   8 -29.397   2.236 -88.404
   57   2HB   SER   8          1HB       SER   8 -30.839   2.162 -87.390
   58    HG   SER   8           HG       SER   8 -30.804  -0.026 -87.460
   59    H    LEU   9           H        LEU   9 -33.331   2.624 -90.580
   60    HA   LEU   9           HA       LEU   9 -32.641   5.342 -91.021
   61   1HB   LEU   9          2HB       LEU   9 -34.385   3.908 -92.237
   62   2HB   LEU   9          1HB       LEU   9 -35.444   4.257 -90.885
   63    HG   LEU   9           HG       LEU   9 -34.428   6.741 -91.758
   64   1HD1  LEU   9          1HD1      LEU   9 -35.241   6.738 -94.104
   65   2HD1  LEU   9          2HD1      LEU   9 -35.344   4.979 -94.024
   66   3HD1  LEU   9          3HD1      LEU   9 -33.781   5.779 -93.857
   67   1HD2  LEU   9          1HD2      LEU   9 -36.886   5.479 -91.153
   68   2HD2  LEU   9          2HD2      LEU   9 -37.069   6.277 -92.715
   69   3HD2  LEU   9          3HD2      LEU   9 -36.549   7.204 -91.307
   70    H    ASP  10           H        ASP  10 -34.133   3.597 -88.422
   71    HA   ASP  10           HA       ASP  10 -35.244   5.819 -87.045
   72   1HB   ASP  10          2HB       ASP  10 -35.475   4.314 -85.151
   73   2HB   ASP  10          1HB       ASP  10 -35.951   3.485 -86.626
   74    H    ASP  11           H        ASP  11 -32.121   4.193 -86.940
   75    HA   ASP  11           HA       ASP  11 -31.035   5.668 -84.791
   76   1HB   ASP  11          2HB       ASP  11 -30.105   3.547 -85.964
   77   2HB   ASP  11          1HB       ASP  11 -29.365   4.682 -87.089
   78    H    ILE  12           H        ILE  12 -31.120   6.216 -88.279
   79    HA   ILE  12           HA       ILE  12 -29.632   8.594 -88.373
   80    HB   ILE  12           HB       ILE  12 -32.057   7.907 -90.031
   81   1HG1  ILE  12          2HG1      ILE  12 -29.170   7.538 -90.835
   82   2HG1  ILE  12          1HG1      ILE  12 -30.079   6.262 -90.031
   83   1HG2  ILE  12          1HG2      ILE  12 -31.803  10.053 -90.671
   84   2HG2  ILE  12          2HG2      ILE  12 -30.447   9.432 -91.616
   85   3HG2  ILE  12          3HG2      ILE  12 -30.160  10.160 -90.031
   86   1HD1  ILE  12          1HD1      ILE  12 -30.509   7.452 -92.743
   87   2HD1  ILE  12          2HD1      ILE  12 -31.784   6.558 -91.914
   88   3HD1  ILE  12          3HD1      ILE  12 -30.256   5.764 -92.295
   89    H    ILE  13           H        ILE  13 -33.094   8.029 -87.907
   90    HA   ILE  13           HA       ILE  13 -34.050  10.582 -87.649
   91    HB   ILE  13           HB       ILE  13 -34.790   8.126 -86.060
   92   1HG1  ILE  13          2HG1      ILE  13 -36.287   9.562 -88.260
   93   2HG1  ILE  13          1HG1      ILE  13 -35.201   8.205 -88.546
   94   1HG2  ILE  13          1HG2      ILE  13 -35.508  10.840 -85.508
   95   2HG2  ILE  13          2HG2      ILE  13 -35.991   9.368 -84.665
   96   3HG2  ILE  13          3HG2      ILE  13 -36.938   9.950 -86.034
   97   1HD1  ILE  13          1HD1      ILE  13 -36.645   6.688 -87.639
   98   2HD1  ILE  13          2HD1      ILE  13 -37.783   7.856 -88.306
   99   3HD1  ILE  13          3HD1      ILE  13 -37.408   7.876 -86.584
  100    H    LYS  14           H        LYS  14 -32.647   8.623 -85.023
  101    HA   LYS  14           HA       LYS  14 -32.698  10.636 -83.062
  102   1HB   LYS  14          2HB       LYS  14 -30.638   8.436 -83.277
  103   2HB   LYS  14          1HB       LYS  14 -31.169   9.262 -81.819
  104   1HG   LYS  14          2HG       LYS  14 -32.948   7.526 -83.515
  105   2HG   LYS  14          1HG       LYS  14 -32.072   6.963 -82.091
  106   1HD   LYS  14          2HD       LYS  14 -33.836   9.362 -81.879
  107   2HD   LYS  14          1HD       LYS  14 -34.557   7.752 -81.889
  108   1HE   LYS  14          2HE       LYS  14 -32.254   8.036 -80.099
  109   2HE   LYS  14          1HE       LYS  14 -33.633   9.048 -79.671
  110   1HZ   LYS  14          1HZ       LYS  14 -33.318   6.425 -79.033
  111   2HZ   LYS  14          2HZ       LYS  14 -34.392   6.367 -80.343
  112   3HZ   LYS  14          3HZ       LYS  14 -34.776   7.290 -78.971
  113    H    LEU  15           H        LEU  15 -30.087   9.618 -85.248
  114    HA   LEU  15           HA       LEU  15 -28.118  11.386 -84.372
  115   1HB   LEU  15          2HB       LEU  15 -28.437   9.493 -86.438
  116   2HB   LEU  15          1HB       LEU  15 -27.924  10.979 -87.211
  117    HG   LEU  15           HG       LEU  15 -26.055   9.452 -86.628
  118   1HD1  LEU  15          1HD1      LEU  15 -24.919  11.362 -85.106
  119   2HD1  LEU  15          2HD1      LEU  15 -26.287  12.254 -85.770
  120   3HD1  LEU  15          3HD1      LEU  15 -25.126  11.487 -86.852
  121   1HD2  LEU  15          1HD2      LEU  15 -27.376   9.500 -84.067
  122   2HD2  LEU  15          2HD2      LEU  15 -25.682   9.966 -83.920
  123   3HD2  LEU  15          3HD2      LEU  15 -26.111   8.424 -84.661
  124    H    ASN  16           H        ASN  16 -30.323  11.760 -87.150
  125    HA   ASN  16           HA       ASN  16 -29.281  14.318 -87.802
  126   1HB   ASN  16          2HB       ASN  16 -30.596  14.259 -89.673
  127   2HB   ASN  16          1HB       ASN  16 -30.516  12.545 -89.299
  128   1HD2  ASN  16          1HD2      ASN  16 -32.336  11.482 -88.654
  129   2HD2  ASN  16          2HD2      ASN  16 -33.915  12.179 -88.745
  130    H    ARG  17           H        ARG  17 -31.927  13.251 -85.780
  131    HA   ARG  17           HA       ARG  17 -33.154  15.839 -85.640
  132   1HB   ARG  17          2HB       ARG  17 -34.745  14.897 -84.292
  133   2HB   ARG  17          1HB       ARG  17 -34.158  13.461 -85.113
  134   1HG   ARG  17          2HG       ARG  17 -32.726  12.963 -83.175
  135   2HG   ARG  17          1HG       ARG  17 -33.382  14.379 -82.351
  136   1HD   ARG  17          2HD       ARG  17 -35.045  12.072 -83.356
  137   2HD   ARG  17          1HD       ARG  17 -34.453  12.220 -81.701
  138    HE   ARG  17           HE       ARG  17 -36.339  14.112 -82.977
  139   1HH1  ARG  17          1HH1      ARG  17 -35.140  12.394 -80.168
  140   2HH1  ARG  17          2HH1      ARG  17 -36.287  13.105 -79.076
  141   1HH2  ARG  17          1HH2      ARG  17 -37.874  15.032 -81.545
  142   2HH2  ARG  17          2HH2      ARG  17 -37.843  14.598 -79.858
  143    H    ASN  18           H        ASN  18 -30.538  14.264 -84.025
  144    HA   ASN  18           HA       ASN  18 -30.417  16.074 -81.803
  145   1HB   ASN  18          2HB       ASN  18 -29.365  13.745 -81.931
  146   2HB   ASN  18          1HB       ASN  18 -28.109  14.479 -82.922
  147   1HD2  ASN  18          1HD2      ASN  18 -26.404  15.276 -81.902
  148   2HD2  ASN  18          2HD2      ASN  18 -26.324  15.661 -80.219
  149    H    GLN  19           H        GLN  19 -29.501  16.171 -85.095
  150    HA   GLN  19           HA       GLN  19 -27.616  18.367 -84.700
  151   1HB   GLN  19          2HB       GLN  19 -28.482  17.041 -87.275
  152   2HB   GLN  19          1HB       GLN  19 -27.140  18.157 -87.073
  153   1HG   GLN  19          2HG       GLN  19 -25.798  16.589 -86.098
  154   2HG   GLN  19          1HG       GLN  19 -27.157  15.660 -85.466
  155   1HE2  GLN  19          1HE2      GLN  19 -25.016  14.458 -86.742
  156   2HE2  GLN  19          2HE2      GLN  19 -25.573  13.779 -88.240
  157    H    ARG  20           H        ARG  20 -30.793  18.174 -84.652
  158    HA   ARG  20           HA       ARG  20 -31.170  20.747 -86.025
  159   1HB   ARG  20          2HB       ARG  20 -32.558  18.208 -86.474
  160   2HB   ARG  20          1HB       ARG  20 -33.653  19.541 -86.138
  161   1HG   ARG  20          2HG       ARG  20 -33.462  19.570 -88.443
  162   2HG   ARG  20          1HG       ARG  20 -32.319  20.813 -87.928
  163   1HD   ARG  20          2HD       ARG  20 -30.804  18.515 -87.911
  164   2HD   ARG  20          1HD       ARG  20 -31.850  18.295 -89.314
  165    HE   ARG  20           HE       ARG  20 -30.164  20.688 -88.931
  166   1HH1  ARG  20          1HH1      ARG  20 -31.475  18.122 -90.914
  167   2HH1  ARG  20          2HH1      ARG  20 -30.692  18.669 -92.372
  168   1HH2  ARG  20          1HH2      ARG  20 -29.118  21.415 -90.843
  169   2HH2  ARG  20          2HH2      ARG  20 -29.363  20.546 -92.327
  170    H    ARG  21           H        ARG  21 -33.012  21.978 -85.193
  171    HA   ARG  21           HA       ARG  21 -34.348  22.869 -83.603
  172   1HB   ARG  21          2HB       ARG  21 -35.009  20.304 -83.426
  173   2HB   ARG  21          1HB       ARG  21 -34.245  20.460 -81.851
  174   1HG   ARG  21          2HG       ARG  21 -36.513  20.863 -81.465
  175   2HG   ARG  21          1HG       ARG  21 -35.771  22.463 -81.486
  176   1HD   ARG  21          2HD       ARG  21 -36.785  21.417 -84.063
  177   2HD   ARG  21          1HD       ARG  21 -37.990  21.867 -82.855
  178    HE   ARG  21           HE       ARG  21 -36.412  24.028 -82.859
  179   1HH1  ARG  21          1HH1      ARG  21 -37.864  22.211 -85.475
  180   2HH1  ARG  21          2HH1      ARG  21 -37.941  23.564 -86.558
  181   1HH2  ARG  21          1HH2      ARG  21 -36.494  25.821 -84.276
  182   2HH2  ARG  21          2HH2      ARG  21 -37.137  25.621 -85.881
  183    H    VAL  22           H        VAL  22 -32.260  20.717 -81.671
  184    HA   VAL  22           HA       VAL  22 -30.992  23.050 -80.466
  185    HB   VAL  22           HB       VAL  22 -32.869  22.754 -79.000
  186   1HG1  VAL  22          1HG1      VAL  22 -33.568  20.530 -79.535
  187   2HG1  VAL  22          2HG1      VAL  22 -33.259  20.611 -77.800
  188   3HG1  VAL  22          3HG1      VAL  22 -32.082  19.850 -78.871
  189   1HG2  VAL  22          1HG2      VAL  22 -30.586  21.423 -77.579
  190   2HG2  VAL  22          2HG2      VAL  22 -31.790  22.530 -76.923
  191   3HG2  VAL  22          3HG2      VAL  22 -30.556  23.126 -78.035
  192    H    ASN  23           H        ASN  23 -28.887  22.684 -79.992
  193    HA   ASN  23           HA       ASN  23 -27.923  19.916 -80.320
  194   1HB   ASN  23          2HB       ASN  23 -27.262  21.563 -82.107
  195   2HB   ASN  23          1HB       ASN  23 -26.364  22.446 -80.875
  196   1HD2  ASN  23          1HD2      ASN  23 -24.403  22.104 -81.897
  197   2HD2  ASN  23          2HD2      ASN  23 -23.628  20.558 -81.925
  198    H    ARG  24           H        ARG  24 -27.875  19.299 -78.195
  199    HA   ARG  24           HA       ARG  24 -25.553  19.962 -76.731
  200   1HB   ARG  24          2HB       ARG  24 -26.663  20.868 -74.688
  201   2HB   ARG  24          1HB       ARG  24 -26.722  21.965 -76.060
  202   1HG   ARG  24          2HG       ARG  24 -29.054  20.956 -76.484
  203   2HG   ARG  24          1HG       ARG  24 -28.931  20.374 -74.822
  204   1HD   ARG  24          2HD       ARG  24 -28.209  22.905 -74.419
  205   2HD   ARG  24          1HD       ARG  24 -29.199  23.139 -75.860
  206    HE   ARG  24           HE       ARG  24 -30.790  21.628 -74.279
  207   1HH1  ARG  24          1HH1      ARG  24 -29.042  24.623 -73.768
  208   2HH1  ARG  24          2HH1      ARG  24 -30.159  25.214 -72.570
  209   1HH2  ARG  24          1HH2      ARG  24 -32.246  22.401 -72.714
  210   2HH2  ARG  24          2HH2      ARG  24 -31.982  23.950 -71.968
  211    H    GLY  25           H        GLY  25 -26.831  17.651 -77.759
  212   1HA   GLY  25          2HA       GLY  25 -27.256  15.483 -77.074
  213   2HA   GLY  25          1HA       GLY  25 -27.079  16.012 -75.405
  214    H    GLY  26           H        GLY  26 -28.891  15.163 -74.499
  215   1HA   GLY  26          2HA       GLY  26 -31.464  15.947 -75.725
  216   2HA   GLY  26          1HA       GLY  26 -31.233  14.507 -74.746
  217    H    GLY  27           H        GLY  27 -29.547  15.953 -72.800
  218   1HA   GLY  27          2HA       GLY  27 -31.143  18.075 -71.710
  219   2HA   GLY  27          1HA       GLY  27 -31.384  16.559 -70.858
  220    HA   PRO  28           HA       PRO  28 -26.833  17.886 -70.077
  221   1HB   PRO  28          2HB       PRO  28 -26.084  20.371 -70.754
  222   2HB   PRO  28          1HB       PRO  28 -26.072  19.050 -71.930
  223   1HG   PRO  28          2HG       PRO  28 -28.096  21.219 -71.538
  224   2HG   PRO  28          1HG       PRO  28 -27.432  20.568 -73.047
  225   1HD   PRO  28          2HD       PRO  28 -29.863  19.841 -72.000
  226   2HD   PRO  28          1HD       PRO  28 -28.895  18.807 -73.068
  227    H    ARG  29           H        ARG  29 -28.533  17.875 -68.203
  228    HA   ARG  29           HA       ARG  29 -28.869  20.454 -66.918
  229   1HB   ARG  29          2HB       ARG  29 -29.619  17.688 -65.946
  230   2HB   ARG  29          1HB       ARG  29 -30.105  19.208 -65.206
  231   1HG   ARG  29          2HG       ARG  29 -30.807  18.491 -68.035
  232   2HG   ARG  29          1HG       ARG  29 -31.819  18.055 -66.657
  233   1HD   ARG  29          2HD       ARG  29 -31.032  20.850 -66.606
  234   2HD   ARG  29          1HD       ARG  29 -31.903  20.429 -68.080
  235    HE   ARG  29           HE       ARG  29 -32.925  20.165 -65.331
  236   1HH1  ARG  29          1HH1      ARG  29 -33.464  20.335 -68.790
  237   2HH1  ARG  29          2HH1      ARG  29 -35.198  20.352 -68.652
  238   1HH2  ARG  29          1HH2      ARG  29 -35.192  20.208 -65.139
  239   2HH2  ARG  29          2HH2      ARG  29 -36.183  20.285 -66.568
  240    H    ARG  30           H        ARG  30 -27.204  21.294 -65.900
  241    HA   ARG  30           HA       ARG  30 -25.705  19.640 -64.019
  242   1HB   ARG  30          2HB       ARG  30 -23.586  20.108 -64.874
  243   2HB   ARG  30          1HB       ARG  30 -24.529  19.792 -66.321
  244   1HG   ARG  30          2HG       ARG  30 -24.269  22.601 -65.370
  245   2HG   ARG  30          1HG       ARG  30 -22.898  21.839 -66.179
  246   1HD   ARG  30          2HD       ARG  30 -23.851  22.370 -68.116
  247   2HD   ARG  30          1HD       ARG  30 -25.114  21.196 -67.744
  248    HE   ARG  30           HE       ARG  30 -26.122  23.256 -66.501
  249   1HH1  ARG  30          1HH1      ARG  30 -24.478  23.233 -69.597
  250   2HH1  ARG  30          2HH1      ARG  30 -25.341  24.616 -70.205
  251   1HH2  ARG  30          1HH2      ARG  30 -27.248  25.083 -67.297
  252   2HH2  ARG  30          2HH2      ARG  30 -26.882  25.690 -68.885
  253    H    ASN  31           H        ASN  31 -24.440  20.919 -62.507
  254    HA   ASN  31           HA       ASN  31 -25.889  23.154 -61.518
  255   1HB   ASN  31          2HB       ASN  31 -24.314  21.380 -60.335
  256   2HB   ASN  31          1HB       ASN  31 -23.077  22.588 -60.663
  257   1HD2  ASN  31          1HD2      ASN  31 -26.430  22.528 -59.463
  258   2HD2  ASN  31          2HD2      ASN  31 -26.126  23.576 -58.116
  259    H    ARG  32           H        ARG  32 -25.304  25.352 -61.454
  260    HA   ARG  32           HA       ARG  32 -24.195  26.357 -63.815
  261   1HB   ARG  32          2HB       ARG  32 -25.168  27.507 -61.285
  262   2HB   ARG  32          1HB       ARG  32 -23.998  28.496 -62.147
  263   1HG   ARG  32          2HG       ARG  32 -26.455  27.370 -63.456
  264   2HG   ARG  32          1HG       ARG  32 -26.425  28.940 -62.653
  265   1HD   ARG  32          2HD       ARG  32 -25.105  28.062 -65.175
  266   2HD   ARG  32          1HD       ARG  32 -25.991  29.544 -64.826
  267    HE   ARG  32           HE       ARG  32 -23.876  29.950 -63.316
  268   1HH1  ARG  32          1HH1      ARG  32 -24.009  28.609 -66.562
  269   2HH1  ARG  32          2HH1      ARG  32 -22.438  29.208 -67.000
  270   1HH2  ARG  32          1HH2      ARG  32 -21.806  30.720 -63.894
  271   2HH2  ARG  32          2HH2      ARG  32 -21.175  30.397 -65.483
  272    HA   PRO  33           HA       PRO  33 -20.124  27.399 -61.444
  273   1HB   PRO  33          2HB       PRO  33 -20.221  25.870 -58.946
  274   2HB   PRO  33          1HB       PRO  33 -19.849  27.576 -59.198
  275   1HG   PRO  33          2HG       PRO  33 -22.133  26.778 -58.026
  276   2HG   PRO  33          1HG       PRO  33 -22.059  28.215 -59.062
  277   1HD   PRO  33          2HD       PRO  33 -23.037  25.457 -59.716
  278   2HD   PRO  33          1HD       PRO  33 -23.753  27.032 -60.128
  279    H    ALA  34           H        ALA  34 -21.487  24.590 -62.266
  280    HA   ALA  34           HA       ALA  34 -18.947  23.116 -62.096
  281   1HB   ALA  34          1HB       ALA  34 -20.001  21.279 -61.389
  282   2HB   ALA  34          2HB       ALA  34 -21.278  21.454 -62.590
  283   3HB   ALA  34          3HB       ALA  34 -21.378  22.331 -61.062
  284    H    ILE  35           H        ILE  35 -20.387  24.973 -64.120
  285    HA   ILE  35           HA       ILE  35 -20.595  23.407 -66.491
  286    HB   ILE  35           HB       ILE  35 -21.669  25.595 -66.327
  287   1HG1  ILE  35          2HG1      ILE  35 -20.301  26.616 -68.445
  288   2HG1  ILE  35          1HG1      ILE  35 -19.749  24.943 -68.467
  289   1HG2  ILE  35          1HG2      ILE  35 -19.519  26.467 -65.027
  290   2HG2  ILE  35          2HG2      ILE  35 -20.643  27.554 -65.848
  291   3HG2  ILE  35          3HG2      ILE  35 -19.134  27.089 -66.636
  292   1HD1  ILE  35          1HD1      ILE  35 -22.193  24.291 -68.379
  293   2HD1  ILE  35          2HD1      ILE  35 -21.617  25.021 -69.879
  294   3HD1  ILE  35          3HD1      ILE  35 -22.548  25.982 -68.730
  295    H    ALA  36           H        ALA  36 -18.047  25.120 -64.844
  296    HA   ALA  36           HA       ALA  36 -15.992  23.491 -65.852
  297   1HB   ALA  36          1HB       ALA  36 -14.891  25.804 -66.844
  298   2HB   ALA  36          2HB       ALA  36 -16.562  25.910 -67.400
  299   3HB   ALA  36          3HB       ALA  36 -15.581  24.504 -67.817
  300    H    ARG  37           H        ARG  37 -16.541  26.868 -64.884
  301    HA   ARG  37           HA       ARG  37 -14.807  26.397 -62.547
  302   1HB   ARG  37          2HB       ARG  37 -15.091  29.000 -64.062
  303   2HB   ARG  37          1HB       ARG  37 -14.037  28.701 -62.688
  304   1HG   ARG  37          2HG       ARG  37 -13.802  27.350 -65.371
  305   2HG   ARG  37          1HG       ARG  37 -12.838  28.727 -64.836
  306   1HD   ARG  37          2HD       ARG  37 -11.900  27.416 -63.034
  307   2HD   ARG  37          1HD       ARG  37 -12.942  26.055 -63.444
  308    HE   ARG  37           HE       ARG  37 -11.695  26.078 -65.648
  309   1HH1  ARG  37          1HH1      ARG  37 -10.275  27.155 -62.631
  310   2HH1  ARG  37          2HH1      ARG  37  -8.655  26.715 -63.088
  311   1HH2  ARG  37          1HH2      ARG  37  -9.577  25.481 -66.248
  312   2HH2  ARG  37          2HH2      ARG  37  -8.251  25.771 -65.161
  313    H    GLY  38           H        GLY  38 -15.277  27.908 -60.734
  314   1HA   GLY  38          2HA       GLY  38 -17.168  29.511 -60.031
  315   2HA   GLY  38          1HA       GLY  38 -18.199  28.155 -60.473
  316    H    GLY  39           H        GLY  39 -16.162  26.239 -59.532
  317   1HA   GLY  39          2HA       GLY  39 -16.322  26.709 -56.623
  318   2HA   GLY  39          1HA       GLY  39 -16.667  25.135 -57.332
  319    H    ARG  40           H        ARG  40 -14.877  24.767 -55.613
  320    HA   ARG  40           HA       ARG  40 -12.785  24.024 -55.181
  321   1HB   ARG  40          2HB       ARG  40 -12.261  24.180 -58.147
  322   2HB   ARG  40          1HB       ARG  40 -11.478  23.133 -56.970
  323   1HG   ARG  40          2HG       ARG  40 -13.398  21.789 -56.736
  324   2HG   ARG  40          1HG       ARG  40 -14.415  22.966 -57.570
  325   1HD   ARG  40          2HD       ARG  40 -14.017  21.242 -59.126
  326   2HD   ARG  40          1HD       ARG  40 -12.963  22.573 -59.604
  327    HE   ARG  40           HE       ARG  40 -11.574  20.843 -57.868
  328   1HH1  ARG  40          1HH1      ARG  40 -12.804  21.005 -61.140
  329   2HH1  ARG  40          2HH1      ARG  40 -11.625  19.900 -61.778
  330   1HH2  ARG  40          1HH2      ARG  40 -10.017  19.394 -58.691
  331   2HH2  ARG  40          2HH2      ARG  40 -10.056  18.962 -60.377
  332    H    ASN  41           H        ASN  41 -11.236  25.439 -57.900
  333    HA   ASN  41           HA       ASN  41  -9.802  27.256 -56.172
  334   1HB   ASN  41          2HB       ASN  41  -8.872  25.853 -58.189
  335   2HB   ASN  41          1HB       ASN  41  -9.451  27.210 -59.149
  336   1HD2  ASN  41          1HD2      ASN  41  -8.699  29.381 -58.410
  337   2HD2  ASN  41          2HD2      ASN  41  -7.072  29.510 -57.829
  338    H    ARG  42           H        ARG  42 -11.990  28.270 -55.783
  339    HA   ARG  42           HA       ARG  42 -12.070  30.760 -57.229
  340   1HB   ARG  42          2HB       ARG  42 -13.711  28.803 -58.196
  341   2HB   ARG  42          1HB       ARG  42 -14.756  29.594 -57.036
  342   1HG   ARG  42          2HG       ARG  42 -14.795  30.425 -59.457
  343   2HG   ARG  42          1HG       ARG  42 -14.734  31.611 -58.151
  344   1HD   ARG  42          2HD       ARG  42 -12.128  30.691 -59.199
  345   2HD   ARG  42          1HD       ARG  42 -13.105  31.665 -60.298
  346    HE   ARG  42           HE       ARG  42 -11.752  32.547 -57.916
  347   1HH1  ARG  42          1HH1      ARG  42 -14.315  33.224 -60.205
  348   2HH1  ARG  42          2HH1      ARG  42 -14.479  34.892 -59.730
  349   1HH2  ARG  42          1HH2      ARG  42 -11.948  34.741 -57.290
  350   2HH2  ARG  42          2HH2      ARG  42 -13.140  35.751 -58.063
  351    HA   PRO  43           HA       PRO  43 -14.898  31.072 -53.372
  352   1HB   PRO  43          2HB       PRO  43 -14.985  28.404 -52.155
  353   2HB   PRO  43          1HB       PRO  43 -16.318  29.480 -52.586
  354   1HG   PRO  43          2HG       PRO  43 -15.829  27.210 -53.944
  355   2HG   PRO  43          1HG       PRO  43 -16.453  28.669 -54.741
  356   1HD   PRO  43          2HD       PRO  43 -13.642  27.618 -54.647
  357   2HD   PRO  43          1HD       PRO  43 -14.549  28.278 -56.032
  358    H    ALA  44           H        ALA  44 -11.991  29.435 -53.597
  359    HA   ALA  44           HA       ALA  44 -11.182  29.511 -50.853
  360   1HB   ALA  44          1HB       ALA  44  -9.197  28.596 -51.561
  361   2HB   ALA  44          2HB       ALA  44  -9.203  29.491 -53.082
  362   3HB   ALA  44          3HB       ALA  44 -10.262  28.095 -52.877
  363    HA   PRO  45           HA       PRO  45 -10.308  33.811 -50.340
  364   1HB   PRO  45          2HB       PRO  45  -7.866  32.791 -48.958
  365   2HB   PRO  45          1HB       PRO  45  -9.063  33.968 -48.404
  366   1HG   PRO  45          2HG       PRO  45  -9.088  31.490 -47.458
  367   2HG   PRO  45          1HG       PRO  45 -10.606  32.326 -47.836
  368   1HD   PRO  45          2HD       PRO  45  -9.195  30.176 -49.350
  369   2HD   PRO  45          1HD       PRO  45 -10.936  30.458 -49.144
  370    H    TYR  46           H        TYR  46  -7.253  31.998 -50.759
  371    HA   TYR  46           HA       TYR  46  -6.621  33.797 -52.993
  372   1HB   TYR  46          2HB       TYR  46  -5.349  33.981 -50.597
  373   2HB   TYR  46          1HB       TYR  46  -4.315  32.822 -51.427
  374    HD1  TYR  46           1HD      TYR  46  -2.380  34.117 -51.795
  375    HD2  TYR  46           2HD      TYR  46  -6.178  35.635 -52.968
  376    HE1  TYR  46           1HE      TYR  46  -1.269  35.957 -52.986
  377    HE2  TYR  46           2HE      TYR  46  -5.077  37.480 -54.163
  378    HH   TYR  46           HH       TYR  46  -2.191  38.534 -53.681
  379    H    SER  47           H        SER  47  -4.789  31.113 -51.563
  380    HA   SER  47           HA       SER  47  -4.861  29.825 -54.204
  381   1HB   SER  47          2HB       SER  47  -2.918  28.880 -52.183
  382   2HB   SER  47          1HB       SER  47  -2.694  29.199 -53.903
  383    HG   SER  47           HG       SER  47  -2.696  31.449 -53.398
  384    H    ARG  48           H        ARG  48  -5.155  29.180 -50.731
  385    HA   ARG  48           HA       ARG  48  -6.868  26.911 -51.321
  386   1HB   ARG  48          2HB       ARG  48  -5.610  25.303 -50.053
  387   2HB   ARG  48          1HB       ARG  48  -4.548  25.987 -51.273
  388   1HG   ARG  48          2HG       ARG  48  -4.502  27.305 -48.635
  389   2HG   ARG  48          1HG       ARG  48  -3.857  25.665 -48.702
  390   1HD   ARG  48          2HD       ARG  48  -2.303  26.292 -50.429
  391   2HD   ARG  48          1HD       ARG  48  -3.020  27.898 -50.545
  392    HE   ARG  48           HE       ARG  48  -2.117  28.395 -48.370
  393   1HH1  ARG  48          1HH1      ARG  48  -0.905  25.484 -49.909
  394   2HH1  ARG  48          2HH1      ARG  48   0.529  25.411 -48.925
  395   1HH2  ARG  48          1HH2      ARG  48  -0.233  28.295 -47.071
  396   2HH2  ARG  48          2HH2      ARG  48   0.903  26.998 -47.302
  397    HA   PRO  49           HA       PRO  49  -8.773  28.487 -47.613
  398   1HB   PRO  49          2HB       PRO  49 -10.523  26.452 -47.205
  399   2HB   PRO  49          1HB       PRO  49 -10.765  27.688 -48.446
  400   1HG   PRO  49          2HG       PRO  49  -9.722  24.901 -48.723
  401   2HG   PRO  49          1HG       PRO  49 -10.827  25.797 -49.782
  402   1HD   PRO  49          2HD       PRO  49  -8.173  25.471 -50.313
  403   2HD   PRO  49          1HD       PRO  49  -9.115  26.869 -50.866
  404    H    LYS  50           H        LYS  50  -8.122  28.354 -45.566
  405    HA   LYS  50           HA       LYS  50  -6.575  25.982 -44.800
  406   1HB   LYS  50          2HB       LYS  50  -6.472  28.866 -43.994
  407   2HB   LYS  50          1HB       LYS  50  -5.771  27.622 -42.967
  408   1HG   LYS  50          2HG       LYS  50  -4.846  27.153 -45.591
  409   2HG   LYS  50          1HG       LYS  50  -4.675  28.880 -45.275
  410   1HD   LYS  50          2HD       LYS  50  -3.689  26.711 -43.426
  411   2HD   LYS  50          1HD       LYS  50  -2.683  27.523 -44.627
  412   1HE   LYS  50          2HE       LYS  50  -3.608  29.685 -43.419
  413   2HE   LYS  50          1HE       LYS  50  -3.821  28.560 -42.078
  414   1HZ   LYS  50          1HZ       LYS  50  -1.598  29.850 -42.378
  415   2HZ   LYS  50          2HZ       LYS  50  -1.245  28.625 -43.492
  416   3HZ   LYS  50          3HZ       LYS  50  -1.579  28.230 -41.874
  417    HA   PRO  51           HA       PRO  51  -9.591  25.424 -41.514
  418   1HB   PRO  51          2HB       PRO  51  -9.244  22.786 -41.243
  419   2HB   PRO  51          1HB       PRO  51 -10.208  23.447 -42.569
  420   1HG   PRO  51          2HG       PRO  51  -7.455  22.327 -42.596
  421   2HG   PRO  51          1HG       PRO  51  -8.702  22.278 -43.853
  422   1HD   PRO  51          2HD       PRO  51  -6.514  24.047 -43.722
  423   2HD   PRO  51          1HD       PRO  51  -7.917  24.183 -44.799
  424    H    LEU  52           H        LEU  52  -6.316  25.285 -41.821
  425    HA   LEU  52           HA       LEU  52  -4.546  25.413 -40.433
  426   1HB   LEU  52          2HB       LEU  52  -6.775  25.796 -38.480
  427   2HB   LEU  52          1HB       LEU  52  -5.137  25.581 -37.893
  428    HG   LEU  52           HG       LEU  52  -4.707  27.509 -39.721
  429   1HD1  LEU  52          1HD1      LEU  52  -6.499  28.669 -40.318
  430   2HD1  LEU  52          2HD1      LEU  52  -7.045  28.800 -38.646
  431   3HD1  LEU  52          3HD1      LEU  52  -7.487  27.392 -39.611
  432   1HD2  LEU  52          1HD2      LEU  52  -5.367  29.010 -37.542
  433   2HD2  LEU  52          2HD2      LEU  52  -3.846  28.140 -37.749
  434   3HD2  LEU  52          3HD2      LEU  52  -5.164  27.410 -36.830
  435    HA   PRO  53           HA       PRO  53  -4.401  20.928 -40.015
  436   1HB   PRO  53          2HB       PRO  53  -1.640  20.883 -39.978
  437   2HB   PRO  53          1HB       PRO  53  -2.627  20.838 -41.442
  438   1HG   PRO  53          2HG       PRO  53  -1.225  23.146 -40.167
  439   2HG   PRO  53          1HG       PRO  53  -1.405  22.751 -41.886
  440   1HD   PRO  53          2HD       PRO  53  -2.890  24.655 -40.700
  441   2HD   PRO  53          1HD       PRO  53  -3.543  23.624 -41.993
  442    H    ASP  54           H        ASP  54  -1.990  22.927 -38.315
  443    HA   ASP  54           HA       ASP  54  -2.120  21.177 -36.007
  444   1HB   ASP  54          2HB       ASP  54  -0.344  22.783 -35.121
  445   2HB   ASP  54          1HB       ASP  54   0.088  21.818 -36.525
  446    H    LYS  55           H        LYS  55  -4.499  22.007 -36.039
  447    HA   LYS  55           HA       LYS  55  -4.926  24.554 -34.772
  448   1HB   LYS  55          2HB       LYS  55  -6.548  22.484 -35.986
  449   2HB   LYS  55          1HB       LYS  55  -7.242  23.025 -34.465
  450   1HG   LYS  55          2HG       LYS  55  -6.364  25.266 -36.042
  451   2HG   LYS  55          1HG       LYS  55  -7.474  24.240 -36.954
  452   1HD   LYS  55          2HD       LYS  55  -8.144  24.958 -34.141
  453   2HD   LYS  55          1HD       LYS  55  -8.377  26.161 -35.411
  454   1HE   LYS  55          2HE       LYS  55  -9.675  23.471 -35.109
  455   2HE   LYS  55          1HE       LYS  55 -10.439  25.054 -35.232
  456   1HZ   LYS  55          1HZ       LYS  55 -10.658  23.796 -37.282
  457   2HZ   LYS  55          2HZ       LYS  55  -8.977  23.662 -37.416
  458   3HZ   LYS  55          3HZ       LYS  55  -9.719  25.185 -37.537
  459    H    TRP  56           H        TRP  56  -4.578  24.913 -32.711
  460    HA   TRP  56           HA       TRP  56  -4.107  22.880 -30.806
  461   1HB   TRP  56          2HB       TRP  56  -3.072  24.656 -29.910
  462   2HB   TRP  56          1HB       TRP  56  -3.947  25.760 -30.959
  463    HD1  TRP  56           HD       TRP  56  -5.982  27.085 -29.913
  464    HE1  TRP  56           1HE      TRP  56  -6.795  27.418 -27.487
  465    HE3  TRP  56           3HE      TRP  56  -3.278  23.393 -27.637
  466    HZ2  TRP  56           2HZ      TRP  56  -6.347  26.260 -24.958
  467    HZ3  TRP  56           3HZ      TRP  56  -3.528  23.071 -25.214
  468    HH2  TRP  56           HH       TRP  56  -5.031  24.476 -23.903
  469    H    GLN  57           H        GLN  57  -5.370  22.139 -29.100
  470    HA   GLN  57           HA       GLN  57  -8.252  22.679 -29.402
  471   1HB   GLN  57          2HB       GLN  57  -7.265  20.350 -29.998
  472   2HB   GLN  57          1HB       GLN  57  -7.149  20.130 -28.258
  473   1HG   GLN  57          2HG       GLN  57  -9.250  19.457 -28.250
  474   2HG   GLN  57          1HG       GLN  57  -9.738  21.076 -28.741
  475   1HE2  GLN  57          1HE2      GLN  57 -11.286  19.018 -29.470
  476   2HE2  GLN  57          2HE2      GLN  57 -11.133  18.699 -31.168
  477    H    HIS  58           H        HIS  58  -6.748  20.768 -26.894
  478    HA   HIS  58           HA       HIS  58  -6.547  22.603 -24.824
  479   1HB   HIS  58          2HB       HIS  58  -9.210  22.369 -25.469
  480   2HB   HIS  58          1HB       HIS  58  -9.039  21.149 -24.210
  481    HD1  HIS  58           1HD      HIS  58  -9.951  22.180 -22.153
  482    HD2  HIS  58           2HD      HIS  58  -7.523  24.810 -24.271
  483    HE1  HIS  58           1HE      HIS  58  -9.757  24.236 -20.715
  484    HE2  HIS  58           2HE      HIS  58  -8.100  25.708 -21.915
  485    H    ASP  59           H        ASP  59  -6.805  21.355 -22.609
  486    HA   ASP  59           HA       ASP  59  -5.279  18.949 -22.806
  487   1HB   ASP  59          2HB       ASP  59  -6.673  19.480 -20.255
  488   2HB   ASP  59          1HB       ASP  59  -4.973  19.152 -20.559
  489    H    LEU  60           H        LEU  60  -8.612  19.741 -22.617
  490    HA   LEU  60           HA       LEU  60 -10.470  18.558 -23.062
  491   1HB   LEU  60          2HB       LEU  60  -8.792  16.084 -23.374
  492   2HB   LEU  60          1HB       LEU  60 -10.409  16.362 -23.978
  493    HG   LEU  60           HG       LEU  60  -8.389  18.261 -24.961
  494   1HD1  LEU  60          1HD1      LEU  60  -8.326  15.688 -26.387
  495   2HD1  LEU  60          2HD1      LEU  60  -7.480  15.726 -24.840
  496   3HD1  LEU  60          3HD1      LEU  60  -7.044  16.869 -26.110
  497   1HD2  LEU  60          1HD2      LEU  60 -10.848  17.988 -25.630
  498   2HD2  LEU  60          2HD2      LEU  60 -10.304  16.575 -26.535
  499   3HD2  LEU  60          3HD2      LEU  60  -9.657  18.171 -26.919
  500    H    PHE  61           H        PHE  61 -11.190  15.999 -22.348
  501    HA   PHE  61           HA       PHE  61 -12.334  14.992 -20.730
  502   1HB   PHE  61          2HB       PHE  61  -9.860  14.741 -20.037
  503   2HB   PHE  61          1HB       PHE  61 -10.279  15.873 -18.763
  504    HD1  PHE  61           1HD      PHE  61 -12.017  15.244 -17.083
  505    HD2  PHE  61           2HD      PHE  61 -10.516  12.475 -19.944
  506    HE1  PHE  61           1HE      PHE  61 -12.898  13.383 -15.738
  507    HE2  PHE  61           2HE      PHE  61 -11.396  10.609 -18.604
  508    HZ   PHE  61           HZ       PHE  61 -12.589  11.062 -16.499
  509    H    ASP  62           H        ASP  62 -10.977  18.032 -19.646
  510    HA   ASP  62           HA       ASP  62 -13.169  19.584 -19.384
  511   1HB   ASP  62          2HB       ASP  62 -13.617  17.578 -17.555
  512   2HB   ASP  62          1HB       ASP  62 -12.864  18.819 -16.557
  513    H    SER  63           H        SER  63 -12.861  21.323 -17.536
  514    HA   SER  63           HA       SER  63  -9.997  21.949 -17.480
  515   1HB   SER  63          2HB       SER  63 -12.015  23.939 -16.576
  516   2HB   SER  63          1HB       SER  63 -10.560  24.170 -17.545
  517    HG   SER  63           HG       SER  63 -13.088  23.180 -18.374
  518    H    GLY  64           H        GLY  64  -9.865  20.241 -15.772
  519   1HA   GLY  64          2HA       GLY  64  -9.148  20.549 -13.396
  520   2HA   GLY  64          1HA       GLY  64 -10.733  21.268 -13.138
  521    H    CYS  65           H        CYS  65 -12.406  19.649 -14.435
  522    HA   CYS  65           HA       CYS  65 -13.568  17.707 -14.403
  523   1HB   CYS  65          2HB       CYS  65 -11.188  16.056 -13.745
  524   2HB   CYS  65          1HB       CYS  65 -12.468  15.769 -14.919
  525    HG   CYS  65           HG       CYS  65  -9.785  17.860 -15.307
  526    H    GLY  66           H        GLY  66 -12.793  19.147 -11.840
  527   1HA   GLY  66          2HA       GLY  66 -13.794  18.736  -9.725
  528   2HA   GLY  66          1HA       GLY  66 -13.718  17.013 -10.069
  529    H    GLY  67           H        GLY  67 -11.878  15.860  -9.610
  530   1HA   GLY  67          2HA       GLY  67  -9.324  16.650  -9.203
  531   2HA   GLY  67          1HA       GLY  67 -10.099  17.081  -7.686
  532    H    GLY  68           H        GLY  68 -11.972  14.763  -7.981
  533   1HA   GLY  68          2HA       GLY  68 -11.184  12.291  -8.218
  534   2HA   GLY  68          1HA       GLY  68 -10.114  12.761  -6.904
  535    H    GLU  69           H        GLU  69 -12.722  11.050  -7.417
  536    HA   GLU  69           HA       GLU  69 -14.542  12.076  -5.448
  537   1HB   GLU  69          2HB       GLU  69 -14.433   9.352  -6.759
  538   2HB   GLU  69          1HB       GLU  69 -15.790  10.008  -5.854
  539   1HG   GLU  69          2HG       GLU  69 -15.477  11.937  -7.701
  540   2HG   GLU  69          1HG       GLU  69 -14.910  10.535  -8.609
  541    H    GLY  70           H        GLY  70 -14.115   8.706  -5.143
  542   1HA   GLY  70          2HA       GLY  70 -13.134   8.980  -2.425
  543   2HA   GLY  70          1HA       GLY  70 -13.625   7.487  -3.217
  544    H    VAL  71           H        VAL  71 -11.604   9.267  -5.152
  545    HA   VAL  71           HA       VAL  71  -9.075   8.495  -4.154
  546    HB   VAL  71           HB       VAL  71  -9.585   6.303  -4.919
  547   1HG1  VAL  71          1HG1      VAL  71 -10.824   5.720  -6.700
  548   2HG1  VAL  71          2HG1      VAL  71 -10.098   6.947  -7.737
  549   3HG1  VAL  71          3HG1      VAL  71 -11.377   7.391  -6.608
  550   1HG2  VAL  71          1HG2      VAL  71  -7.993   6.015  -6.846
  551   2HG2  VAL  71          2HG2      VAL  71  -7.354   6.883  -5.450
  552   3HG2  VAL  71          3HG2      VAL  71  -7.857   7.773  -6.887
  553    H    GLU  72           H        GLU  72  -8.489  10.528  -4.475
  554    HA   GLU  72           HA       GLU  72  -9.019  12.174  -6.610
  555   1HB   GLU  72          2HB       GLU  72  -6.577  13.078  -5.954
  556   2HB   GLU  72          1HB       GLU  72  -8.007  13.389  -4.980
  557   1HG   GLU  72          2HG       GLU  72  -6.517  10.905  -4.416
  558   2HG   GLU  72          1HG       GLU  72  -5.742  12.424  -3.972
  559    H    THR  73           H        THR  73  -6.013  10.332  -6.162
  560    HA   THR  73           HA       THR  73  -6.085   9.350  -8.837
  561    HB   THR  73           HB       THR  73  -3.514  10.467  -8.852
  562    HG1  THR  73           1HG      THR  73  -5.439  12.523  -8.400
  563   1HG2  THR  73          1HG2      THR  73  -5.428  10.032 -10.644
  564   2HG2  THR  73          2HG2      THR  73  -4.104  11.158 -10.945
  565   3HG2  THR  73          3HG2      THR  73  -5.676  11.765 -10.423
  566    H    GLY  74           H        GLY  74  -4.669   7.631  -9.127
  567   1HA   GLY  74          2HA       GLY  74  -3.903   6.157  -6.906
  568   2HA   GLY  74          1HA       GLY  74  -3.272   5.917  -8.528
  569    H    ALA  75           H        ALA  75  -2.280   6.207  -5.540
  570    HA   ALA  75           HA       ALA  75   0.060   7.872  -6.187
  571   1HB   ALA  75          1HB       ALA  75  -0.710   7.089  -3.397
  572   2HB   ALA  75          2HB       ALA  75  -1.512   8.442  -4.198
  573   3HB   ALA  75          3HB       ALA  75   0.235   8.475  -3.945
  574    H    LYS  76           H        LYS  76   1.642   6.589  -6.889
  575    HA   LYS  76           HA       LYS  76   1.925   3.899  -5.752
  576   1HB   LYS  76          2HB       LYS  76   1.705   4.029  -8.175
  577   2HB   LYS  76          1HB       LYS  76   3.061   5.143  -8.264
  578   1HG   LYS  76          2HG       LYS  76   4.617   3.488  -7.828
  579   2HG   LYS  76          1HG       LYS  76   3.421   2.417  -7.095
  580   1HD   LYS  76          2HD       LYS  76   2.412   2.009  -9.258
  581   2HD   LYS  76          1HD       LYS  76   3.511   3.163 -10.016
  582   1HE   LYS  76          2HE       LYS  76   4.732   1.330 -10.471
  583   2HE   LYS  76          1HE       LYS  76   5.277   1.516  -8.804
  584   1HZ   LYS  76          1HZ       LYS  76   3.473  -0.005  -8.139
  585   2HZ   LYS  76          2HZ       LYS  76   4.615  -0.737  -9.159
  586   3HZ   LYS  76          3HZ       LYS  76   3.104  -0.265  -9.779
  587    H    LEU  77           H        LEU  77   3.446   3.485  -4.357
  588    HA   LEU  77           HA       LEU  77   5.740   5.313  -4.114
  589   1HB   LEU  77          2HB       LEU  77   4.352   5.224  -2.147
  590   2HB   LEU  77          1HB       LEU  77   4.362   3.478  -2.154
  591    HG   LEU  77           HG       LEU  77   5.759   4.734  -0.402
  592   1HD1  LEU  77          1HD1      LEU  77   7.524   3.005  -0.488
  593   2HD1  LEU  77          2HD1      LEU  77   6.873   2.495  -2.046
  594   3HD1  LEU  77          3HD1      LEU  77   5.875   2.391  -0.595
  595   1HD2  LEU  77          1HD2      LEU  77   7.589   4.973  -2.787
  596   2HD2  LEU  77          2HD2      LEU  77   8.079   5.205  -1.109
  597   3HD2  LEU  77          3HD2      LEU  77   6.902   6.295  -1.843
  598    H    LEU  78           H        LEU  78   7.580   4.567  -4.914
  599    HA   LEU  78           HA       LEU  78   8.027   1.664  -5.069
  600   1HB   LEU  78          2HB       LEU  78   9.346   3.977  -6.500
  601   2HB   LEU  78          1HB       LEU  78   9.897   2.320  -6.626
  602    HG   LEU  78           HG       LEU  78   8.649   2.549  -8.548
  603   1HD1  LEU  78          1HD1      LEU  78   7.835   0.597  -7.459
  604   2HD1  LEU  78          2HD1      LEU  78   6.453   1.420  -8.179
  605   3HD1  LEU  78          3HD1      LEU  78   6.746   1.546  -6.446
  606   1HD2  LEU  78          1HD2      LEU  78   6.815   4.293  -6.936
  607   2HD2  LEU  78          2HD2      LEU  78   6.384   3.689  -8.537
  608   3HD2  LEU  78          3HD2      LEU  78   7.798   4.723  -8.337
  609    H    VAL  79           H        VAL  79   8.974   1.006  -3.199
  610    HA   VAL  79           HA       VAL  79  11.213   2.596  -2.158
  611    HB   VAL  79           HB       VAL  79  10.986   0.661  -0.318
  612   1HG1  VAL  79          1HG1      VAL  79   9.538   3.268  -0.559
  613   2HG1  VAL  79          2HG1      VAL  79  10.964   2.867   0.399
  614   3HG1  VAL  79          3HG1      VAL  79   9.380   2.258   0.878
  615   1HG2  VAL  79          1HG2      VAL  79   8.113   1.101  -0.822
  616   2HG2  VAL  79          2HG2      VAL  79   8.943  -0.274  -0.094
  617   3HG2  VAL  79          3HG2      VAL  79   8.946  -0.067  -1.845
  618    H    SER  80           H        SER  80  13.195   1.999  -2.747
  619    HA   SER  80           HA       SER  80  13.788  -0.881  -2.520
  620   1HB   SER  80          2HB       SER  80  15.640   0.771  -4.143
  621   2HB   SER  80          1HB       SER  80  15.099  -0.890  -4.391
  622    HG   SER  80           HG       SER  80  13.045   0.841  -4.677
  623    H    ASN  81           H        ASN  81  14.612  -1.006  -0.515
  624    HA   ASN  81           HA       ASN  81  16.899   0.732   0.094
  625   1HB   ASN  81          2HB       ASN  81  16.151   1.214   2.298
  626   2HB   ASN  81          1HB       ASN  81  14.796   1.552   1.231
  627   1HD2  ASN  81          1HD2      ASN  81  15.205   0.670   4.146
  628   2HD2  ASN  81          2HD2      ASN  81  14.050  -0.600   4.336
  629    H    LEU  82           H        LEU  82  15.199  -2.270   0.658
  630    HA   LEU  82           HA       LEU  82  15.900  -4.356   1.182
  631   1HB   LEU  82          2HB       LEU  82  18.096  -3.325  -0.078
  632   2HB   LEU  82          1HB       LEU  82  18.761  -3.774   1.481
  633    HG   LEU  82           HG       LEU  82  17.117  -5.760  -0.037
  634   1HD1  LEU  82          1HD1      LEU  82  19.813  -6.272  -0.606
  635   2HD1  LEU  82          2HD1      LEU  82  19.538  -4.575  -1.002
  636   3HD1  LEU  82          3HD1      LEU  82  18.534  -5.825  -1.737
  637   1HD2  LEU  82          1HD2      LEU  82  18.002  -6.014   2.368
  638   2HD2  LEU  82          2HD2      LEU  82  19.577  -6.242   1.605
  639   3HD2  LEU  82          3HD2      LEU  82  18.250  -7.344   1.237
  640    H    ASP  83           H        ASP  83  18.068  -2.090   2.857
  641    HA   ASP  83           HA       ASP  83  18.477  -1.665   5.037
  642   1HB   ASP  83          2HB       ASP  83  16.482  -1.371   6.021
  643   2HB   ASP  83          1HB       ASP  83  15.745  -2.653   5.072
  644    H    PHE  84           H        PHE  84  17.251  -4.989   4.959
  645    HA   PHE  84           HA       PHE  84  19.625  -6.365   5.305
  646   1HB   PHE  84          2HB       PHE  84  18.780  -5.037   7.730
  647   2HB   PHE  84          1HB       PHE  84  18.680  -6.782   7.940
  648    HD1  PHE  84           1HD      PHE  84  20.560  -4.722   9.283
  649    HD2  PHE  84           2HD      PHE  84  21.013  -7.373   5.987
  650    HE1  PHE  84           1HE      PHE  84  22.985  -4.803   9.686
  651    HE2  PHE  84           2HE      PHE  84  23.439  -7.459   6.384
  652    HZ   PHE  84           HZ       PHE  84  24.428  -6.173   8.236
  653    H    GLY  85           H        GLY  85  16.240  -6.001   6.120
  654   1HA   GLY  85          2HA       GLY  85  15.525  -8.369   4.745
  655   2HA   GLY  85          1HA       GLY  85  15.536  -8.676   6.476
  656    H    VAL  86           H        VAL  86  14.312  -6.221   4.181
  657    HA   VAL  86           HA       VAL  86  11.890  -5.993   5.809
  658    HB   VAL  86           HB       VAL  86  12.770  -4.468   3.344
  659   1HG1  VAL  86          1HG1      VAL  86  10.246  -4.807   3.703
  660   2HG1  VAL  86          2HG1      VAL  86  10.839  -3.165   3.454
  661   3HG1  VAL  86          3HG1      VAL  86  10.441  -3.722   5.079
  662   1HG2  VAL  86          1HG2      VAL  86  12.363  -3.246   6.033
  663   2HG2  VAL  86          2HG2      VAL  86  13.419  -2.742   4.714
  664   3HG2  VAL  86          3HG2      VAL  86  13.851  -4.134   5.706
  665    H    SER  87           H        SER  87  10.484  -7.634   5.450
  666    HA   SER  87           HA       SER  87  10.203  -8.782   2.826
  667   1HB   SER  87          2HB       SER  87   8.258  -9.554   4.884
  668   2HB   SER  87          1HB       SER  87   9.362 -10.556   3.940
  669    HG   SER  87           HG       SER  87   9.866  -9.132   6.342
  670    H    ASP  88           H        ASP  88   7.699  -9.415   2.452
  671    HA   ASP  88           HA       ASP  88   6.514  -7.123   1.342
  672   1HB   ASP  88          2HB       ASP  88   6.181  -9.592   0.713
  673   2HB   ASP  88          1HB       ASP  88   5.005  -9.642   2.021
  674    H    ALA  89           H        ALA  89   5.579  -9.027   4.194
  675    HA   ALA  89           HA       ALA  89   3.443  -7.352   4.962
  676   1HB   ALA  89          1HB       ALA  89   4.301  -9.786   5.753
  677   2HB   ALA  89          2HB       ALA  89   3.138  -8.809   6.650
  678   3HB   ALA  89          3HB       ALA  89   4.841  -8.796   7.110
  679    H    ASP  90           H        ASP  90   6.879  -7.189   5.501
  680    HA   ASP  90           HA       ASP  90   6.944  -5.521   7.757
  681   1HB   ASP  90          2HB       ASP  90   8.842  -6.177   5.556
  682   2HB   ASP  90          1HB       ASP  90   9.188  -4.753   6.528
  683    H    ILE  91           H        ILE  91   7.646  -4.528   4.410
  684    HA   ILE  91           HA       ILE  91   7.437  -1.808   4.818
  685    HB   ILE  91           HB       ILE  91   8.380  -2.907   2.790
  686   1HG1  ILE  91          2HG1      ILE  91   7.517  -1.138   1.191
  687   2HG1  ILE  91          1HG1      ILE  91   6.394  -0.659   2.460
  688   1HG2  ILE  91          1HG2      ILE  91   6.557  -3.107   0.909
  689   2HG2  ILE  91          2HG2      ILE  91   5.500  -3.445   2.281
  690   3HG2  ILE  91          3HG2      ILE  91   6.911  -4.461   1.984
  691   1HD1  ILE  91          1HD1      ILE  91   9.005   0.233   2.074
  692   2HD1  ILE  91          2HD1      ILE  91   9.067  -0.810   3.495
  693   3HD1  ILE  91          3HD1      ILE  91   7.951   0.556   3.453
  694    H    GLN  92           H        GLN  92   4.843  -4.102   4.210
  695    HA   GLN  92           HA       GLN  92   2.858  -2.125   3.670
  696   1HB   GLN  92          2HB       GLN  92   2.800  -4.656   3.127
  697   2HB   GLN  92          1HB       GLN  92   2.240  -4.846   4.783
  698   1HG   GLN  92          2HG       GLN  92   0.459  -3.104   4.168
  699   2HG   GLN  92          1HG       GLN  92   0.901  -3.455   2.497
  700   1HE2  GLN  92          1HE2      GLN  92   0.620  -5.607   1.722
  701   2HE2  GLN  92          2HE2      GLN  92  -0.574  -6.637   2.438
  702    H    GLU  93           H        GLU  93   3.724  -4.020   6.532
  703    HA   GLU  93           HA       GLU  93   1.860  -2.927   8.312
  704   1HB   GLU  93          2HB       GLU  93   3.630  -4.899   8.502
  705   2HB   GLU  93          1HB       GLU  93   4.595  -3.643   9.265
  706   1HG   GLU  93          2HG       GLU  93   2.481  -3.261  10.713
  707   2HG   GLU  93          1HG       GLU  93   2.043  -4.882  10.174
  708    H    LEU  94           H        LEU  94   5.076  -1.882   7.355
  709    HA   LEU  94           HA       LEU  94   5.410   0.194   9.217
  710   1HB   LEU  94          2HB       LEU  94   7.105  -0.881   7.603
  711   2HB   LEU  94          1HB       LEU  94   6.495   0.254   6.414
  712    HG   LEU  94           HG       LEU  94   7.211   1.592   8.885
  713   1HD1  LEU  94          1HD1      LEU  94   9.643   1.295   8.650
  714   2HD1  LEU  94          2HD1      LEU  94   9.355   0.024   7.463
  715   3HD1  LEU  94          3HD1      LEU  94   8.824  -0.191   9.132
  716   1HD2  LEU  94          1HD2      LEU  94   8.578   1.985   6.268
  717   2HD2  LEU  94          2HD2      LEU  94   8.049   3.177   7.454
  718   3HD2  LEU  94          3HD2      LEU  94   6.867   2.389   6.410
  719    H    PHE  95           H        PHE  95   4.738   0.614   5.753
  720    HA   PHE  95           HA       PHE  95   3.816   3.196   5.886
  721   1HB   PHE  95          2HB       PHE  95   3.708   1.044   3.939
  722   2HB   PHE  95          1HB       PHE  95   2.355   2.163   3.798
  723    HD1  PHE  95           1HD      PHE  95   2.898   4.651   3.672
  724    HD2  PHE  95           2HD      PHE  95   5.776   1.584   3.048
  725    HE1  PHE  95           1HE      PHE  95   4.343   6.251   2.489
  726    HE2  PHE  95           2HE      PHE  95   7.228   3.178   1.867
  727    HZ   PHE  95           HZ       PHE  95   6.489   5.500   1.545
  728    H    ALA  96           H        ALA  96   2.008   0.354   6.825
  729    HA   ALA  96           HA       ALA  96  -0.532   1.677   6.890
  730   1HB   ALA  96          1HB       ALA  96   0.247  -0.606   8.685
  731   2HB   ALA  96          2HB       ALA  96  -0.092  -0.846   6.970
  732   3HB   ALA  96          3HB       ALA  96  -1.344  -0.207   8.036
  733    H    GLU  97           H        GLU  97   1.910   0.972   9.306
  734    HA   GLU  97           HA       GLU  97   0.973   2.561  11.409
  735   1HB   GLU  97          2HB       GLU  97   3.400   1.252  10.787
  736   2HB   GLU  97          1HB       GLU  97   3.820   2.917  11.174
  737   1HG   GLU  97          2HG       GLU  97   3.152   2.732  13.346
  738   2HG   GLU  97          1HG       GLU  97   1.959   1.483  12.989
  739    H    PHE  98           H        PHE  98   2.831   3.445   8.558
  740    HA   PHE  98           HA       PHE  98   3.038   6.198   8.945
  741   1HB   PHE  98          2HB       PHE  98   3.736   4.376   6.964
  742   2HB   PHE  98          1HB       PHE  98   2.653   5.503   6.156
  743    HD1  PHE  98           1HD      PHE  98   3.381   7.951   7.813
  744    HD2  PHE  98           2HD      PHE  98   5.752   4.976   5.892
  745    HE1  PHE  98           1HE      PHE  98   5.222   9.556   7.591
  746    HE2  PHE  98           2HE      PHE  98   7.597   6.585   5.671
  747    HZ   PHE  98           HZ       PHE  98   7.338   8.875   6.513
  748    H    GLY  99           H        GLY  99   0.178   4.660   8.900
  749   1HA   GLY  99          2HA       GLY  99  -1.741   6.205   9.002
  750   2HA   GLY  99          1HA       GLY  99  -1.142   6.917   7.519
  751    H    THR 100           H        THR 100  -1.604   5.901   5.524
  752    HA   THR 100           HA       THR 100  -3.825   3.990   5.770
  753    HB   THR 100           HB       THR 100  -4.378   5.643   3.567
  754    HG1  THR 100           1HG      THR 100  -3.228   7.381   4.202
  755   1HG2  THR 100          1HG2      THR 100  -6.150   6.511   5.338
  756   2HG2  THR 100          2HG2      THR 100  -5.525   5.147   6.266
  757   3HG2  THR 100          3HG2      THR 100  -6.231   4.881   4.671
  758    H    LEU 101           H        LEU 101  -2.941   2.187   4.868
  759    HA   LEU 101           HA       LEU 101  -1.673   2.491   2.239
  760   1HB   LEU 101          2HB       LEU 101  -0.494   1.337   4.238
  761   2HB   LEU 101          1HB       LEU 101  -1.551  -0.014   3.875
  762    HG   LEU 101           HG       LEU 101  -0.527  -0.444   1.830
  763   1HD1  LEU 101          1HD1      LEU 101  -0.417   1.415   0.553
  764   2HD1  LEU 101          2HD1      LEU 101   1.268   1.394   1.078
  765   3HD1  LEU 101          3HD1      LEU 101   0.102   2.438   1.892
  766   1HD2  LEU 101          1HD2      LEU 101   0.979  -1.044   3.594
  767   2HD2  LEU 101          2HD2      LEU 101   1.606   0.602   3.678
  768   3HD2  LEU 101          3HD2      LEU 101   1.921  -0.391   2.252
  769    H    LYS 102           H        LYS 102  -3.270   2.425   0.819
  770    HA   LYS 102           HA       LYS 102  -5.538   0.798   0.816
  771   1HB   LYS 102          2HB       LYS 102  -4.163   2.463  -1.118
  772   2HB   LYS 102          1HB       LYS 102  -4.813   1.019  -1.878
  773   1HG   LYS 102          2HG       LYS 102  -6.358   3.026  -0.253
  774   2HG   LYS 102          1HG       LYS 102  -6.399   2.838  -2.006
  775   1HD   LYS 102          2HD       LYS 102  -8.137   1.475  -1.680
  776   2HD   LYS 102          1HD       LYS 102  -6.966   0.302  -1.073
  777   1HE   LYS 102          2HE       LYS 102  -8.487   0.391   0.658
  778   2HE   LYS 102          1HE       LYS 102  -7.273   1.558   1.181
  779   1HZ   LYS 102          1HZ       LYS 102  -8.641   3.347   0.580
  780   2HZ   LYS 102          2HZ       LYS 102  -9.679   2.252   1.363
  781   3HZ   LYS 102          3HZ       LYS 102  -9.688   2.366  -0.330
  782    H    LYS 103           H        LYS 103  -2.509   0.224  -1.000
  783    HA   LYS 103           HA       LYS 103  -2.575  -2.546  -0.157
  784   1HB   LYS 103          2HB       LYS 103  -2.630  -3.540  -2.269
  785   2HB   LYS 103          1HB       LYS 103  -3.855  -2.287  -2.384
  786   1HG   LYS 103          2HG       LYS 103  -1.510  -1.053  -3.221
  787   2HG   LYS 103          1HG       LYS 103  -1.454  -2.667  -3.932
  788   1HD   LYS 103          2HD       LYS 103  -4.068  -1.890  -4.326
  789   2HD   LYS 103          1HD       LYS 103  -3.160  -0.397  -4.576
  790   1HE   LYS 103          2HE       LYS 103  -1.891  -1.333  -6.316
  791   2HE   LYS 103          1HE       LYS 103  -2.354  -2.979  -5.881
  792   1HZ   LYS 103          1HZ       LYS 103  -3.716  -1.069  -7.547
  793   2HZ   LYS 103          2HZ       LYS 103  -4.731  -1.804  -6.400
  794   3HZ   LYS 103          3HZ       LYS 103  -3.859  -2.760  -7.494
  795    H    ALA 104           H        ALA 104  -0.523  -3.632  -0.508
  796    HA   ALA 104           HA       ALA 104   1.668  -2.194  -1.662
  797   1HB   ALA 104          1HB       ALA 104   1.176  -1.747   1.108
  798   2HB   ALA 104          2HB       ALA 104   2.489  -1.128   0.102
  799   3HB   ALA 104          3HB       ALA 104   2.667  -2.674   0.938
  800    H    ALA 105           H        ALA 105   3.195  -3.534  -2.299
  801    HA   ALA 105           HA       ALA 105   3.444  -6.179  -1.068
  802   1HB   ALA 105          1HB       ALA 105   2.004  -5.875  -3.369
  803   2HB   ALA 105          2HB       ALA 105   2.840  -7.353  -2.885
  804   3HB   ALA 105          3HB       ALA 105   3.620  -6.217  -3.988
  805    H    VAL 106           H        VAL 106   5.490  -7.223  -1.673
  806    HA   VAL 106           HA       VAL 106   7.545  -5.264  -2.304
  807    HB   VAL 106           HB       VAL 106   7.477  -7.948  -1.000
  808   1HG1  VAL 106          1HG1      VAL 106   9.228  -8.431  -2.499
  809   2HG1  VAL 106          2HG1      VAL 106  10.007  -7.941  -0.995
  810   3HG1  VAL 106          3HG1      VAL 106   9.911  -6.812  -2.345
  811   1HG2  VAL 106          1HG2      VAL 106   8.821  -5.333  -0.351
  812   2HG2  VAL 106          2HG2      VAL 106   8.810  -6.769   0.677
  813   3HG2  VAL 106          3HG2      VAL 106   7.300  -5.932   0.313
  814    H    ASP 107           H        ASP 107   9.182  -5.685  -3.868
  815    HA   ASP 107           HA       ASP 107   8.007  -6.994  -6.233
  816   1HB   ASP 107          2HB       ASP 107   8.310  -4.475  -6.313
  817   2HB   ASP 107          1HB       ASP 107  10.044  -4.752  -6.215
  818    H    TYR 108           H        TYR 108   9.141  -8.595  -7.130
  819    HA   TYR 108           HA       TYR 108  11.686  -9.245  -5.844
  820   1HB   TYR 108          2HB       TYR 108   9.954 -11.059  -7.532
  821   2HB   TYR 108          1HB       TYR 108  11.306 -11.529  -6.503
  822    HD1  TYR 108           1HD      TYR 108   7.847 -11.455  -6.693
  823    HD2  TYR 108           2HD      TYR 108  11.008 -10.662  -3.961
  824    HE1  TYR 108           1HE      TYR 108   6.291 -11.748  -4.814
  825    HE2  TYR 108           2HE      TYR 108   9.460 -10.957  -2.074
  826    HH   TYR 108           HH       TYR 108   6.073 -11.083  -2.498
  827    H    ASP 109           H        ASP 109  13.516  -9.771  -7.031
  828    HA   ASP 109           HA       ASP 109  13.504  -8.636  -9.735
  829   1HB   ASP 109          2HB       ASP 109  15.134  -7.565  -8.332
  830   2HB   ASP 109          1HB       ASP 109  15.732  -9.113  -7.742
  831    H    ARG 110           H        ARG 110  14.889  -9.763 -11.312
  832    HA   ARG 110           HA       ARG 110  14.035 -12.439 -11.563
  833   1HB   ARG 110          2HB       ARG 110  16.140 -10.907 -13.093
  834   2HB   ARG 110          1HB       ARG 110  15.504 -12.478 -13.566
  835   1HG   ARG 110          2HG       ARG 110  13.589 -11.613 -14.362
  836   2HG   ARG 110          1HG       ARG 110  13.490 -10.387 -13.095
  837   1HD   ARG 110          2HD       ARG 110  15.738  -9.946 -14.874
  838   2HD   ARG 110          1HD       ARG 110  14.204  -9.983 -15.743
  839    HE   ARG 110           HE       ARG 110  14.366  -8.302 -13.362
  840   1HH1  ARG 110          1HH1      ARG 110  14.294  -8.542 -16.855
  841   2HH1  ARG 110          2HH1      ARG 110  13.969  -6.846 -17.086
  842   1HH2  ARG 110          1HH2      ARG 110  13.951  -6.092 -13.649
  843   2HH2  ARG 110          2HH2      ARG 110  13.774  -5.450 -15.261
  844    H    SER 111           H        SER 111  16.828 -11.061 -10.006
  845    HA   SER 111           HA       SER 111  17.987 -13.754  -9.827
  846   1HB   SER 111          2HB       SER 111  20.126 -12.051  -9.530
  847   2HB   SER 111          1HB       SER 111  19.694 -12.888 -11.022
  848    HG   SER 111           HG       SER 111  18.559 -10.376 -10.343
  849    H    GLY 112           H        GLY 112  17.267 -10.710  -8.242
  850   1HA   GLY 112          2HA       GLY 112  18.821 -11.493  -5.879
  851   2HA   GLY 112          1HA       GLY 112  18.202  -9.887  -6.217
  852    H    ARG 113           H        ARG 113  15.733 -11.967  -6.846
  853    HA   ARG 113           HA       ARG 113  13.810 -12.513  -5.812
  854   1HB   ARG 113          2HB       ARG 113  15.569 -13.885  -4.503
  855   2HB   ARG 113          1HB       ARG 113  15.266 -12.757  -3.194
  856   1HG   ARG 113          2HG       ARG 113  12.811 -13.333  -3.461
  857   2HG   ARG 113          1HG       ARG 113  13.346 -14.658  -4.494
  858   1HD   ARG 113          2HD       ARG 113  14.452 -15.735  -2.734
  859   2HD   ARG 113          1HD       ARG 113  14.448 -14.283  -1.729
  860    HE   ARG 113           HE       ARG 113  12.288 -14.752  -1.071
  861   1HH1  ARG 113          1HH1      ARG 113  13.292 -16.974  -3.590
  862   2HH1  ARG 113          2HH1      ARG 113  11.846 -17.933  -3.501
  863   1HH2  ARG 113          1HH2      ARG 113  10.383 -16.008  -0.951
  864   2HH2  ARG 113          2HH2      ARG 113  10.191 -17.380  -2.001
  865    H    SER 114           H        SER 114  14.405 -11.359  -2.580
  866    HA   SER 114           HA       SER 114  12.517  -9.201  -3.224
  867   1HB   SER 114          2HB       SER 114  12.678  -9.887  -0.402
  868   2HB   SER 114          1HB       SER 114  11.270  -9.845  -1.464
  869    HG   SER 114           HG       SER 114  13.133 -11.969  -1.140
  870    H    LEU 115           H        LEU 115  14.894  -8.495  -3.763
  871    HA   LEU 115           HA       LEU 115  16.582  -7.551  -1.729
  872   1HB   LEU 115          2HB       LEU 115  17.194  -5.914  -3.837
  873   2HB   LEU 115          1HB       LEU 115  17.885  -7.491  -3.523
  874    HG   LEU 115           HG       LEU 115  16.108  -8.474  -5.017
  875   1HD1  LEU 115          1HD1      LEU 115  15.079  -5.849  -4.865
  876   2HD1  LEU 115          2HD1      LEU 115  14.446  -7.220  -5.779
  877   3HD1  LEU 115          3HD1      LEU 115  15.598  -6.116  -6.530
  878   1HD2  LEU 115          1HD2      LEU 115  17.279  -8.031  -6.993
  879   2HD2  LEU 115          2HD2      LEU 115  18.468  -7.902  -5.694
  880   3HD2  LEU 115          3HD2      LEU 115  17.801  -6.442  -6.428
  881    H    GLY 116           H        GLY 116  14.140  -6.628  -0.891
  882   1HA   GLY 116          2HA       GLY 116  13.523  -4.789   0.342
  883   2HA   GLY 116          1HA       GLY 116  14.971  -3.985  -0.230
  884    H    THR 117           H        THR 117  13.115  -5.062  -2.815
  885    HA   THR 117           HA       THR 117  12.141  -2.378  -3.348
  886    HB   THR 117           HB       THR 117  11.169  -3.979  -5.368
  887    HG1  THR 117           1HG      THR 117  12.213  -5.815  -5.170
  888   1HG2  THR 117          1HG2      THR 117  13.940  -3.158  -5.802
  889   2HG2  THR 117          2HG2      THR 117  12.939  -1.887  -5.101
  890   3HG2  THR 117          3HG2      THR 117  12.468  -2.642  -6.624
  891    H    ALA 118           H        ALA 118  10.008  -1.742  -3.283
  892    HA   ALA 118           HA       ALA 118   7.916  -3.743  -3.230
  893   1HB   ALA 118          1HB       ALA 118   7.043  -3.398  -1.142
  894   2HB   ALA 118          2HB       ALA 118   7.759  -1.792  -0.983
  895   3HB   ALA 118          3HB       ALA 118   8.766  -3.230  -0.798
  896    H    ASP 119           H        ASP 119   5.810  -2.863  -3.415
  897    HA   ASP 119           HA       ASP 119   5.703  -0.078  -4.366
  898   1HB   ASP 119          2HB       ASP 119   5.401  -1.316  -6.347
  899   2HB   ASP 119          1HB       ASP 119   4.487  -2.577  -5.528
  900    H    VAL 120           H        VAL 120   4.639   1.005  -2.810
  901    HA   VAL 120           HA       VAL 120   2.238  -0.292  -1.719
  902    HB   VAL 120           HB       VAL 120   2.489   0.677   0.303
  903   1HG1  VAL 120          1HG1      VAL 120   5.061   0.156  -0.857
  904   2HG1  VAL 120          2HG1      VAL 120   4.482  -0.142   0.783
  905   3HG1  VAL 120          3HG1      VAL 120   5.175   1.429   0.364
  906   1HG2  VAL 120          1HG2      VAL 120   3.922   2.950   0.400
  907   2HG2  VAL 120          2HG2      VAL 120   2.175   2.893   0.165
  908   3HG2  VAL 120          3HG2      VAL 120   3.249   3.069  -1.225
  909    H    HIS 121           H        HIS 121   0.286   0.732  -1.837
  910    HA   HIS 121           HA       HIS 121   0.216   3.078  -3.619
  911   1HB   HIS 121          2HB       HIS 121  -0.944   0.394  -3.886
  912   2HB   HIS 121          1HB       HIS 121  -2.108   1.692  -4.125
  913    HD1  HIS 121           1HD      HIS 121   0.812   0.023  -5.711
  914    HD2  HIS 121           2HD      HIS 121  -1.589   3.364  -6.358
  915    HE1  HIS 121           1HE      HIS 121   1.239   0.719  -8.082
  916    HE2  HIS 121           2HE      HIS 121  -0.401   2.577  -8.521
  917    H    PHE 122           H        PHE 122  -0.738   4.751  -2.587
  918    HA   PHE 122           HA       PHE 122  -3.053   4.121  -0.889
  919   1HB   PHE 122          2HB       PHE 122  -2.279   6.910  -0.820
  920   2HB   PHE 122          1HB       PHE 122  -2.420   5.761   0.503
  921    HD1  PHE 122           1HD      PHE 122  -0.497   4.735   1.457
  922    HD2  PHE 122           2HD      PHE 122  -0.123   7.178  -2.005
  923    HE1  PHE 122           1HE      PHE 122   1.936   4.801   1.769
  924    HE2  PHE 122           2HE      PHE 122   2.312   7.241  -1.702
  925    HZ   PHE 122           HZ       PHE 122   3.346   6.053   0.188
  926    H    GLU 123           H        GLU 123  -4.987   5.394  -1.185
  927    HA   GLU 123           HA       GLU 123  -5.513   5.889  -3.982
  928   1HB   GLU 123          2HB       GLU 123  -7.816   6.206  -3.302
  929   2HB   GLU 123          1HB       GLU 123  -7.167   4.781  -2.509
  930   1HG   GLU 123          2HG       GLU 123  -7.058   7.374  -1.061
  931   2HG   GLU 123          1HG       GLU 123  -8.611   6.552  -1.207
  932    H    ARG 124           H        ARG 124  -4.214   7.708  -1.539
  933    HA   ARG 124           HA       ARG 124  -5.385  10.226  -2.486
  934   1HB   ARG 124          2HB       ARG 124  -4.117  10.926  -0.235
  935   2HB   ARG 124          1HB       ARG 124  -5.779  10.353  -0.251
  936   1HG   ARG 124          2HG       ARG 124  -4.295   8.034  -0.076
  937   2HG   ARG 124          1HG       ARG 124  -3.406   9.176   0.933
  938   1HD   ARG 124          2HD       ARG 124  -6.192   8.140   1.235
  939   2HD   ARG 124          1HD       ARG 124  -4.899   8.228   2.427
  940    HE   ARG 124           HE       ARG 124  -6.856  10.227   1.846
  941   1HH1  ARG 124          1HH1      ARG 124  -3.572   9.744   3.011
  942   2HH1  ARG 124          2HH1      ARG 124  -3.534  11.253   3.878
  943   1HH2  ARG 124          1HH2      ARG 124  -6.814  12.178   3.018
  944   2HH2  ARG 124          2HH2      ARG 124  -5.377  12.628   3.894
  945    H    ARG 125           H        ARG 125  -4.096  11.701  -3.445
  946    HA   ARG 125           HA       ARG 125  -1.411  11.071  -4.094
  947   1HB   ARG 125          2HB       ARG 125  -1.586  13.724  -4.667
  948   2HB   ARG 125          1HB       ARG 125  -2.116  12.439  -5.740
  949   1HG   ARG 125          2HG       ARG 125  -4.158  13.280  -5.718
  950   2HG   ARG 125          1HG       ARG 125  -4.255  12.990  -3.980
  951   1HD   ARG 125          2HD       ARG 125  -2.941  15.207  -3.774
  952   2HD   ARG 125          1HD       ARG 125  -3.453  15.481  -5.438
  953    HE   ARG 125           HE       ARG 125  -5.236  15.236  -3.103
  954   1HH1  ARG 125          1HH1      ARG 125  -4.695  16.184  -6.442
  955   2HH1  ARG 125          2HH1      ARG 125  -6.222  16.999  -6.578
  956   1HH2  ARG 125          1HH2      ARG 125  -7.265  16.278  -3.317
  957   2HH2  ARG 125          2HH2      ARG 125  -7.668  17.058  -4.827
  958    H    ALA 126           H        ALA 126  -2.915  13.024  -1.597
  959    HA   ALA 126           HA       ALA 126  -0.637  14.503  -0.830
  960   1HB   ALA 126          1HB       ALA 126  -2.542  15.404   0.051
  961   2HB   ALA 126          2HB       ALA 126  -1.938  14.514   1.449
  962   3HB   ALA 126          3HB       ALA 126  -3.230  13.832   0.460
  963    H    ASP 127           H        ASP 127  -1.781  11.310   0.058
  964    HA   ASP 127           HA       ASP 127  -0.024  10.852   2.215
  965   1HB   ASP 127          2HB       ASP 127  -1.977   9.362   0.866
  966   2HB   ASP 127          1HB       ASP 127  -0.488   8.443   0.672
  967    H    ALA 128           H        ALA 128   0.348  10.617  -1.245
  968    HA   ALA 128           HA       ALA 128   2.974   9.426  -1.120
  969   1HB   ALA 128          1HB       ALA 128   2.997   9.998  -3.580
  970   2HB   ALA 128          2HB       ALA 128   1.362  10.624  -3.367
  971   3HB   ALA 128          3HB       ALA 128   1.701   8.921  -3.063
  972    H    LEU 129           H        LEU 129   1.549  12.584  -1.557
  973    HA   LEU 129           HA       LEU 129   3.859  14.069  -2.124
  974   1HB   LEU 129          2HB       LEU 129   1.516  14.914  -2.276
  975   2HB   LEU 129          1HB       LEU 129   1.468  14.989  -0.525
  976    HG   LEU 129           HG       LEU 129   3.749  16.435  -1.587
  977   1HD1  LEU 129          1HD1      LEU 129   2.816  17.386  -3.369
  978   2HD1  LEU 129          2HD1      LEU 129   1.763  18.242  -2.242
  979   3HD1  LEU 129          3HD1      LEU 129   1.225  16.732  -2.979
  980   1HD2  LEU 129          1HD2      LEU 129   1.364  17.295   0.048
  981   2HD2  LEU 129          2HD2      LEU 129   2.874  18.187  -0.147
  982   3HD2  LEU 129          3HD2      LEU 129   2.867  16.636   0.694
  983    H    LYS 130           H        LYS 130   2.328  13.309   0.990
  984    HA   LYS 130           HA       LYS 130   4.281  14.632   2.564
  985   1HB   LYS 130          2HB       LYS 130   2.693  14.266   4.090
  986   2HB   LYS 130          1HB       LYS 130   1.862  13.175   2.993
  987   1HG   LYS 130          2HG       LYS 130   4.047  11.760   4.102
  988   2HG   LYS 130          1HG       LYS 130   3.207  12.581   5.422
  989   1HD   LYS 130          2HD       LYS 130   1.081  11.623   4.653
  990   2HD   LYS 130          1HD       LYS 130   1.934  10.786   3.356
  991   1HE   LYS 130          2HE       LYS 130   3.082   9.396   4.878
  992   2HE   LYS 130          1HE       LYS 130   2.633  10.401   6.253
  993   1HZ   LYS 130          1HZ       LYS 130   0.729   8.808   4.611
  994   2HZ   LYS 130          2HZ       LYS 130   0.348   9.719   5.991
  995   3HZ   LYS 130          3HZ       LYS 130   1.328   8.349   6.133
  996    H    ALA 131           H        ALA 131   3.946  11.319   1.392
  997    HA   ALA 131           HA       ALA 131   6.126  10.247   2.844
  998   1HB   ALA 131          1HB       ALA 131   5.260   9.194   0.172
  999   2HB   ALA 131          2HB       ALA 131   4.259   8.990   1.608
 1000   3HB   ALA 131          3HB       ALA 131   5.885   8.306   1.563
 1001    H    MET 132           H        MET 132   5.911  11.856  -0.291
 1002    HA   MET 132           HA       MET 132   8.649  11.312  -0.952
 1003   1HB   MET 132          2HB       MET 132   8.228  12.299  -2.977
 1004   2HB   MET 132          1HB       MET 132   6.594  11.856  -2.515
 1005   1HG   MET 132          2HG       MET 132   6.023  14.055  -1.978
 1006   2HG   MET 132          1HG       MET 132   7.707  14.568  -1.905
 1007   1HE   MET 132          1HE       MET 132   4.729  13.594  -3.767
 1008   2HE   MET 132          2HE       MET 132   5.538  12.767  -5.099
 1009   3HE   MET 132          3HE       MET 132   4.859  14.377  -5.343
 1010    H    LYS 133           H        LYS 133   7.001  13.663   0.915
 1011    HA   LYS 133           HA       LYS 133   9.188  15.564   0.820
 1012   1HB   LYS 133          2HB       LYS 133   6.447  15.521   1.848
 1013   2HB   LYS 133          1HB       LYS 133   7.581  16.318   2.930
 1014   1HG   LYS 133          2HG       LYS 133   6.573  17.933   1.455
 1015   2HG   LYS 133          1HG       LYS 133   8.292  17.778   1.087
 1016   1HD   LYS 133          2HD       LYS 133   7.843  16.469  -0.846
 1017   2HD   LYS 133          1HD       LYS 133   6.144  16.285  -0.405
 1018   1HE   LYS 133          2HE       LYS 133   5.875  17.969  -1.886
 1019   2HE   LYS 133          1HE       LYS 133   6.306  18.964  -0.496
 1020   1HZ   LYS 133          1HZ       LYS 133   7.896  18.276  -2.860
 1021   2HZ   LYS 133          2HZ       LYS 133   8.711  18.526  -1.394
 1022   3HZ   LYS 133          3HZ       LYS 133   7.747  19.760  -2.050
 1023    H    GLN 134           H        GLN 134   7.761  13.310   3.164
 1024    HA   GLN 134           HA       GLN 134   9.887  13.947   5.055
 1025   1HB   GLN 134          2HB       GLN 134   7.190  13.100   5.285
 1026   2HB   GLN 134          1HB       GLN 134   8.200  11.866   6.027
 1027   1HG   GLN 134          2HG       GLN 134   8.051  13.172   7.837
 1028   2HG   GLN 134          1HG       GLN 134   9.319  14.103   7.043
 1029   1HE2  GLN 134          1HE2      GLN 134   8.378  15.730   5.397
 1030   2HE2  GLN 134          2HE2      GLN 134   7.044  16.678   5.967
 1031    H    TYR 135           H        TYR 135   8.560  10.961   3.572
 1032    HA   TYR 135           HA       TYR 135  10.655   9.361   4.678
 1033   1HB   TYR 135          2HB       TYR 135   8.224   8.732   3.772
 1034   2HB   TYR 135          1HB       TYR 135   9.135   8.400   2.305
 1035    HD1  TYR 135           1HD      TYR 135  11.510   7.733   4.610
 1036    HD2  TYR 135           2HD      TYR 135   7.742   6.202   3.370
 1037    HE1  TYR 135           1HE      TYR 135  12.120   5.524   5.506
 1038    HE2  TYR 135           2HE      TYR 135   8.331   3.994   4.269
 1039    HH   TYR 135           HH       TYR 135  10.542   3.401   6.398
 1040    H    LYS 136           H        LYS 136   9.899  10.326   1.332
 1041    HA   LYS 136           HA       LYS 136  12.233   9.249   0.202
 1042   1HB   LYS 136          2HB       LYS 136  10.355   9.796  -1.193
 1043   2HB   LYS 136          1HB       LYS 136  10.421  11.485  -0.709
 1044   1HG   LYS 136          2HG       LYS 136  12.884  11.206  -1.731
 1045   2HG   LYS 136          1HG       LYS 136  12.010  10.017  -2.700
 1046   1HD   LYS 136          2HD       LYS 136  10.907  11.598  -3.842
 1047   2HD   LYS 136          1HD       LYS 136  10.587  12.549  -2.391
 1048   1HE   LYS 136          2HE       LYS 136  11.967  13.830  -3.891
 1049   2HE   LYS 136          1HE       LYS 136  12.910  13.382  -2.470
 1050   1HZ   LYS 136          1HZ       LYS 136  13.767  13.054  -4.963
 1051   2HZ   LYS 136          2HZ       LYS 136  13.043  11.541  -4.713
 1052   3HZ   LYS 136          3HZ       LYS 136  14.267  12.076  -3.670
 1053    H    GLY 137           H        GLY 137  14.251   9.799   0.680
 1054   1HA   GLY 137          2HA       GLY 137  15.879  11.673   0.321
 1055   2HA   GLY 137          1HA       GLY 137  14.804  12.612   1.356
 1056    H    VAL 138           H        VAL 138  14.513   9.692   2.618
 1057    HA   VAL 138           HA       VAL 138  16.261  10.179   4.822
 1058    HB   VAL 138           HB       VAL 138  14.394   7.934   4.095
 1059   1HG1  VAL 138          1HG1      VAL 138  16.700   7.682   5.771
 1060   2HG1  VAL 138          2HG1      VAL 138  15.474   6.477   5.375
 1061   3HG1  VAL 138          3HG1      VAL 138  15.240   7.552   6.753
 1062   1HG2  VAL 138          1HG2      VAL 138  13.004   9.344   5.122
 1063   2HG2  VAL 138          2HG2      VAL 138  14.328  10.313   5.768
 1064   3HG2  VAL 138          3HG2      VAL 138  13.803   8.859   6.617
 1065    HA   PRO 139           HA       PRO 139  19.735   7.844   3.146
 1066   1HB   PRO 139          2HB       PRO 139  21.181   8.746   5.484
 1067   2HB   PRO 139          1HB       PRO 139  21.418   9.220   3.799
 1068   1HG   PRO 139          2HG       PRO 139  20.473  10.908   5.731
 1069   2HG   PRO 139          1HG       PRO 139  20.106  11.081   4.005
 1070   1HD   PRO 139          2HD       PRO 139  18.433   9.898   6.192
 1071   2HD   PRO 139          1HD       PRO 139  17.947  10.940   4.836
 1072    H    LEU 140           H        LEU 140  20.029   5.686   3.580
 1073    HA   LEU 140           HA       LEU 140  19.630   4.810   6.345
 1074   1HB   LEU 140          2HB       LEU 140  17.595   4.571   4.646
 1075   2HB   LEU 140          1HB       LEU 140  18.498   3.157   4.137
 1076    HG   LEU 140           HG       LEU 140  18.401   2.999   6.934
 1077   1HD1  LEU 140          1HD1      LEU 140  15.740   3.800   5.767
 1078   2HD1  LEU 140          2HD1      LEU 140  16.650   4.648   7.017
 1079   3HD1  LEU 140          3HD1      LEU 140  15.964   3.058   7.351
 1080   1HD2  LEU 140          1HD2      LEU 140  16.670   1.583   4.912
 1081   2HD2  LEU 140          2HD2      LEU 140  17.112   1.009   6.519
 1082   3HD2  LEU 140          3HD2      LEU 140  18.346   1.164   5.267
 1083    H    ASP 141           H        ASP 141  21.230   3.531   6.951
 1084    HA   ASP 141           HA       ASP 141  23.298   2.587   6.863
 1085   1HB   ASP 141          2HB       ASP 141  21.451   0.868   5.769
 1086   2HB   ASP 141          1HB       ASP 141  22.720   0.889   4.547
 1087    H    GLY 142           H        GLY 142  24.131   4.685   6.053
 1088   1HA   GLY 142          2HA       GLY 142  26.047   5.316   4.836
 1089   2HA   GLY 142          1HA       GLY 142  25.662   4.098   3.633
 1090    H    ARG 143           H        ARG 143  23.356   4.616   2.522
 1091    HA   ARG 143           HA       ARG 143  23.558   7.456   1.742
 1092   1HB   ARG 143          2HB       ARG 143  23.293   6.818  -0.584
 1093   2HB   ARG 143          1HB       ARG 143  24.678   5.980   0.100
 1094   1HG   ARG 143          2HG       ARG 143  23.833   4.053  -0.578
 1095   2HG   ARG 143          1HG       ARG 143  22.434   4.305   0.467
 1096   1HD   ARG 143          2HD       ARG 143  21.280   5.486  -1.305
 1097   2HD   ARG 143          1HD       ARG 143  22.699   5.371  -2.344
 1098    HE   ARG 143           HE       ARG 143  22.095   2.772  -1.700
 1099   1HH1  ARG 143          1HH1      ARG 143  20.367   5.422  -3.207
 1100   2HH1  ARG 143          2HH1      ARG 143  19.384   4.393  -4.205
 1101   1HH2  ARG 143          1HH2      ARG 143  20.790   1.405  -2.994
 1102   2HH2  ARG 143          2HH2      ARG 143  19.622   2.104  -4.083
 1103    HA   PRO 144           HA       PRO 144  19.097   7.754   1.946
 1104   1HB   PRO 144          2HB       PRO 144  19.313   9.046  -0.726
 1105   2HB   PRO 144          1HB       PRO 144  18.519   9.626   0.743
 1106   1HG   PRO 144          2HG       PRO 144  20.841  10.665  -0.044
 1107   2HG   PRO 144          1HG       PRO 144  20.504  10.384   1.675
 1108   1HD   PRO 144          2HD       PRO 144  22.214   8.810  -0.204
 1109   2HD   PRO 144          1HD       PRO 144  22.471   9.182   1.512
 1110    H    MET 145           H        MET 145  17.659   6.247   1.462
 1111    HA   MET 145           HA       MET 145  18.284   4.247  -0.491
 1112   1HB   MET 145          2HB       MET 145  16.306   3.094   0.302
 1113   2HB   MET 145          1HB       MET 145  17.226   3.696   1.672
 1114   1HG   MET 145          2HG       MET 145  15.563   5.741   1.404
 1115   2HG   MET 145          1HG       MET 145  14.554   4.495   0.673
 1116   1HE   MET 145          1HE       MET 145  12.814   4.066   1.847
 1117   2HE   MET 145          2HE       MET 145  12.617   3.721   3.565
 1118   3HE   MET 145          3HE       MET 145  13.239   2.476   2.480
 1119    H    ASP 146           H        ASP 146  15.992   3.452  -1.672
 1120    HA   ASP 146           HA       ASP 146  15.520   5.692  -3.510
 1121   1HB   ASP 146          2HB       ASP 146  16.397   3.234  -4.123
 1122   2HB   ASP 146          1HB       ASP 146  14.661   2.925  -4.192
 1123    H    ILE 147           H        ILE 147  13.780   6.772  -2.899
 1124    HA   ILE 147           HA       ILE 147  11.301   5.242  -2.480
 1125    HB   ILE 147           HB       ILE 147  11.193   7.835  -1.210
 1126   1HG1  ILE 147          2HG1      ILE 147  13.539   6.092  -0.589
 1127   2HG1  ILE 147          1HG1      ILE 147  13.412   7.845  -0.571
 1128   1HG2  ILE 147          1HG2      ILE 147  11.058   5.300   0.324
 1129   2HG2  ILE 147          2HG2      ILE 147   9.881   5.544  -0.969
 1130   3HG2  ILE 147          3HG2      ILE 147   9.991   6.703   0.356
 1131   1HD1  ILE 147          1HD1      ILE 147  13.750   6.794   1.655
 1132   2HD1  ILE 147          2HD1      ILE 147  12.157   6.054   1.491
 1133   3HD1  ILE 147          3HD1      ILE 147  12.312   7.810   1.541
 1134    H    GLN 148           H        GLN 148  10.136   5.564  -4.244
 1135    HA   GLN 148           HA       GLN 148  10.121   8.268  -5.425
 1136   1HB   GLN 148          2HB       GLN 148   9.709   5.601  -6.783
 1137   2HB   GLN 148          1HB       GLN 148   9.552   7.165  -7.570
 1138   1HG   GLN 148          2HG       GLN 148  11.903   7.633  -7.110
 1139   2HG   GLN 148          1HG       GLN 148  12.059   6.058  -6.330
 1140   1HE2  GLN 148          1HE2      GLN 148  10.843   7.415  -9.379
 1141   2HE2  GLN 148          2HE2      GLN 148  11.557   6.200 -10.393
 1142    H    LEU 149           H        LEU 149   8.262   9.325  -5.279
 1143    HA   LEU 149           HA       LEU 149   5.814   7.751  -4.821
 1144   1HB   LEU 149          2HB       LEU 149   6.736  10.439  -3.902
 1145   2HB   LEU 149          1HB       LEU 149   5.018  10.171  -4.115
 1146    HG   LEU 149           HG       LEU 149   5.450   9.793  -1.833
 1147   1HD1  LEU 149          1HD1      LEU 149   4.904   7.460  -3.521
 1148   2HD1  LEU 149          2HD1      LEU 149   4.001   8.118  -2.156
 1149   3HD1  LEU 149          3HD1      LEU 149   5.404   7.087  -1.872
 1150   1HD2  LEU 149          1HD2      LEU 149   7.219   7.819  -1.402
 1151   2HD2  LEU 149          2HD2      LEU 149   7.646   9.530  -1.392
 1152   3HD2  LEU 149          3HD2      LEU 149   7.934   8.559  -2.835
 1153    H    VAL 150           H        VAL 150   4.907   7.430  -6.809
 1154    HA   VAL 150           HA       VAL 150   4.769   9.740  -8.612
 1155    HB   VAL 150           HB       VAL 150   4.368   6.790  -9.190
 1156   1HG1  VAL 150          1HG1      VAL 150   4.523   9.038 -11.190
 1157   2HG1  VAL 150          2HG1      VAL 150   2.996   8.404 -10.572
 1158   3HG1  VAL 150          3HG1      VAL 150   4.086   7.354 -11.477
 1159   1HG2  VAL 150          1HG2      VAL 150   6.489   6.704 -10.048
 1160   2HG2  VAL 150          2HG2      VAL 150   6.730   7.861  -8.738
 1161   3HG2  VAL 150          3HG2      VAL 150   6.540   8.433 -10.395
 1162    H    ALA 151           H        ALA 151   2.942  10.831  -8.328
 1163    HA   ALA 151           HA       ALA 151   0.476   9.366  -7.796
 1164   1HB   ALA 151          1HB       ALA 151  -0.125  11.529  -6.472
 1165   2HB   ALA 151          2HB       ALA 151   1.625  11.731  -6.367
 1166   3HB   ALA 151          3HB       ALA 151   0.863  10.285  -5.706
 1167    H    SER 152           H        SER 152  -1.059   9.827  -9.087
 1168    HA   SER 152           HA       SER 152  -2.544  10.962 -10.393
 1169   1HB   SER 152          2HB       SER 152  -0.681  13.343 -10.379
 1170   2HB   SER 152          1HB       SER 152  -2.394  13.319 -10.800
 1171    HG   SER 152           HG       SER 152  -2.849  12.764  -8.624
 1172    H    GLN 153           H        GLN 153   0.111   9.612 -11.123
 1173    HA   GLN 153           HA       GLN 153  -0.269  10.054 -14.002
 1174   1HB   GLN 153          2HB       GLN 153   1.973  10.921 -13.027
 1175   2HB   GLN 153          1HB       GLN 153   2.392   9.221 -12.857
 1176   1HG   GLN 153          2HG       GLN 153   1.377   9.793 -15.499
 1177   2HG   GLN 153          1HG       GLN 153   2.748  10.825 -15.094
 1178   1HE2  GLN 153          1HE2      GLN 153   4.079   9.812 -16.593
 1179   2HE2  GLN 153          2HE2      GLN 153   4.708   8.219 -16.340
 1180    H    ILE 154           H        ILE 154   1.527   7.845 -11.907
 1181    HA   ILE 154           HA       ILE 154   1.783   5.583 -11.954
 1182    HB   ILE 154           HB       ILE 154  -0.395   4.388 -11.391
 1183   1HG1  ILE 154          2HG1      ILE 154  -1.647   6.968 -10.717
 1184   2HG1  ILE 154          1HG1      ILE 154  -1.610   6.608 -12.439
 1185   1HG2  ILE 154          1HG2      ILE 154   1.256   5.197  -9.762
 1186   2HG2  ILE 154          2HG2      ILE 154  -0.395   5.277  -9.145
 1187   3HG2  ILE 154          3HG2      ILE 154   0.414   6.745  -9.697
 1188   1HD1  ILE 154          1HD1      ILE 154  -2.960   5.107 -10.233
 1189   2HD1  ILE 154          2HD1      ILE 154  -2.599   4.337 -11.779
 1190   3HD1  ILE 154          3HD1      ILE 154  -3.646   5.756 -11.722
 1191    H    ASP 155           H        ASP 155   2.015   6.263 -14.509
 1192    HA   ASP 155           HA       ASP 155   0.321   4.341 -15.964
 1193   1HB   ASP 155          2HB       ASP 155   0.560   6.940 -16.556
 1194   2HB   ASP 155          1HB       ASP 155   1.944   6.329 -17.460
 1195    H    LEU 156           H        LEU 156   3.568   5.249 -15.150
 1196    HA   LEU 156           HA       LEU 156   4.814   3.446 -17.018
 1197   1HB   LEU 156          2HB       LEU 156   5.703   5.271 -14.861
 1198   2HB   LEU 156          1HB       LEU 156   6.731   3.886 -15.162
 1199    HG   LEU 156           HG       LEU 156   7.597   4.796 -17.015
 1200   1HD1  LEU 156          1HD1      LEU 156   4.797   5.628 -17.734
 1201   2HD1  LEU 156          2HD1      LEU 156   5.756   4.324 -18.432
 1202   3HD1  LEU 156          3HD1      LEU 156   6.205   6.003 -18.727
 1203   1HD2  LEU 156          1HD2      LEU 156   6.136   7.338 -16.414
 1204   2HD2  LEU 156          2HD2      LEU 156   7.793   7.106 -16.974
 1205   3HD2  LEU 156          3HD2      LEU 156   7.361   6.709 -15.310
 1206    H    GLU 157           H        GLU 157   4.604   3.556 -13.489
 1207    HA   GLU 157           HA       GLU 157   4.404   2.013 -11.888
 1208   1HB   GLU 157          2HB       GLU 157   3.143   0.643 -14.184
 1209   2HB   GLU 157          1HB       GLU 157   3.481  -0.297 -12.731
 1210   1HG   GLU 157          2HG       GLU 157   2.384   2.136 -11.879
 1211   2HG   GLU 157          1HG       GLU 157   1.400   1.580 -13.221
 1212    H    HIS 158           H        HIS 158   5.345  -0.181 -14.526
 1213    HA   HIS 158           HA       HIS 158   7.971  -0.630 -13.531
 1214   1HB   HIS 158          2HB       HIS 158   6.172  -1.826 -11.931
 1215   2HB   HIS 158          1HB       HIS 158   6.295  -3.065 -13.171
 1216    HD1  HIS 158           1HD      HIS 158   9.281  -3.099 -13.727
 1217    HD2  HIS 158           2HD      HIS 158   7.661  -2.806  -9.911
 1218    HE1  HIS 158           1HE      HIS 158  11.056  -3.962 -12.167
 1219    HE2  HIS 158           2HE      HIS 158   9.946  -4.017  -9.902
  Start of MODEL   11
    1    H    MET   1           H        MET   1-124.232  -8.840 -48.014
    2    HA   MET   1           HA       MET   1-122.168  -6.843 -47.714
    3   1HB   MET   1          2HB       MET   1-121.924  -9.076 -45.879
    4   2HB   MET   1          1HB       MET   1-122.218  -7.378 -45.537
    5   1HG   MET   1          2HG       MET   1-124.561  -7.653 -45.725
    6   2HG   MET   1          1HG       MET   1-124.383  -9.266 -46.411
    7   1HE   MET   1          1HE       MET   1-121.938 -10.253 -44.425
    8   2HE   MET   1          2HE       MET   1-123.245 -11.299 -44.983
    9   3HE   MET   1          3HE       MET   1-122.885 -11.177 -43.260
   10    H    ALA   2           H        ALA   2-122.436 -10.245 -48.499
   11    HA   ALA   2           HA       ALA   2-121.031 -11.703 -49.519
   12   1HB   ALA   2          1HB       ALA   2-120.300 -10.596 -51.320
   13   2HB   ALA   2          2HB       ALA   2-118.809 -10.358 -50.409
   14   3HB   ALA   2          3HB       ALA   2-120.048  -9.104 -50.414
   15    H    ASP   3           H        ASP   3-120.932 -11.438 -46.821
   16    HA   ASP   3           HA       ASP   3-118.074 -11.763 -46.182
   17   1HB   ASP   3          2HB       ASP   3-118.899  -9.807 -45.043
   18   2HB   ASP   3          1HB       ASP   3-120.327 -10.668 -44.486
   19    H    LYS   4           H        LYS   4-121.094 -12.538 -44.485
   20    HA   LYS   4           HA       LYS   4-121.916 -14.434 -43.564
   21   1HB   LYS   4          2HB       LYS   4-121.165 -15.086 -46.196
   22   2HB   LYS   4          1HB       LYS   4-120.626 -16.428 -45.194
   23   1HG   LYS   4          2HG       LYS   4-122.760 -17.068 -45.777
   24   2HG   LYS   4          1HG       LYS   4-123.014 -16.325 -44.198
   25   1HD   LYS   4          2HD       LYS   4-123.298 -14.174 -45.815
   26   2HD   LYS   4          1HD       LYS   4-123.899 -15.456 -46.870
   27   1HE   LYS   4          2HE       LYS   4-125.329 -16.185 -44.888
   28   2HE   LYS   4          1HE       LYS   4-124.913 -14.633 -44.161
   29   1HZ   LYS   4          1HZ       LYS   4-126.242 -14.982 -46.799
   30   2HZ   LYS   4          2HZ       LYS   4-125.894 -13.504 -46.041
   31   3HZ   LYS   4          3HZ       LYS   4-127.029 -14.562 -45.358
   32    H    MET   5           H        MET   5-119.348 -13.401 -42.642
   33    HA   MET   5           HA       MET   5-118.321 -15.869 -41.393
   34   1HB   MET   5          2HB       MET   5-116.787 -14.589 -43.062
   35   2HB   MET   5          1HB       MET   5-116.629 -13.413 -41.765
   36   1HG   MET   5          2HG       MET   5-116.068 -15.611 -40.381
   37   2HG   MET   5          1HG       MET   5-115.567 -16.163 -41.980
   38   1HE   MET   5          1HE       MET   5-113.060 -15.210 -43.117
   39   2HE   MET   5          2HE       MET   5-113.025 -13.449 -43.032
   40   3HE   MET   5          3HE       MET   5-114.497 -14.277 -43.538
   41    H    ASP   6           H        ASP   6-118.681 -12.367 -41.080
   42    HA   ASP   6           HA       ASP   6-118.931 -12.681 -38.154
   43   1HB   ASP   6          2HB       ASP   6-117.840 -10.552 -39.901
   44   2HB   ASP   6          1HB       ASP   6-118.787  -9.997 -38.524
   45    H    MET   7           H        MET   7-120.417 -11.671 -41.094
   46    HA   MET   7           HA       MET   7-122.566 -11.283 -41.678
   47   1HB   MET   7          2HB       MET   7-122.939 -13.098 -39.843
   48   2HB   MET   7          1HB       MET   7-123.527 -11.751 -38.879
   49   1HG   MET   7          2HG       MET   7-124.714 -11.688 -41.488
   50   2HG   MET   7          1HG       MET   7-124.942 -13.272 -40.750
   51   1HE   MET   7          1HE       MET   7-126.836 -13.002 -37.803
   52   2HE   MET   7          2HE       MET   7-125.571 -11.911 -37.236
   53   3HE   MET   7          3HE       MET   7-125.151 -13.315 -38.218
   54    H    SER   8           H        SER   8-123.180 -10.231 -38.379
   55    HA   SER   8           HA       SER   8-123.994  -7.657 -39.351
   56   1HB   SER   8          2HB       SER   8-123.887  -7.707 -36.504
   57   2HB   SER   8          1HB       SER   8-125.309  -7.787 -37.547
   58    HG   SER   8           HG       SER   8-125.428  -9.673 -36.527
   59    H    LEU   9           H        LEU   9-122.182  -6.598 -40.097
   60    HA   LEU   9           HA       LEU   9-119.787  -6.289 -38.610
   61   1HB   LEU   9          2HB       LEU   9-121.004  -4.811 -40.926
   62   2HB   LEU   9          1HB       LEU   9-119.517  -4.256 -40.180
   63    HG   LEU   9           HG       LEU   9-119.352  -7.071 -40.807
   64   1HD1  LEU   9          1HD1      LEU   9-119.289  -6.753 -43.282
   65   2HD1  LEU   9          2HD1      LEU   9-120.069  -5.190 -43.046
   66   3HD1  LEU   9          3HD1      LEU   9-120.902  -6.672 -42.575
   67   1HD2  LEU   9          1HD2      LEU   9-117.395  -5.799 -40.381
   68   2HD2  LEU   9          2HD2      LEU   9-117.834  -4.595 -41.593
   69   3HD2  LEU   9          3HD2      LEU   9-117.365  -6.220 -42.092
   70    H    ASP  10           H        ASP  10-122.842  -4.646 -38.679
   71    HA   ASP  10           HA       ASP  10-122.208  -2.293 -37.287
   72   1HB   ASP  10          2HB       ASP  10-124.360  -2.476 -38.302
   73   2HB   ASP  10          1HB       ASP  10-124.724  -3.959 -37.429
   74    H    ASP  11           H        ASP  11-122.981  -5.536 -36.174
   75    HA   ASP  11           HA       ASP  11-123.114  -5.012 -33.414
   76   1HB   ASP  11          2HB       ASP  11-123.286  -7.271 -35.093
   77   2HB   ASP  11          1HB       ASP  11-121.991  -7.616 -33.953
   78    H    ILE  12           H        ILE  12-120.445  -5.770 -35.577
   79    HA   ILE  12           HA       ILE  12-118.414  -5.961 -33.614
   80    HB   ILE  12           HB       ILE  12-118.065  -5.001 -36.452
   81   1HG1  ILE  12          2HG1      ILE  12-117.798  -7.861 -35.521
   82   2HG1  ILE  12          1HG1      ILE  12-119.311  -7.228 -36.163
   83   1HG2  ILE  12          1HG2      ILE  12-116.219  -4.897 -34.571
   84   2HG2  ILE  12          2HG2      ILE  12-115.817  -5.397 -36.217
   85   3HG2  ILE  12          3HG2      ILE  12-116.049  -6.611 -34.961
   86   1HD1  ILE  12          1HD1      ILE  12-117.208  -8.337 -37.595
   87   2HD1  ILE  12          2HD1      ILE  12-117.112  -6.603 -37.911
   88   3HD1  ILE  12          3HD1      ILE  12-118.605  -7.479 -38.244
   89    H    ILE  13           H        ILE  13-119.439  -3.306 -35.733
   90    HA   ILE  13           HA       ILE  13-117.797  -1.274 -34.843
   91    HB   ILE  13           HB       ILE  13-120.698  -1.116 -35.658
   92   1HG1  ILE  13          2HG1      ILE  13-118.324  -0.271 -37.297
   93   2HG1  ILE  13          1HG1      ILE  13-118.812  -1.962 -37.243
   94   1HG2  ILE  13          1HG2      ILE  13-120.632   1.176 -35.675
   95   2HG2  ILE  13          2HG2      ILE  13-118.877   1.235 -35.841
   96   3HG2  ILE  13          3HG2      ILE  13-119.603   0.847 -34.281
   97   1HD1  ILE  13          1HD1      ILE  13-119.713  -0.724 -39.177
   98   2HD1  ILE  13          2HD1      ILE  13-120.612   0.303 -38.060
   99   3HD1  ILE  13          3HD1      ILE  13-120.963  -1.423 -38.150
  100    H    LYS  14           H        LYS  14-120.898  -2.303 -33.491
  101    HA   LYS  14           HA       LYS  14-121.105  -0.534 -31.370
  102   1HB   LYS  14          2HB       LYS  14-122.070  -3.265 -31.946
  103   2HB   LYS  14          1HB       LYS  14-122.086  -2.788 -30.253
  104   1HG   LYS  14          2HG       LYS  14-123.650  -1.713 -32.542
  105   2HG   LYS  14          1HG       LYS  14-124.176  -2.134 -30.912
  106   1HD   LYS  14          2HD       LYS  14-122.655  -0.149 -30.196
  107   2HD   LYS  14          1HD       LYS  14-122.808   0.343 -31.886
  108   1HE   LYS  14          2HE       LYS  14-124.971   0.026 -29.821
  109   2HE   LYS  14          1HE       LYS  14-124.523   1.473 -30.723
  110   1HZ   LYS  14          1HZ       LYS  14-125.809  -0.965 -31.831
  111   2HZ   LYS  14          2HZ       LYS  14-125.295   0.358 -32.754
  112   3HZ   LYS  14          3HZ       LYS  14-126.538   0.550 -31.616
  113    H    LEU  15           H        LEU  15-119.561  -3.745 -31.344
  114    HA   LEU  15           HA       LEU  15-118.511  -3.527 -28.737
  115   1HB   LEU  15          2HB       LEU  15-117.469  -5.149 -31.063
  116   2HB   LEU  15          1HB       LEU  15-117.046  -5.387 -29.378
  117    HG   LEU  15           HG       LEU  15-119.869  -5.650 -30.398
  118   1HD1  LEU  15          1HD1      LEU  15-119.217  -7.500 -31.449
  119   2HD1  LEU  15          2HD1      LEU  15-118.948  -8.188 -29.847
  120   3HD1  LEU  15          3HD1      LEU  15-117.611  -7.443 -30.721
  121   1HD2  LEU  15          1HD2      LEU  15-118.619  -5.728 -27.811
  122   2HD2  LEU  15          2HD2      LEU  15-119.373  -7.279 -28.178
  123   3HD2  LEU  15          3HD2      LEU  15-120.330  -5.799 -28.233
  124    H    ASN  16           H        ASN  16-117.353  -2.516 -31.872
  125    HA   ASN  16           HA       ASN  16-114.688  -1.949 -31.250
  126   1HB   ASN  16          2HB       ASN  16-116.583  -1.214 -33.370
  127   2HB   ASN  16          1HB       ASN  16-115.329  -0.010 -33.084
  128   1HD2  ASN  16          1HD2      ASN  16-115.607  -3.537 -33.271
  129   2HD2  ASN  16          2HD2      ASN  16-114.204  -3.759 -34.268
  130    H    ARG  17           H        ARG  17-117.612  -0.003 -30.963
  131    HA   ARG  17           HA       ARG  17-116.414   2.385 -30.064
  132   1HB   ARG  17          2HB       ARG  17-119.165   1.251 -29.542
  133   2HB   ARG  17          1HB       ARG  17-118.678   2.885 -29.122
  134   1HG   ARG  17          2HG       ARG  17-118.891   3.622 -31.228
  135   2HG   ARG  17          1HG       ARG  17-118.233   2.137 -31.925
  136   1HD   ARG  17          2HD       ARG  17-120.313   1.601 -32.508
  137   2HD   ARG  17          1HD       ARG  17-120.649   1.364 -30.795
  138    HE   ARG  17           HE       ARG  17-121.383   3.665 -32.436
  139   1HH1  ARG  17          1HH1      ARG  17-121.316   2.166 -29.248
  140   2HH1  ARG  17          2HH1      ARG  17-122.488   3.263 -28.581
  141   1HH2  ARG  17          1HH2      ARG  17-122.942   5.084 -31.547
  142   2HH2  ARG  17          2HH2      ARG  17-123.406   4.906 -29.880
  143    H    ASN  18           H        ASN  18-117.677  -0.442 -28.373
  144    HA   ASN  18           HA       ASN  18-117.245   0.597 -25.755
  145   1HB   ASN  18          2HB       ASN  18-118.857  -1.243 -26.350
  146   2HB   ASN  18          1HB       ASN  18-117.470  -2.311 -26.548
  147   1HD2  ASN  18          1HD2      ASN  18-117.400  -3.629 -24.882
  148   2HD2  ASN  18          2HD2      ASN  18-117.576  -3.168 -23.219
  149    H    GLN  19           H        GLN  19-115.292  -1.154 -28.035
  150    HA   GLN  19           HA       GLN  19-113.196  -1.702 -26.109
  151   1HB   GLN  19          2HB       GLN  19-113.301  -2.061 -29.110
  152   2HB   GLN  19          1HB       GLN  19-111.958  -2.559 -28.093
  153   1HG   GLN  19          2HG       GLN  19-114.760  -3.640 -28.074
  154   2HG   GLN  19          1HG       GLN  19-113.290  -4.469 -28.584
  155   1HE2  GLN  19          1HE2      GLN  19-115.433  -4.018 -26.099
  156   2HE2  GLN  19          2HE2      GLN  19-114.483  -4.653 -24.799
  157    H    ARG  20           H        ARG  20-110.886  -1.158 -27.209
  158    HA   ARG  20           HA       ARG  20-109.318   0.453 -27.521
  159   1HB   ARG  20          2HB       ARG  20-111.492   1.669 -29.241
  160   2HB   ARG  20          1HB       ARG  20-109.808   2.176 -29.243
  161   1HG   ARG  20          2HG       ARG  20-109.573   0.742 -30.933
  162   2HG   ARG  20          1HG       ARG  20-109.593  -0.510 -29.690
  163   1HD   ARG  20          2HD       ARG  20-111.888  -0.951 -30.035
  164   2HD   ARG  20          1HD       ARG  20-112.103   0.517 -30.987
  165    HE   ARG  20           HE       ARG  20-110.811  -0.549 -32.755
  166   1HH1  ARG  20          1HH1      ARG  20-112.022  -2.622 -30.216
  167   2HH1  ARG  20          2HH1      ARG  20-112.019  -4.057 -31.193
  168   1HH2  ARG  20          1HH2      ARG  20-110.814  -2.426 -34.061
  169   2HH2  ARG  20          2HH2      ARG  20-111.360  -3.938 -33.399
  170    H    ARG  21           H        ARG  21-110.649   0.663 -25.159
  171    HA   ARG  21           HA       ARG  21-111.828   3.166 -24.629
  172   1HB   ARG  21          2HB       ARG  21-111.244   0.813 -23.193
  173   2HB   ARG  21          1HB       ARG  21-110.473   2.128 -22.315
  174   1HG   ARG  21          2HG       ARG  21-112.455   2.431 -21.356
  175   2HG   ARG  21          1HG       ARG  21-112.945   3.160 -22.887
  176   1HD   ARG  21          2HD       ARG  21-113.530   0.777 -23.614
  177   2HD   ARG  21          1HD       ARG  21-113.408   0.363 -21.905
  178    HE   ARG  21           HE       ARG  21-115.377   2.178 -23.113
  179   1HH1  ARG  21          1HH1      ARG  21-114.257   0.279 -20.386
  180   2HH1  ARG  21          2HH1      ARG  21-115.741   0.466 -19.493
  181   1HH2  ARG  21          1HH2      ARG  21-117.301   2.455 -21.928
  182   2HH2  ARG  21          2HH2      ARG  21-117.458   1.720 -20.360
  183    H    VAL  22           H        VAL  22-108.512   1.989 -24.099
  184    HA   VAL  22           HA       VAL  22-107.670   4.812 -23.923
  185    HB   VAL  22           HB       VAL  22-106.097   2.622 -22.602
  186   1HG1  VAL  22          1HG1      VAL  22-105.896   4.888 -21.088
  187   2HG1  VAL  22          2HG1      VAL  22-106.067   5.544 -22.715
  188   3HG1  VAL  22          3HG1      VAL  22-104.767   4.408 -22.356
  189   1HG2  VAL  22          1HG2      VAL  22-107.790   4.141 -20.778
  190   2HG2  VAL  22          2HG2      VAL  22-107.454   2.411 -20.836
  191   3HG2  VAL  22          3HG2      VAL  22-108.705   3.101 -21.870
  192    H    ASN  23           H        ASN  23-107.369   4.704 -26.240
  193    HA   ASN  23           HA       ASN  23-105.264   3.004 -27.262
  194   1HB   ASN  23          2HB       ASN  23-107.368   4.286 -28.453
  195   2HB   ASN  23          1HB       ASN  23-106.033   5.362 -28.856
  196   1HD2  ASN  23          1HD2      ASN  23-105.532   4.947 -30.898
  197   2HD2  ASN  23          2HD2      ASN  23-105.251   3.374 -31.570
  198    H    ARG  24           H        ARG  24-103.951   3.918 -25.364
  199    HA   ARG  24           HA       ARG  24-102.850   6.564 -25.795
  200   1HB   ARG  24          2HB       ARG  24-103.395   5.222 -23.533
  201   2HB   ARG  24          1HB       ARG  24-101.712   4.756 -23.735
  202   1HG   ARG  24          2HG       ARG  24-101.772   7.513 -24.167
  203   2HG   ARG  24          1HG       ARG  24-102.827   7.227 -22.782
  204   1HD   ARG  24          2HD       ARG  24-101.114   6.685 -21.446
  205   2HD   ARG  24          1HD       ARG  24-100.338   5.702 -22.687
  206    HE   ARG  24           HE       ARG  24 -99.858   8.215 -23.547
  207   1HH1  ARG  24          1HH1      ARG  24 -99.350   6.622 -20.459
  208   2HH1  ARG  24          2HH1      ARG  24 -97.993   7.626 -20.033
  209   1HH2  ARG  24          1HH2      ARG  24 -98.099   9.527 -22.986
  210   2HH2  ARG  24          2HH2      ARG  24 -97.289   9.296 -21.458
  211    H    GLY  25           H        GLY  25-100.674   7.006 -26.157
  212   1HA   GLY  25          2HA       GLY  25 -98.843   4.801 -26.672
  213   2HA   GLY  25          1HA       GLY  25 -99.247   5.810 -28.057
  214    H    GLY  26           H        GLY  26 -97.424   5.548 -25.149
  215   1HA   GLY  26          2HA       GLY  26 -95.424   7.261 -25.799
  216   2HA   GLY  26          1HA       GLY  26 -96.632   8.323 -25.092
  217    H    GLY  27           H        GLY  27 -95.073   8.799 -23.450
  218   1HA   GLY  27          2HA       GLY  27 -94.371   8.567 -21.258
  219   2HA   GLY  27          1HA       GLY  27 -95.226   7.032 -21.183
  220    HA   PRO  28           HA       PRO  28 -91.054   5.858 -23.126
  221   1HB   PRO  28          2HB       PRO  28 -89.253   7.704 -23.827
  222   2HB   PRO  28          1HB       PRO  28 -90.670   7.371 -24.833
  223   1HG   PRO  28          2HG       PRO  28 -90.208   9.606 -22.897
  224   2HG   PRO  28          1HG       PRO  28 -90.927   9.660 -24.518
  225   1HD   PRO  28          2HD       PRO  28 -92.376   9.603 -22.182
  226   2HD   PRO  28          1HD       PRO  28 -92.988   9.040 -23.750
  227    H    ARG  29           H        ARG  29 -91.449   7.663 -20.427
  228    HA   ARG  29           HA       ARG  29 -89.114   6.464 -19.176
  229   1HB   ARG  29          2HB       ARG  29 -89.232   9.249 -19.808
  230   2HB   ARG  29          1HB       ARG  29 -89.338   9.074 -18.062
  231   1HG   ARG  29          2HG       ARG  29 -87.156   8.753 -17.951
  232   2HG   ARG  29          1HG       ARG  29 -87.294   7.343 -19.004
  233   1HD   ARG  29          2HD       ARG  29 -87.328   8.986 -20.941
  234   2HD   ARG  29          1HD       ARG  29 -86.821  10.210 -19.779
  235    HE   ARG  29           HE       ARG  29 -84.724   9.260 -19.709
  236   1HH1  ARG  29          1HH1      ARG  29 -86.902   7.194 -21.507
  237   2HH1  ARG  29          2HH1      ARG  29 -85.640   6.157 -22.098
  238   1HH2  ARG  29          1HH2      ARG  29 -83.054   7.923 -20.493
  239   2HH2  ARG  29          2HH2      ARG  29 -83.443   6.579 -21.535
  240    H    ARG  30           H        ARG  30 -91.009   5.176 -18.462
  241    HA   ARG  30           HA       ARG  30 -92.722   6.480 -16.498
  242   1HB   ARG  30          2HB       ARG  30 -92.665   3.734 -17.721
  243   2HB   ARG  30          1HB       ARG  30 -93.639   4.072 -16.295
  244   1HG   ARG  30          2HG       ARG  30 -94.563   6.036 -17.730
  245   2HG   ARG  30          1HG       ARG  30 -93.945   5.085 -19.081
  246   1HD   ARG  30          2HD       ARG  30 -95.516   3.583 -17.098
  247   2HD   ARG  30          1HD       ARG  30 -96.416   4.798 -18.004
  248    HE   ARG  30           HE       ARG  30 -95.458   2.296 -18.973
  249   1HH1  ARG  30          1HH1      ARG  30 -96.185   5.592 -19.936
  250   2HH1  ARG  30          2HH1      ARG  30 -96.334   5.196 -21.624
  251   1HH2  ARG  30          1HH2      ARG  30 -95.706   1.772 -21.188
  252   2HH2  ARG  30          2HH2      ARG  30 -96.073   3.031 -22.333
  253    H    ASN  31           H        ASN  31 -89.794   4.765 -16.617
  254    HA   ASN  31           HA       ASN  31 -89.947   4.217 -13.728
  255   1HB   ASN  31          2HB       ASN  31 -89.425   2.360 -15.557
  256   2HB   ASN  31          1HB       ASN  31 -87.798   3.022 -15.434
  257   1HD2  ASN  31          1HD2      ASN  31 -89.986   0.840 -14.151
  258   2HD2  ASN  31          2HD2      ASN  31 -89.165   0.490 -12.664
  259    H    ARG  32           H        ARG  32 -86.903   3.858 -13.956
  260    HA   ARG  32           HA       ARG  32 -86.241   6.532 -13.186
  261   1HB   ARG  32          2HB       ARG  32 -85.143   3.970 -12.800
  262   2HB   ARG  32          1HB       ARG  32 -83.925   4.883 -13.682
  263   1HG   ARG  32          2HG       ARG  32 -83.293   5.690 -11.716
  264   2HG   ARG  32          1HG       ARG  32 -84.772   6.651 -11.744
  265   1HD   ARG  32          2HD       ARG  32 -84.169   4.125 -10.272
  266   2HD   ARG  32          1HD       ARG  32 -84.927   5.605  -9.694
  267    HE   ARG  32           HE       ARG  32 -86.219   3.337 -10.921
  268   1HH1  ARG  32          1HH1      ARG  32 -86.499   6.764 -10.181
  269   2HH1  ARG  32          2HH1      ARG  32 -88.240   6.765 -10.280
  270   1HH2  ARG  32          1HH2      ARG  32 -88.482   3.340 -11.039
  271   2HH2  ARG  32          2HH2      ARG  32 -89.373   4.810 -10.763
  272    HA   PRO  33           HA       PRO  33 -85.288   8.211 -17.167
  273   1HB   PRO  33          2HB       PRO  33 -83.276   9.782 -15.645
  274   2HB   PRO  33          1HB       PRO  33 -84.563  10.341 -16.717
  275   1HG   PRO  33          2HG       PRO  33 -84.787  10.597 -14.077
  276   2HG   PRO  33          1HG       PRO  33 -86.189  10.166 -15.074
  277   1HD   PRO  33          2HD       PRO  33 -84.499   8.430 -13.323
  278   2HD   PRO  33          1HD       PRO  33 -86.253   8.389 -13.599
  279    H    ALA  34           H        ALA  34 -82.588   7.511 -14.965
  280    HA   ALA  34           HA       ALA  34 -80.631   6.420 -15.230
  281   1HB   ALA  34          1HB       ALA  34 -81.444   4.606 -16.391
  282   2HB   ALA  34          2HB       ALA  34 -80.249   5.244 -17.522
  283   3HB   ALA  34          3HB       ALA  34 -81.963   5.581 -17.767
  284    H    ILE  35           H        ILE  35 -78.769   7.411 -15.416
  285    HA   ILE  35           HA       ILE  35 -78.482   9.660 -17.200
  286    HB   ILE  35           HB       ILE  35 -77.568   9.688 -14.881
  287   1HG1  ILE  35          2HG1      ILE  35 -75.169   9.990 -16.609
  288   2HG1  ILE  35          1HG1      ILE  35 -76.600  10.914 -17.055
  289   1HG2  ILE  35          1HG2      ILE  35 -75.094   8.341 -15.387
  290   2HG2  ILE  35          2HG2      ILE  35 -76.442   7.228 -15.621
  291   3HG2  ILE  35          3HG2      ILE  35 -76.261   8.086 -14.090
  292   1HD1  ILE  35          1HD1      ILE  35 -75.029  12.164 -15.628
  293   2HD1  ILE  35          2HD1      ILE  35 -75.294  10.981 -14.346
  294   3HD1  ILE  35          3HD1      ILE  35 -76.629  11.990 -14.905
  295    H    ALA  36           H        ALA  36 -77.566   6.339 -17.058
  296    HA   ALA  36           HA       ALA  36 -76.702   4.901 -18.578
  297   1HB   ALA  36          1HB       ALA  36 -78.041   6.433 -20.183
  298   2HB   ALA  36          2HB       ALA  36 -76.841   5.322 -20.841
  299   3HB   ALA  36          3HB       ALA  36 -76.450   7.032 -20.655
  300    H    ARG  37           H        ARG  37 -75.133   8.035 -19.192
  301    HA   ARG  37           HA       ARG  37 -72.549   6.794 -19.474
  302   1HB   ARG  37          2HB       ARG  37 -73.762   9.318 -20.118
  303   2HB   ARG  37          1HB       ARG  37 -72.275   9.598 -19.224
  304   1HG   ARG  37          2HG       ARG  37 -71.176   9.341 -21.127
  305   2HG   ARG  37          1HG       ARG  37 -71.631   7.637 -21.096
  306   1HD   ARG  37          2HD       ARG  37 -72.759   7.981 -22.980
  307   2HD   ARG  37          1HD       ARG  37 -73.883   8.974 -22.053
  308    HE   ARG  37           HE       ARG  37 -71.469  10.135 -23.291
  309   1HH1  ARG  37          1HH1      ARG  37 -74.949  10.067 -22.828
  310   2HH1  ARG  37          2HH1      ARG  37 -75.219  11.553 -23.699
  311   1HH2  ARG  37          1HH2      ARG  37 -71.822  12.081 -24.452
  312   2HH2  ARG  37          2HH2      ARG  37 -73.445  12.695 -24.621
  313    H    GLY  38           H        GLY  38 -71.770   9.589 -18.010
  314   1HA   GLY  38          2HA       GLY  38 -71.590   8.288 -15.365
  315   2HA   GLY  38          1HA       GLY  38 -70.227   9.129 -16.089
  316    H    GLY  39           H        GLY  39 -70.819   9.942 -13.672
  317   1HA   GLY  39          2HA       GLY  39 -70.892  12.403 -13.212
  318   2HA   GLY  39          1HA       GLY  39 -72.444  12.386 -14.036
  319    H    ARG  40           H        ARG  40 -70.954  12.320 -11.082
  320    HA   ARG  40           HA       ARG  40 -73.493  11.677  -9.803
  321   1HB   ARG  40          2HB       ARG  40 -71.055  10.065  -9.576
  322   2HB   ARG  40          1HB       ARG  40 -71.737  10.540  -8.027
  323   1HG   ARG  40          2HG       ARG  40 -72.781   8.695 -10.076
  324   2HG   ARG  40          1HG       ARG  40 -72.910   8.632  -8.316
  325   1HD   ARG  40          2HD       ARG  40 -74.565  10.485  -8.432
  326   2HD   ARG  40          1HD       ARG  40 -74.494  10.387 -10.191
  327    HE   ARG  40           HE       ARG  40 -75.932   8.672  -8.416
  328   1HH1  ARG  40          1HH1      ARG  40 -74.317   8.799 -11.528
  329   2HH1  ARG  40          2HH1      ARG  40 -75.237   7.483 -12.197
  330   1HH2  ARG  40          1HH2      ARG  40 -77.172   6.981  -9.316
  331   2HH2  ARG  40          2HH2      ARG  40 -76.866   6.467 -10.950
  332    H    ASN  41           H        ASN  41 -70.313  13.121  -9.695
  333    HA   ASN  41           HA       ASN  41 -69.495  14.935  -8.598
  334   1HB   ASN  41          2HB       ASN  41 -71.823  15.763  -9.477
  335   2HB   ASN  41          1HB       ASN  41 -72.266  15.732  -7.775
  336   1HD2  ASN  41          1HD2      ASN  41 -72.392  17.821  -7.288
  337   2HD2  ASN  41          2HD2      ASN  41 -71.106  18.970  -7.492
  338    H    ARG  42           H        ARG  42 -68.910  13.014  -7.089
  339    HA   ARG  42           HA       ARG  42 -69.261  13.812  -4.396
  340   1HB   ARG  42          2HB       ARG  42 -71.420  12.360  -5.301
  341   2HB   ARG  42          1HB       ARG  42 -70.417  11.135  -4.547
  342   1HG   ARG  42          2HG       ARG  42 -70.354  12.426  -2.485
  343   2HG   ARG  42          1HG       ARG  42 -71.381  13.658  -3.223
  344   1HD   ARG  42          2HD       ARG  42 -72.833  11.408  -3.681
  345   2HD   ARG  42          1HD       ARG  42 -72.068  11.011  -2.144
  346    HE   ARG  42           HE       ARG  42 -74.122  12.980  -2.621
  347   1HH1  ARG  42          1HH1      ARG  42 -71.568  11.920  -0.454
  348   2HH1  ARG  42          2HH1      ARG  42 -72.197  12.806   0.910
  349   1HH2  ARG  42          1HH2      ARG  42 -74.945  14.120  -0.828
  350   2HH2  ARG  42          2HH2      ARG  42 -74.119  14.040   0.697
  351    HA   PRO  43           HA       PRO  43 -67.188   9.483  -4.222
  352   1HB   PRO  43          2HB       PRO  43 -66.848   8.680  -7.047
  353   2HB   PRO  43          1HB       PRO  43 -67.434   7.740  -5.670
  354   1HG   PRO  43          2HG       PRO  43 -69.107   8.577  -7.575
  355   2HG   PRO  43          1HG       PRO  43 -69.596   8.549  -5.870
  356   1HD   PRO  43          2HD       PRO  43 -68.702  10.869  -7.545
  357   2HD   PRO  43          1HD       PRO  43 -70.045  10.780  -6.378
  358    H    ALA  44           H        ALA  44 -66.291  11.868  -6.532
  359    HA   ALA  44           HA       ALA  44 -63.545  11.103  -6.799
  360   1HB   ALA  44          1HB       ALA  44 -63.496  12.714  -8.335
  361   2HB   ALA  44          2HB       ALA  44 -64.035  13.931  -7.178
  362   3HB   ALA  44          3HB       ALA  44 -65.219  12.941  -8.034
  363    HA   PRO  45           HA       PRO  45 -62.231  11.987  -2.642
  364   1HB   PRO  45          2HB       PRO  45 -59.736  12.636  -4.166
  365   2HB   PRO  45          1HB       PRO  45 -59.935  11.674  -2.697
  366   1HG   PRO  45          2HG       PRO  45 -59.608  10.487  -5.053
  367   2HG   PRO  45          1HG       PRO  45 -60.737   9.831  -3.854
  368   1HD   PRO  45          2HD       PRO  45 -61.296  11.277  -6.385
  369   2HD   PRO  45          1HD       PRO  45 -62.266  10.054  -5.543
  370    H    TYR  46           H        TYR  46 -60.879  14.198  -5.108
  371    HA   TYR  46           HA       TYR  46 -62.015  16.445  -3.630
  372   1HB   TYR  46          2HB       TYR  46 -59.357  15.827  -3.323
  373   2HB   TYR  46          1HB       TYR  46 -59.335  17.014  -4.621
  374    HD1  TYR  46           1HD      TYR  46 -60.058  16.444  -1.085
  375    HD2  TYR  46           2HD      TYR  46 -60.041  19.311  -4.229
  376    HE1  TYR  46           1HE      TYR  46 -60.262  18.250   0.569
  377    HE2  TYR  46           2HE      TYR  46 -60.246  21.125  -2.582
  378    HH   TYR  46           HH       TYR  46 -59.495  20.984   0.399
  379    H    SER  47           H        SER  47 -63.421  16.374  -5.390
  380    HA   SER  47           HA       SER  47 -64.310  17.160  -7.324
  381   1HB   SER  47          2HB       SER  47 -61.609  18.484  -7.646
  382   2HB   SER  47          1HB       SER  47 -62.973  18.744  -8.733
  383    HG   SER  47           HG       SER  47 -62.467  19.872  -6.328
  384    H    ARG  48           H        ARG  48 -61.072  15.812  -7.597
  385    HA   ARG  48           HA       ARG  48 -62.027  14.096  -9.777
  386   1HB   ARG  48          2HB       ARG  48 -60.183  16.187 -10.111
  387   2HB   ARG  48          1HB       ARG  48 -59.211  14.725 -10.045
  388   1HG   ARG  48          2HG       ARG  48 -60.370  13.780 -11.900
  389   2HG   ARG  48          1HG       ARG  48 -61.569  15.076 -11.877
  390   1HD   ARG  48          2HD       ARG  48 -58.651  15.274 -12.595
  391   2HD   ARG  48          1HD       ARG  48 -60.041  15.547 -13.646
  392    HE   ARG  48           HE       ARG  48 -59.151  17.323 -11.468
  393   1HH1  ARG  48          1HH1      ARG  48 -60.955  16.759 -14.422
  394   2HH1  ARG  48          2HH1      ARG  48 -61.451  18.418 -14.585
  395   1HH2  ARG  48          1HH2      ARG  48 -59.808  19.507 -11.670
  396   2HH2  ARG  48          2HH2      ARG  48 -60.804  19.978 -13.023
  397    HA   PRO  49           HA       PRO  49 -60.031  10.876  -7.367
  398   1HB   PRO  49          2HB       PRO  49 -59.277   9.221  -9.418
  399   2HB   PRO  49          1HB       PRO  49 -60.913   9.281  -8.754
  400   1HG   PRO  49          2HG       PRO  49 -59.815  10.595 -11.207
  401   2HG   PRO  49          1HG       PRO  49 -61.370   9.773 -10.975
  402   1HD   PRO  49          2HD       PRO  49 -61.177  12.451 -10.963
  403   2HD   PRO  49          1HD       PRO  49 -62.317  11.594  -9.904
  404    H    LYS  50           H        LYS  50 -57.933  10.098  -6.905
  405    HA   LYS  50           HA       LYS  50 -55.780  11.583  -8.252
  406   1HB   LYS  50          2HB       LYS  50 -54.708  10.570  -5.917
  407   2HB   LYS  50          1HB       LYS  50 -55.208  12.230  -6.194
  408   1HG   LYS  50          2HG       LYS  50 -57.567  11.172  -5.488
  409   2HG   LYS  50          1HG       LYS  50 -56.482  10.106  -4.593
  410   1HD   LYS  50          2HD       LYS  50 -55.962  13.025  -4.458
  411   2HD   LYS  50          1HD       LYS  50 -57.366  12.404  -3.587
  412   1HE   LYS  50          2HE       LYS  50 -55.984  10.874  -2.345
  413   2HE   LYS  50          1HE       LYS  50 -54.570  11.313  -3.304
  414   1HZ   LYS  50          1HZ       LYS  50 -56.050  13.071  -1.423
  415   2HZ   LYS  50          2HZ       LYS  50 -54.776  13.586  -2.422
  416   3HZ   LYS  50          3HZ       LYS  50 -54.490  12.436  -1.208
  417    HA   PRO  51           HA       PRO  51 -54.317   7.634  -9.556
  418   1HB   PRO  51          2HB       PRO  51 -52.025   8.420 -10.723
  419   2HB   PRO  51          1HB       PRO  51 -53.606   8.790 -11.420
  420   1HG   PRO  51          2HG       PRO  51 -51.751  10.546  -9.886
  421   2HG   PRO  51          1HG       PRO  51 -52.806  10.945 -11.252
  422   1HD   PRO  51          2HD       PRO  51 -53.363  11.450  -8.571
  423   2HD   PRO  51          1HD       PRO  51 -54.559  11.416  -9.883
  424    H    LEU  52           H        LEU  52 -52.488   9.730  -7.468
  425    HA   LEU  52           HA       LEU  52 -50.936   9.398  -5.861
  426   1HB   LEU  52          2HB       LEU  52 -52.001   6.593  -5.842
  427   2HB   LEU  52          1HB       LEU  52 -51.200   7.417  -4.516
  428    HG   LEU  52           HG       LEU  52 -53.607   8.781  -5.483
  429   1HD1  LEU  52          1HD1      LEU  52 -54.925   6.995  -5.643
  430   2HD1  LEU  52          2HD1      LEU  52 -54.738   6.820  -3.899
  431   3HD1  LEU  52          3HD1      LEU  52 -53.684   5.925  -4.994
  432   1HD2  LEU  52          1HD2      LEU  52 -53.499   9.588  -3.422
  433   2HD2  LEU  52          2HD2      LEU  52 -52.056   8.609  -3.149
  434   3HD2  LEU  52          3HD2      LEU  52 -53.647   7.970  -2.738
  435    HA   PRO  53           HA       PRO  53 -47.976   7.761  -9.037
  436   1HB   PRO  53          2HB       PRO  53 -45.943   9.353  -7.960
  437   2HB   PRO  53          1HB       PRO  53 -46.961   9.762  -9.344
  438   1HG   PRO  53          2HG       PRO  53 -47.218  10.586  -6.488
  439   2HG   PRO  53          1HG       PRO  53 -47.551  11.515  -7.962
  440   1HD   PRO  53          2HD       PRO  53 -49.540  10.491  -6.493
  441   2HD   PRO  53          1HD       PRO  53 -49.629  10.518  -8.268
  442    H    ASP  54           H        ASP  54 -46.933   8.562  -5.715
  443    HA   ASP  54           HA       ASP  54 -45.659   7.437  -4.195
  444   1HB   ASP  54          2HB       ASP  54 -47.860   5.764  -5.022
  445   2HB   ASP  54          1HB       ASP  54 -46.487   4.772  -4.537
  446    H    LYS  55           H        LYS  55 -43.713   7.826  -5.489
  447    HA   LYS  55           HA       LYS  55 -42.800   5.505  -7.039
  448   1HB   LYS  55          2HB       LYS  55 -41.914   8.390  -7.056
  449   2HB   LYS  55          1HB       LYS  55 -41.112   7.116  -7.965
  450   1HG   LYS  55          2HG       LYS  55 -44.033   7.715  -8.297
  451   2HG   LYS  55          1HG       LYS  55 -42.782   8.556  -9.214
  452   1HD   LYS  55          2HD       LYS  55 -42.404   6.787 -10.543
  453   2HD   LYS  55          1HD       LYS  55 -42.504   5.642  -9.203
  454   1HE   LYS  55          2HE       LYS  55 -45.046   6.903  -9.966
  455   2HE   LYS  55          1HE       LYS  55 -44.336   5.853 -11.190
  456   1HZ   LYS  55          1HZ       LYS  55 -45.693   5.143  -8.814
  457   2HZ   LYS  55          2HZ       LYS  55 -44.120   4.502  -8.781
  458   3HZ   LYS  55          3HZ       LYS  55 -45.154   4.146 -10.075
  459    H    TRP  56           H        TRP  56 -40.744   4.644  -6.774
  460    HA   TRP  56           HA       TRP  56 -39.421   5.266  -4.223
  461   1HB   TRP  56          2HB       TRP  56 -38.391   2.921  -5.603
  462   2HB   TRP  56          1HB       TRP  56 -39.037   3.062  -3.973
  463    HD1  TRP  56           HD       TRP  56 -39.809   1.597  -7.295
  464    HE1  TRP  56           1HE      TRP  56 -42.187   0.595  -7.314
  465    HE3  TRP  56           3HE      TRP  56 -41.550   3.597  -2.922
  466    HZ2  TRP  56           2HZ      TRP  56 -44.486   0.653  -5.672
  467    HZ3  TRP  56           3HZ      TRP  56 -43.847   3.073  -2.219
  468    HH2  TRP  56           HH       TRP  56 -45.283   1.632  -3.566
  469    H    GLN  57           H        GLN  57 -37.485   6.249  -4.273
  470    HA   GLN  57           HA       GLN  57 -36.457   6.890  -6.936
  471   1HB   GLN  57          2HB       GLN  57 -35.712   8.915  -6.096
  472   2HB   GLN  57          1HB       GLN  57 -37.183   8.642  -5.177
  473   1HG   GLN  57          2HG       GLN  57 -35.529   7.553  -3.457
  474   2HG   GLN  57          1HG       GLN  57 -34.347   8.559  -4.294
  475   1HE2  GLN  57          1HE2      GLN  57 -37.668   8.876  -3.065
  476   2HE2  GLN  57          2HE2      GLN  57 -37.409  10.418  -2.306
  477    H    HIS  58           H        HIS  58 -35.509   5.340  -3.954
  478    HA   HIS  58           HA       HIS  58 -33.557   4.427  -3.215
  479   1HB   HIS  58          2HB       HIS  58 -33.978   2.774  -4.873
  480   2HB   HIS  58          1HB       HIS  58 -33.451   3.831  -6.172
  481    HD1  HIS  58           1HD      HIS  58 -31.508   2.974  -3.001
  482    HD2  HIS  58           2HD      HIS  58 -31.312   2.474  -7.128
  483    HE1  HIS  58           1HE      HIS  58 -29.254   1.963  -3.458
  484    HE2  HIS  58           2HE      HIS  58 -29.082   1.863  -5.973
  485    H    ASP  59           H        ASP  59 -33.043   6.786  -2.796
  486    HA   ASP  59           HA       ASP  59 -31.332   8.221  -2.374
  487   1HB   ASP  59          2HB       ASP  59 -29.856   6.162  -3.966
  488   2HB   ASP  59          1HB       ASP  59 -29.077   7.696  -3.598
  489    H    LEU  60           H        LEU  60 -31.977   7.368  -5.696
  490    HA   LEU  60           HA       LEU  60 -32.447   8.648  -7.507
  491   1HB   LEU  60          2HB       LEU  60 -32.250  10.731  -5.423
  492   2HB   LEU  60          1HB       LEU  60 -32.033  11.265  -7.079
  493    HG   LEU  60           HG       LEU  60 -34.441   9.869  -5.928
  494   1HD1  LEU  60          1HD1      LEU  60 -35.348  12.124  -7.069
  495   2HD1  LEU  60          2HD1      LEU  60 -33.742  12.657  -6.577
  496   3HD1  LEU  60          3HD1      LEU  60 -34.864  12.012  -5.377
  497   1HD2  LEU  60          1HD2      LEU  60 -35.358   9.653  -8.028
  498   2HD2  LEU  60          2HD2      LEU  60 -33.663   9.270  -8.339
  499   3HD2  LEU  60          3HD2      LEU  60 -34.292  10.869  -8.736
  500    H    PHE  61           H        PHE  61 -29.791  10.318  -5.821
  501    HA   PHE  61           HA       PHE  61 -28.182  10.145  -8.264
  502   1HB   PHE  61          2HB       PHE  61 -28.434  12.133  -6.380
  503   2HB   PHE  61          1HB       PHE  61 -26.945  11.335  -5.883
  504    HD1  PHE  61           1HD      PHE  61 -25.000  12.189  -6.735
  505    HD2  PHE  61           2HD      PHE  61 -28.559  12.486  -9.047
  506    HE1  PHE  61           1HE      PHE  61 -23.764  13.414  -8.475
  507    HE2  PHE  61           2HE      PHE  61 -27.330  13.711 -10.791
  508    HZ   PHE  61           HZ       PHE  61 -24.925  14.179 -10.501
  509    H    ASP  62           H        ASP  62 -28.963   7.974  -6.360
  510    HA   ASP  62           HA       ASP  62 -28.147   6.027  -5.573
  511   1HB   ASP  62          2HB       ASP  62 -26.495   6.485  -7.628
  512   2HB   ASP  62          1HB       ASP  62 -25.323   6.600  -6.319
  513    H    SER  63           H        SER  63 -26.244   5.170  -4.082
  514    HA   SER  63           HA       SER  63 -26.328   6.886  -1.772
  515   1HB   SER  63          2HB       SER  63 -24.731   4.353  -1.867
  516   2HB   SER  63          1HB       SER  63 -25.712   5.009  -0.554
  517    HG   SER  63           HG       SER  63 -27.578   4.555  -1.933
  518    H    GLY  64           H        GLY  64 -24.376   6.810  -4.405
  519   1HA   GLY  64          2HA       GLY  64 -22.633   8.749  -3.672
  520   2HA   GLY  64          1HA       GLY  64 -21.840   7.279  -3.119
  521    H    CYS  65           H        CYS  65 -23.601   8.335  -6.044
  522    HA   CYS  65           HA       CYS  65 -21.893   6.759  -7.741
  523   1HB   CYS  65          2HB       CYS  65 -24.351   8.299  -8.017
  524   2HB   CYS  65          1HB       CYS  65 -23.252   8.571  -9.365
  525    HG   CYS  65           HG       CYS  65 -23.429   5.339  -8.730
  526    H    GLY  66           H        GLY  66 -19.805   7.423  -7.845
  527   1HA   GLY  66          2HA       GLY  66 -19.334  10.150  -8.809
  528   2HA   GLY  66          1HA       GLY  66 -18.525   9.652  -7.332
  529    H    GLY  67           H        GLY  67 -16.703   8.458  -7.446
  530   1HA   GLY  67          2HA       GLY  67 -15.859   6.722  -9.395
  531   2HA   GLY  67          1HA       GLY  67 -15.389   8.309  -9.988
  532    H    GLY  68           H        GLY  68 -13.189   7.938  -9.820
  533   1HA   GLY  68          2HA       GLY  68 -11.174   8.164  -8.731
  534   2HA   GLY  68          1HA       GLY  68 -12.065   8.482  -7.250
  535    H    GLU  69           H        GLU  69 -11.768   7.074  -5.698
  536    HA   GLU  69           HA       GLU  69 -11.206   5.218  -4.535
  537   1HB   GLU  69          2HB       GLU  69 -12.400   3.994  -7.003
  538   2HB   GLU  69          1HB       GLU  69 -11.697   2.976  -5.752
  539   1HG   GLU  69          2HG       GLU  69 -13.680   5.039  -4.949
  540   2HG   GLU  69          1HG       GLU  69 -14.254   3.583  -5.764
  541    H    GLY  70           H        GLY  70  -9.990   2.821  -5.201
  542   1HA   GLY  70          2HA       GLY  70  -7.322   3.810  -5.763
  543   2HA   GLY  70          1HA       GLY  70  -7.745   2.197  -5.213
  544    H    VAL  71           H        VAL  71  -9.297   3.623  -7.959
  545    HA   VAL  71           HA       VAL  71  -7.815   1.830  -9.723
  546    HB   VAL  71           HB       VAL  71 -10.182   2.043 -11.020
  547   1HG1  VAL  71          1HG1      VAL  71  -8.862   0.045  -9.349
  548   2HG1  VAL  71          2HG1      VAL  71  -9.600  -0.116 -10.942
  549   3HG1  VAL  71          3HG1      VAL  71 -10.603  -0.189  -9.493
  550   1HG2  VAL  71          1HG2      VAL  71 -11.076   1.607  -8.200
  551   2HG2  VAL  71          2HG2      VAL  71 -12.023   2.048  -9.621
  552   3HG2  VAL  71          3HG2      VAL  71 -10.982   3.245  -8.847
  553    H    GLU  72           H        GLU  72  -9.942   4.614  -9.688
  554    HA   GLU  72           HA       GLU  72  -8.779   5.702 -12.106
  555   1HB   GLU  72          2HB       GLU  72 -11.202   5.915 -11.592
  556   2HB   GLU  72          1HB       GLU  72 -10.796   6.902 -10.197
  557   1HG   GLU  72          2HG       GLU  72  -9.576   8.376 -11.980
  558   2HG   GLU  72          1HG       GLU  72 -10.682   7.565 -13.092
  559    H    THR  73           H        THR  73  -8.725   6.242  -8.649
  560    HA   THR  73           HA       THR  73  -6.687   8.318  -8.954
  561    HB   THR  73           HB       THR  73  -7.960   7.344  -6.393
  562    HG1  THR  73           1HG      THR  73  -8.836   9.276  -8.287
  563   1HG2  THR  73          1HG2      THR  73  -7.141  10.123  -6.575
  564   2HG2  THR  73          2HG2      THR  73  -5.802   9.008  -6.839
  565   3HG2  THR  73          3HG2      THR  73  -6.752   8.909  -5.357
  566    H    GLY  74           H        GLY  74  -4.571   7.979  -8.294
  567   1HA   GLY  74          2HA       GLY  74  -3.913   5.436  -7.018
  568   2HA   GLY  74          1HA       GLY  74  -3.304   5.685  -8.647
  569    H    ALA  75           H        ALA  75  -2.382   5.738  -5.576
  570    HA   ALA  75           HA       ALA  75  -0.230   7.650  -6.222
  571   1HB   ALA  75          1HB       ALA  75  -0.735   6.879  -3.390
  572   2HB   ALA  75          2HB       ALA  75  -1.831   8.039  -4.145
  573   3HB   ALA  75          3HB       ALA  75  -0.103   8.385  -4.055
  574    H    LYS  76           H        LYS  76   1.519   6.529  -6.838
  575    HA   LYS  76           HA       LYS  76   1.836   3.791  -5.820
  576   1HB   LYS  76          2HB       LYS  76   1.805   3.601  -8.124
  577   2HB   LYS  76          1HB       LYS  76   2.577   5.159  -8.373
  578   1HG   LYS  76          2HG       LYS  76   4.616   4.259  -8.443
  579   2HG   LYS  76          1HG       LYS  76   4.311   3.233  -7.041
  580   1HD   LYS  76          2HD       LYS  76   2.799   1.936  -8.800
  581   2HD   LYS  76          1HD       LYS  76   3.936   2.670  -9.936
  582   1HE   LYS  76          2HE       LYS  76   5.791   1.743  -8.514
  583   2HE   LYS  76          1HE       LYS  76   4.564   0.852  -7.615
  584   1HZ   LYS  76          1HZ       LYS  76   5.549  -0.532  -9.316
  585   2HZ   LYS  76          2HZ       LYS  76   5.138   0.589 -10.522
  586   3HZ   LYS  76          3HZ       LYS  76   3.919  -0.245  -9.683
  587    H    LEU  77           H        LEU  77   3.418   3.316  -4.493
  588    HA   LEU  77           HA       LEU  77   5.632   5.240  -4.164
  589   1HB   LEU  77          2HB       LEU  77   4.377   5.207  -2.173
  590   2HB   LEU  77          1HB       LEU  77   4.112   3.485  -2.255
  591    HG   LEU  77           HG       LEU  77   5.585   4.305  -0.390
  592   1HD1  LEU  77          1HD1      LEU  77   5.543   1.980  -1.028
  593   2HD1  LEU  77          2HD1      LEU  77   7.162   2.476  -0.533
  594   3HD1  LEU  77          3HD1      LEU  77   6.786   2.274  -2.245
  595   1HD2  LEU  77          1HD2      LEU  77   8.043   4.553  -1.142
  596   2HD2  LEU  77          2HD2      LEU  77   6.964   5.944  -1.272
  597   3HD2  LEU  77          3HD2      LEU  77   7.353   4.990  -2.705
  598    H    LEU  78           H        LEU  78   7.632   4.528  -4.640
  599    HA   LEU  78           HA       LEU  78   8.080   1.613  -4.762
  600   1HB   LEU  78          2HB       LEU  78   9.472   3.865  -6.209
  601   2HB   LEU  78          1HB       LEU  78   9.998   2.194  -6.252
  602    HG   LEU  78           HG       LEU  78   7.235   2.948  -7.150
  603   1HD1  LEU  78          1HD1      LEU  78   9.761   3.670  -8.385
  604   2HD1  LEU  78          2HD1      LEU  78   8.120   4.183  -8.777
  605   3HD1  LEU  78          3HD1      LEU  78   8.752   2.675  -9.436
  606   1HD2  LEU  78          1HD2      LEU  78   7.968   0.935  -8.704
  607   2HD2  LEU  78          2HD2      LEU  78   7.330   0.663  -7.083
  608   3HD2  LEU  78          3HD2      LEU  78   9.070   0.615  -7.365
  609    H    VAL  79           H        VAL  79   8.966   1.040  -2.855
  610    HA   VAL  79           HA       VAL  79  11.165   2.682  -1.798
  611    HB   VAL  79           HB       VAL  79  10.971   1.124   0.212
  612   1HG1  VAL  79          1HG1      VAL  79   8.628   2.294   0.779
  613   2HG1  VAL  79          2HG1      VAL  79   9.138   3.275  -0.596
  614   3HG1  VAL  79          3HG1      VAL  79  10.179   3.134   0.822
  615   1HG2  VAL  79          1HG2      VAL  79   9.478  -0.508   0.239
  616   2HG2  VAL  79          2HG2      VAL  79   9.205  -0.183  -1.472
  617   3HG2  VAL  79          3HG2      VAL  79   8.186   0.586  -0.257
  618    H    SER  80           H        SER  80  13.187   2.022  -2.186
  619    HA   SER  80           HA       SER  80  13.673  -0.885  -2.231
  620   1HB   SER  80          2HB       SER  80  15.410   1.005  -3.790
  621   2HB   SER  80          1HB       SER  80  15.159  -0.725  -4.023
  622    HG   SER  80           HG       SER  80  12.842   0.641  -4.283
  623    H    ASN  81           H        ASN  81  14.791  -1.434  -0.488
  624    HA   ASN  81           HA       ASN  81  17.298  -0.173   0.054
  625   1HB   ASN  81          2HB       ASN  81  16.914   0.568   2.318
  626   2HB   ASN  81          1HB       ASN  81  15.762   1.366   1.258
  627   1HD2  ASN  81          1HD2      ASN  81  15.781   0.744   4.174
  628   2HD2  ASN  81          2HD2      ASN  81  14.274  -0.050   4.469
  629    H    LEU  82           H        LEU  82  14.828  -2.297   1.479
  630    HA   LEU  82           HA       LEU  82  14.892  -4.440   2.206
  631   1HB   LEU  82          2HB       LEU  82  16.179  -4.933   0.166
  632   2HB   LEU  82          1HB       LEU  82  17.663  -4.551   1.017
  633    HG   LEU  82           HG       LEU  82  16.517  -6.466   2.634
  634   1HD1  LEU  82          1HD1      LEU  82  15.302  -6.692   0.073
  635   2HD1  LEU  82          2HD1      LEU  82  15.101  -7.720   1.493
  636   3HD1  LEU  82          3HD1      LEU  82  16.370  -8.074   0.319
  637   1HD2  LEU  82          1HD2      LEU  82  18.199  -7.925   1.085
  638   2HD2  LEU  82          2HD2      LEU  82  18.712  -6.854   2.389
  639   3HD2  LEU  82          3HD2      LEU  82  18.733  -6.285   0.720
  640    H    ASP  83           H        ASP  83  18.225  -3.274   2.624
  641    HA   ASP  83           HA       ASP  83  19.624  -3.187   4.387
  642   1HB   ASP  83          2HB       ASP  83  17.891  -1.655   5.289
  643   2HB   ASP  83          1HB       ASP  83  17.127  -3.022   6.089
  644    H    PHE  84           H        PHE  84  17.299  -4.807   6.486
  645    HA   PHE  84           HA       PHE  84  19.055  -7.117   6.578
  646   1HB   PHE  84          2HB       PHE  84  18.196  -7.491   8.634
  647   2HB   PHE  84          1HB       PHE  84  17.505  -5.883   8.486
  648    HD1  PHE  84           1HD      PHE  84  16.832  -9.454   8.549
  649    HD2  PHE  84           2HD      PHE  84  15.129  -5.603   7.923
  650    HE1  PHE  84           1HE      PHE  84  14.582 -10.410   8.810
  651    HE2  PHE  84           2HE      PHE  84  12.876  -6.555   8.184
  652    HZ   PHE  84           HZ       PHE  84  12.597  -8.960   8.604
  653    H    GLY  85           H        GLY  85  16.012  -6.154   5.233
  654   1HA   GLY  85          2HA       GLY  85  15.381  -7.554   3.239
  655   2HA   GLY  85          1HA       GLY  85  15.523  -8.924   4.336
  656    H    VAL  86           H        VAL  86  13.928  -5.742   4.264
  657    HA   VAL  86           HA       VAL  86  11.845  -6.391   6.009
  658    HB   VAL  86           HB       VAL  86  10.610  -4.527   4.563
  659   1HG1  VAL  86          1HG1      VAL  86  12.042  -2.829   5.887
  660   2HG1  VAL  86          2HG1      VAL  86  12.829  -4.263   6.551
  661   3HG1  VAL  86          3HG1      VAL  86  11.094  -4.027   6.771
  662   1HG2  VAL  86          1HG2      VAL  86  13.425  -3.695   4.025
  663   2HG2  VAL  86          2HG2      VAL  86  11.928  -3.178   3.248
  664   3HG2  VAL  86          3HG2      VAL  86  12.609  -4.764   2.884
  665    H    SER  87           H        SER  87  10.443  -7.986   5.761
  666    HA   SER  87           HA       SER  87   9.780  -9.233   3.372
  667   1HB   SER  87          2HB       SER  87   7.784  -9.398   5.519
  668   2HB   SER  87          1HB       SER  87   8.737 -10.677   4.763
  669    HG   SER  87           HG       SER  87   9.240  -9.197   7.055
  670    H    ASP  88           H        ASP  88   7.526  -9.476   2.540
  671    HA   ASP  88           HA       ASP  88   6.526  -7.011   1.634
  672   1HB   ASP  88          2HB       ASP  88   5.279  -8.262   0.233
  673   2HB   ASP  88          1HB       ASP  88   6.247  -9.595   0.844
  674    H    ALA  89           H        ALA  89   5.628  -9.057   4.335
  675    HA   ALA  89           HA       ALA  89   3.323  -7.503   5.046
  676   1HB   ALA  89          1HB       ALA  89   2.931  -9.189   6.446
  677   2HB   ALA  89          2HB       ALA  89   4.477  -8.950   7.261
  678   3HB   ALA  89          3HB       ALA  89   4.386  -9.962   5.819
  679    H    ASP  90           H        ASP  90   6.737  -7.427   5.734
  680    HA   ASP  90           HA       ASP  90   6.655  -5.772   8.035
  681   1HB   ASP  90          2HB       ASP  90   8.709  -6.752   6.171
  682   2HB   ASP  90          1HB       ASP  90   9.065  -5.175   6.867
  683    H    ILE  91           H        ILE  91   7.630  -4.941   4.711
  684    HA   ILE  91           HA       ILE  91   7.535  -2.192   4.999
  685    HB   ILE  91           HB       ILE  91   8.509  -3.409   3.054
  686   1HG1  ILE  91          2HG1      ILE  91   7.802  -1.674   1.360
  687   2HG1  ILE  91          1HG1      ILE  91   6.614  -1.115   2.534
  688   1HG2  ILE  91          1HG2      ILE  91   5.621  -3.773   2.372
  689   2HG2  ILE  91          2HG2      ILE  91   6.935  -4.948   2.340
  690   3HG2  ILE  91          3HG2      ILE  91   6.844  -3.694   1.104
  691   1HD1  ILE  91          1HD1      ILE  91   8.959   0.024   2.333
  692   2HD1  ILE  91          2HD1      ILE  91   9.462  -1.316   3.363
  693   3HD1  ILE  91          3HD1      ILE  91   8.201  -0.211   3.908
  694    H    GLN  92           H        GLN  92   4.873  -4.404   4.245
  695    HA   GLN  92           HA       GLN  92   2.920  -2.474   3.661
  696   1HB   GLN  92          2HB       GLN  92   2.444  -4.766   3.179
  697   2HB   GLN  92          1HB       GLN  92   2.727  -5.244   4.846
  698   1HG   GLN  92          2HG       GLN  92   0.655  -3.288   4.785
  699   2HG   GLN  92          1HG       GLN  92   0.291  -4.552   3.612
  700   1HE2  GLN  92          1HE2      GLN  92   0.549  -3.731   6.937
  701   2HE2  GLN  92          2HE2      GLN  92  -0.006  -5.239   7.583
  702    H    GLU  93           H        GLU  93   3.611  -4.145   6.718
  703    HA   GLU  93           HA       GLU  93   1.867  -2.700   8.335
  704   1HB   GLU  93          2HB       GLU  93   4.142  -4.481   8.722
  705   2HB   GLU  93          1HB       GLU  93   4.000  -3.275   9.996
  706   1HG   GLU  93          2HG       GLU  93   1.689  -4.972   9.112
  707   2HG   GLU  93          1HG       GLU  93   2.815  -5.471  10.374
  708    H    LEU  94           H        LEU  94   5.199  -1.994   7.404
  709    HA   LEU  94           HA       LEU  94   5.554   0.203   9.136
  710   1HB   LEU  94          2HB       LEU  94   7.434  -0.938   8.104
  711   2HB   LEU  94          1HB       LEU  94   6.887  -0.454   6.510
  712    HG   LEU  94           HG       LEU  94   7.162   1.975   7.506
  713   1HD1  LEU  94          1HD1      LEU  94   8.480   2.249   9.312
  714   2HD1  LEU  94          2HD1      LEU  94   9.469   0.836   8.941
  715   3HD1  LEU  94          3HD1      LEU  94   7.899   0.634   9.717
  716   1HD2  LEU  94          1HD2      LEU  94   9.029   2.143   6.225
  717   2HD2  LEU  94          2HD2      LEU  94   8.483   0.555   5.687
  718   3HD2  LEU  94          3HD2      LEU  94   9.759   0.684   6.897
  719    H    PHE  95           H        PHE  95   5.121   0.296   5.608
  720    HA   PHE  95           HA       PHE  95   4.464   2.969   5.502
  721   1HB   PHE  95          2HB       PHE  95   4.538   0.842   3.640
  722   2HB   PHE  95          1HB       PHE  95   3.040   1.741   3.386
  723    HD1  PHE  95           1HD      PHE  95   3.114   4.157   2.900
  724    HD2  PHE  95           2HD      PHE  95   6.646   1.803   3.151
  725    HE1  PHE  95           1HE      PHE  95   4.360   5.904   1.699
  726    HE2  PHE  95           2HE      PHE  95   7.901   3.548   1.960
  727    HZ   PHE  95           HZ       PHE  95   6.766   5.680   1.363
  728    H    ALA  96           H        ALA  96   2.267   0.376   6.401
  729    HA   ALA  96           HA       ALA  96  -0.100   1.962   6.293
  730   1HB   ALA  96          1HB       ALA  96   0.447  -0.239   8.278
  731   2HB   ALA  96          2HB       ALA  96   0.014  -0.548   6.596
  732   3HB   ALA  96          3HB       ALA  96  -1.114   0.300   7.656
  733    H    GLU  97           H        GLU  97   2.334   1.401   8.636
  734    HA   GLU  97           HA       GLU  97   1.409   3.158  10.678
  735   1HB   GLU  97          2HB       GLU  97   3.759   1.599  10.200
  736   2HB   GLU  97          1HB       GLU  97   4.251   3.226  10.660
  737   1HG   GLU  97          2HG       GLU  97   2.129   1.980  12.287
  738   2HG   GLU  97          1HG       GLU  97   3.746   1.287  12.422
  739    H    PHE  98           H        PHE  98   3.503   3.610   7.886
  740    HA   PHE  98           HA       PHE  98   3.917   6.394   8.152
  741   1HB   PHE  98          2HB       PHE  98   4.227   4.395   5.956
  742   2HB   PHE  98          1HB       PHE  98   4.322   6.104   5.563
  743    HD1  PHE  98           1HD      PHE  98   5.510   5.854   8.806
  744    HD2  PHE  98           2HD      PHE  98   6.596   4.924   4.800
  745    HE1  PHE  98           1HE      PHE  98   7.885   5.870   9.448
  746    HE2  PHE  98           2HE      PHE  98   8.971   4.928   5.437
  747    HZ   PHE  98           HZ       PHE  98   9.619   5.402   7.763
  748    H    GLY  99           H        GLY  99   1.031   4.898   7.588
  749   1HA   GLY  99          2HA       GLY  99  -0.656   6.832   7.103
  750   2HA   GLY  99          1HA       GLY  99   0.144   6.828   5.545
  751    H    THR 100           H        THR 100  -2.281   6.597   5.157
  752    HA   THR 100           HA       THR 100  -3.567   4.117   5.583
  753    HB   THR 100           HB       THR 100  -4.641   5.455   3.294
  754    HG1  THR 100           1HG      THR 100  -3.631   7.345   3.846
  755   1HG2  THR 100          1HG2      THR 100  -6.364   4.637   4.476
  756   2HG2  THR 100          2HG2      THR 100  -6.228   6.094   5.461
  757   3HG2  THR 100          3HG2      THR 100  -5.427   4.607   5.971
  758    H    LEU 101           H        LEU 101  -2.715   2.297   4.765
  759    HA   LEU 101           HA       LEU 101  -1.571   2.353   2.080
  760   1HB   LEU 101          2HB       LEU 101  -0.616   1.180   4.277
  761   2HB   LEU 101          1HB       LEU 101  -1.587  -0.150   3.671
  762    HG   LEU 101           HG       LEU 101  -0.279  -0.435   1.784
  763   1HD1  LEU 101          1HD1      LEU 101  -0.123   1.493   0.619
  764   2HD1  LEU 101          2HD1      LEU 101   1.492   1.519   1.330
  765   3HD1  LEU 101          3HD1      LEU 101   0.193   2.466   2.056
  766   1HD2  LEU 101          1HD2      LEU 101   1.004  -0.956   3.817
  767   2HD2  LEU 101          2HD2      LEU 101   1.679   0.673   3.787
  768   3HD2  LEU 101          3HD2      LEU 101   2.038  -0.456   2.478
  769    H    LYS 102           H        LYS 102  -3.504   2.591   0.988
  770    HA   LYS 102           HA       LYS 102  -5.691   0.938   0.865
  771   1HB   LYS 102          2HB       LYS 102  -5.622   2.835  -0.575
  772   2HB   LYS 102          1HB       LYS 102  -4.174   2.255  -1.385
  773   1HG   LYS 102          2HG       LYS 102  -5.827   1.818  -2.930
  774   2HG   LYS 102          1HG       LYS 102  -5.659   0.266  -2.107
  775   1HD   LYS 102          2HD       LYS 102  -7.572   0.866  -0.663
  776   2HD   LYS 102          1HD       LYS 102  -7.762   2.365  -1.576
  777   1HE   LYS 102          2HE       LYS 102  -7.920   0.835  -3.639
  778   2HE   LYS 102          1HE       LYS 102  -8.205  -0.460  -2.477
  779   1HZ   LYS 102          1HZ       LYS 102 -10.243   0.626  -3.390
  780   2HZ   LYS 102          2HZ       LYS 102  -9.809   2.037  -2.557
  781   3HZ   LYS 102          3HZ       LYS 102 -10.148   0.614  -1.696
  782    H    LYS 103           H        LYS 103  -2.660   0.408  -0.994
  783    HA   LYS 103           HA       LYS 103  -2.902  -2.420  -0.398
  784   1HB   LYS 103          2HB       LYS 103  -3.092  -3.228  -2.522
  785   2HB   LYS 103          1HB       LYS 103  -3.972  -1.722  -2.723
  786   1HG   LYS 103          2HG       LYS 103  -1.641  -0.787  -3.427
  787   2HG   LYS 103          1HG       LYS 103  -1.269  -2.489  -3.714
  788   1HD   LYS 103          2HD       LYS 103  -3.836  -1.913  -4.815
  789   2HD   LYS 103          1HD       LYS 103  -2.691  -0.694  -5.381
  790   1HE   LYS 103          2HE       LYS 103  -1.376  -2.240  -6.466
  791   2HE   LYS 103          1HE       LYS 103  -1.905  -3.570  -5.436
  792   1HZ   LYS 103          1HZ       LYS 103  -3.970  -3.672  -6.569
  793   2HZ   LYS 103          2HZ       LYS 103  -2.765  -3.627  -7.760
  794   3HZ   LYS 103          3HZ       LYS 103  -3.669  -2.233  -7.415
  795    H    ALA 104           H        ALA 104  -0.890  -3.586  -0.662
  796    HA   ALA 104           HA       ALA 104   1.461  -2.108  -1.463
  797   1HB   ALA 104          1HB       ALA 104   2.147  -1.399   0.524
  798   2HB   ALA 104          2HB       ALA 104   2.197  -3.071   1.092
  799   3HB   ALA 104          3HB       ALA 104   0.728  -2.116   1.292
  800    H    ALA 105           H        ALA 105   3.088  -3.403  -2.075
  801    HA   ALA 105           HA       ALA 105   3.270  -6.167  -1.222
  802   1HB   ALA 105          1HB       ALA 105   3.368  -5.993  -4.135
  803   2HB   ALA 105          2HB       ALA 105   1.768  -5.666  -3.469
  804   3HB   ALA 105          3HB       ALA 105   2.582  -7.186  -3.101
  805    H    VAL 106           H        VAL 106   5.349  -7.137  -2.073
  806    HA   VAL 106           HA       VAL 106   7.286  -5.004  -2.558
  807    HB   VAL 106           HB       VAL 106   8.998  -6.816  -2.169
  808   1HG1  VAL 106          1HG1      VAL 106   8.346  -5.194  -0.455
  809   2HG1  VAL 106          2HG1      VAL 106   8.730  -6.766   0.248
  810   3HG1  VAL 106          3HG1      VAL 106   7.047  -6.271   0.061
  811   1HG2  VAL 106          1HG2      VAL 106   6.728  -8.476  -2.338
  812   2HG2  VAL 106          2HG2      VAL 106   7.298  -8.558  -0.672
  813   3HG2  VAL 106          3HG2      VAL 106   8.394  -8.945  -1.998
  814    H    ASP 107           H        ASP 107   9.150  -5.565  -3.987
  815    HA   ASP 107           HA       ASP 107   8.289  -6.978  -6.409
  816   1HB   ASP 107          2HB       ASP 107   7.984  -4.313  -6.320
  817   2HB   ASP 107          1HB       ASP 107   9.685  -4.372  -6.772
  818    H    TYR 108           H        TYR 108  10.145  -7.299  -7.913
  819    HA   TYR 108           HA       TYR 108  12.739  -7.262  -6.589
  820   1HB   TYR 108          2HB       TYR 108  11.231  -9.752  -7.307
  821   2HB   TYR 108          1HB       TYR 108  12.990  -9.742  -7.383
  822    HD1  TYR 108           1HD      TYR 108  10.112 -10.001  -5.257
  823    HD2  TYR 108           2HD      TYR 108  14.287  -9.159  -5.274
  824    HE1  TYR 108           1HE      TYR 108  10.202 -10.427  -2.839
  825    HE2  TYR 108           2HE      TYR 108  14.384  -9.586  -2.855
  826    HH   TYR 108           HH       TYR 108  11.665  -9.766  -0.905
  827    H    ASP 109           H        ASP 109  14.377  -8.389  -8.177
  828    HA   ASP 109           HA       ASP 109  14.041  -6.990 -10.713
  829   1HB   ASP 109          2HB       ASP 109  16.139  -6.650  -9.434
  830   2HB   ASP 109          1HB       ASP 109  16.474  -8.375  -9.545
  831    H    ARG 110           H        ARG 110  14.674  -8.130 -12.697
  832    HA   ARG 110           HA       ARG 110  13.174 -10.505 -12.973
  833   1HB   ARG 110          2HB       ARG 110  14.862  -8.814 -14.713
  834   2HB   ARG 110          1HB       ARG 110  14.662 -10.483 -15.227
  835   1HG   ARG 110          2HG       ARG 110  12.212  -9.026 -14.440
  836   2HG   ARG 110          1HG       ARG 110  12.996  -8.535 -15.942
  837   1HD   ARG 110          2HD       ARG 110  11.537 -11.000 -15.282
  838   2HD   ARG 110          1HD       ARG 110  11.728 -10.176 -16.826
  839    HE   ARG 110           HE       ARG 110  14.112 -11.185 -16.686
  840   1HH1  ARG 110          1HH1      ARG 110  11.143 -12.699 -15.597
  841   2HH1  ARG 110          2HH1      ARG 110  11.728 -14.319 -15.842
  842   1HH2  ARG 110          1HH2      ARG 110  14.892 -13.316 -17.007
  843   2HH2  ARG 110          2HH2      ARG 110  13.871 -14.671 -16.616
  844    H    SER 111           H        SER 111  16.638  -9.908 -12.564
  845    HA   SER 111           HA       SER 111  16.998 -12.822 -12.308
  846   1HB   SER 111          2HB       SER 111  19.367 -11.372 -13.267
  847   2HB   SER 111          1HB       SER 111  18.682 -12.904 -13.811
  848    HG   SER 111           HG       SER 111  17.020 -10.931 -14.485
  849    H    GLY 112           H        GLY 112  17.902  -9.595 -11.324
  850   1HA   GLY 112          2HA       GLY 112  20.097 -10.363  -9.661
  851   2HA   GLY 112          1HA       GLY 112  19.310  -8.795  -9.685
  852    H    ARG 113           H        ARG 113  16.727  -9.565  -9.007
  853    HA   ARG 113           HA       ARG 113  15.535  -9.422  -7.062
  854   1HB   ARG 113          2HB       ARG 113  15.276 -11.610  -5.968
  855   2HB   ARG 113          1HB       ARG 113  15.213 -11.717  -7.720
  856   1HG   ARG 113          2HG       ARG 113  17.158 -12.894  -7.857
  857   2HG   ARG 113          1HG       ARG 113  17.824 -12.168  -6.392
  858   1HD   ARG 113          2HD       ARG 113  17.313 -14.109  -5.402
  859   2HD   ARG 113          1HD       ARG 113  15.643 -13.541  -5.447
  860    HE   ARG 113           HE       ARG 113  15.295 -14.848  -7.418
  861   1HH1  ARG 113          1HH1      ARG 113  18.335 -15.420  -5.783
  862   2HH1  ARG 113          2HH1      ARG 113  18.634 -16.938  -6.579
  863   1HH2  ARG 113          1HH2      ARG 113  15.642 -16.874  -8.427
  864   2HH2  ARG 113          2HH2      ARG 113  17.086 -17.775  -8.061
  865    H    SER 114           H        SER 114  17.283  -7.820  -6.364
  866    HA   SER 114           HA       SER 114  17.898  -8.320  -3.624
  867   1HB   SER 114          2HB       SER 114  20.449  -7.674  -4.189
  868   2HB   SER 114          1HB       SER 114  19.898  -9.346  -4.078
  869    HG   SER 114           HG       SER 114  19.713  -9.410  -6.315
  870    H    LEU 115           H        LEU 115  16.308  -6.437  -4.364
  871    HA   LEU 115           HA       LEU 115  17.900  -3.964  -4.364
  872   1HB   LEU 115          2HB       LEU 115  15.396  -3.372  -5.509
  873   2HB   LEU 115          1HB       LEU 115  16.971  -3.327  -6.274
  874    HG   LEU 115           HG       LEU 115  16.620  -5.824  -6.761
  875   1HD1  LEU 115          1HD1      LEU 115  14.312  -6.569  -6.879
  876   2HD1  LEU 115          2HD1      LEU 115  13.768  -5.049  -6.167
  877   3HD1  LEU 115          3HD1      LEU 115  14.750  -6.166  -5.219
  878   1HD2  LEU 115          1HD2      LEU 115  15.214  -5.296  -8.740
  879   2HD2  LEU 115          2HD2      LEU 115  16.561  -4.182  -8.507
  880   3HD2  LEU 115          3HD2      LEU 115  14.926  -3.696  -8.057
  881    H    GLY 116           H        GLY 116  15.553  -5.801  -2.788
  882   1HA   GLY 116          2HA       GLY 116  14.157  -5.390  -1.018
  883   2HA   GLY 116          1HA       GLY 116  15.124  -3.949  -0.752
  884    H    THR 117           H        THR 117  13.247  -4.545  -3.656
  885    HA   THR 117           HA       THR 117  11.971  -1.994  -3.287
  886    HB   THR 117           HB       THR 117  11.292  -3.795  -5.568
  887    HG1  THR 117           1HG      THR 117  13.684  -2.259  -5.448
  888   1HG2  THR 117          1HG2      THR 117  10.200  -1.725  -5.699
  889   2HG2  THR 117          2HG2      THR 117  11.614  -1.518  -6.735
  890   3HG2  THR 117          3HG2      THR 117  11.608  -0.844  -5.104
  891    H    ALA 118           H        ALA 118   9.827  -1.550  -3.135
  892    HA   ALA 118           HA       ALA 118   7.859  -3.678  -3.283
  893   1HB   ALA 118          1HB       ALA 118   7.657  -1.863  -0.911
  894   2HB   ALA 118          2HB       ALA 118   8.656  -3.315  -0.820
  895   3HB   ALA 118          3HB       ALA 118   6.931  -3.451  -1.178
  896    H    ASP 119           H        ASP 119   5.817  -2.928  -3.798
  897    HA   ASP 119           HA       ASP 119   5.630  -0.060  -4.442
  898   1HB   ASP 119          2HB       ASP 119   5.462  -1.062  -6.538
  899   2HB   ASP 119          1HB       ASP 119   4.661  -2.494  -5.902
  900    H    VAL 120           H        VAL 120   4.440   0.891  -2.918
  901    HA   VAL 120           HA       VAL 120   2.010  -0.526  -2.064
  902    HB   VAL 120           HB       VAL 120   2.067   0.491   0.031
  903   1HG1  VAL 120          1HG1      VAL 120   4.604  -0.549  -0.936
  904   2HG1  VAL 120          2HG1      VAL 120   3.740  -0.887   0.564
  905   3HG1  VAL 120          3HG1      VAL 120   4.790   0.525   0.452
  906   1HG2  VAL 120          1HG2      VAL 120   3.749   2.362   0.514
  907   2HG2  VAL 120          2HG2      VAL 120   2.302   2.759  -0.414
  908   3HG2  VAL 120          3HG2      VAL 120   3.845   2.523  -1.242
  909    H    HIS 121           H        HIS 121   0.065   0.568  -2.146
  910    HA   HIS 121           HA       HIS 121   0.117   3.030  -3.772
  911   1HB   HIS 121          2HB       HIS 121  -1.132   0.397  -4.207
  912   2HB   HIS 121          1HB       HIS 121  -2.216   1.761  -4.448
  913    HD1  HIS 121           1HD      HIS 121   0.879   0.170  -5.874
  914    HD2  HIS 121           2HD      HIS 121  -1.697   3.322  -6.679
  915    HE1  HIS 121           1HE      HIS 121   1.352   0.837  -8.243
  916    HE2  HIS 121           2HE      HIS 121  -0.455   2.505  -8.791
  917    H    PHE 122           H        PHE 122  -0.816   4.656  -2.595
  918    HA   PHE 122           HA       PHE 122  -3.062   3.943  -0.853
  919   1HB   PHE 122          2HB       PHE 122  -2.278   6.752  -0.810
  920   2HB   PHE 122          1HB       PHE 122  -2.450   5.614   0.518
  921    HD1  PHE 122           1HD      PHE 122  -0.569   4.504   1.448
  922    HD2  PHE 122           2HD      PHE 122  -0.136   6.956  -1.999
  923    HE1  PHE 122           1HE      PHE 122   1.870   4.464   1.730
  924    HE2  PHE 122           2HE      PHE 122   2.302   6.916  -1.726
  925    HZ   PHE 122           HZ       PHE 122   3.310   5.671   0.140
  926    H    GLU 123           H        GLU 123  -4.961   5.287  -0.876
  927    HA   GLU 123           HA       GLU 123  -5.862   5.851  -3.546
  928   1HB   GLU 123          2HB       GLU 123  -7.057   5.116  -1.130
  929   2HB   GLU 123          1HB       GLU 123  -7.644   6.744  -1.447
  930   1HG   GLU 123          2HG       GLU 123  -8.603   6.113  -3.497
  931   2HG   GLU 123          1HG       GLU 123  -7.739   4.575  -3.514
  932    H    ARG 124           H        ARG 124  -4.262   7.625  -1.187
  933    HA   ARG 124           HA       ARG 124  -5.409  10.175  -2.097
  934   1HB   ARG 124          2HB       ARG 124  -3.627  10.465   0.133
  935   2HB   ARG 124          1HB       ARG 124  -5.337  10.863   0.026
  936   1HG   ARG 124          2HG       ARG 124  -5.253   8.088   0.281
  937   2HG   ARG 124          1HG       ARG 124  -4.030   8.696   1.401
  938   1HD   ARG 124          2HD       ARG 124  -5.925   8.732   2.712
  939   2HD   ARG 124          1HD       ARG 124  -5.888  10.380   2.089
  940    HE   ARG 124           HE       ARG 124  -7.686   8.229   1.198
  941   1HH1  ARG 124          1HH1      ARG 124  -6.796  11.616   1.297
  942   2HH1  ARG 124          2HH1      ARG 124  -8.281  12.163   0.581
  943   1HH2  ARG 124          1HH2      ARG 124  -9.644   8.937   0.252
  944   2HH2  ARG 124          2HH2      ARG 124  -9.905  10.641  -0.009
  945    H    ARG 125           H        ARG 125  -4.166  11.599  -3.190
  946    HA   ARG 125           HA       ARG 125  -1.506  10.844  -3.953
  947   1HB   ARG 125          2HB       ARG 125  -2.768  13.551  -4.373
  948   2HB   ARG 125          1HB       ARG 125  -1.517  12.778  -5.336
  949   1HG   ARG 125          2HG       ARG 125  -3.019  11.809  -6.648
  950   2HG   ARG 125          1HG       ARG 125  -3.916  11.175  -5.265
  951   1HD   ARG 125          2HD       ARG 125  -5.010  13.364  -5.003
  952   2HD   ARG 125          1HD       ARG 125  -4.144  13.953  -6.420
  953    HE   ARG 125           HE       ARG 125  -5.357  12.058  -7.617
  954   1HH1  ARG 125          1HH1      ARG 125  -6.691  13.808  -4.889
  955   2HH1  ARG 125          2HH1      ARG 125  -8.339  13.512  -5.344
  956   1HH2  ARG 125          1HH2      ARG 125  -7.518  11.672  -8.217
  957   2HH2  ARG 125          2HH2      ARG 125  -8.815  12.295  -7.226
  958    H    ALA 126           H        ALA 126  -2.939  13.022  -1.611
  959    HA   ALA 126           HA       ALA 126  -0.584  14.460  -0.975
  960   1HB   ALA 126          1HB       ALA 126  -3.223  14.068   0.335
  961   2HB   ALA 126          2HB       ALA 126  -2.432  15.552  -0.195
  962   3HB   ALA 126          3HB       ALA 126  -1.899  14.747   1.282
  963    H    ASP 127           H        ASP 127  -1.930  11.432   0.169
  964    HA   ASP 127           HA       ASP 127  -0.184  10.921   2.287
  965   1HB   ASP 127          2HB       ASP 127  -2.100   9.437   0.817
  966   2HB   ASP 127          1HB       ASP 127  -0.614   8.492   0.815
  967    H    ALA 128           H        ALA 128   0.249  10.687  -1.164
  968    HA   ALA 128           HA       ALA 128   2.850   9.425  -0.975
  969   1HB   ALA 128          1HB       ALA 128   2.107  10.729  -3.506
  970   2HB   ALA 128          2HB       ALA 128   0.986   9.482  -2.958
  971   3HB   ALA 128          3HB       ALA 128   2.692   9.091  -3.205
  972    H    LEU 129           H        LEU 129   1.433  12.568  -1.411
  973    HA   LEU 129           HA       LEU 129   3.712  14.071  -2.032
  974   1HB   LEU 129          2HB       LEU 129   1.503  15.011  -2.239
  975   2HB   LEU 129          1HB       LEU 129   1.208  14.812  -0.524
  976    HG   LEU 129           HG       LEU 129   3.540  16.449  -0.928
  977   1HD1  LEU 129          1HD1      LEU 129   1.081  17.731  -2.033
  978   2HD1  LEU 129          2HD1      LEU 129   2.151  16.813  -3.095
  979   3HD1  LEU 129          3HD1      LEU 129   2.770  18.205  -2.206
  980   1HD2  LEU 129          1HD2      LEU 129   2.211  18.028   0.427
  981   2HD2  LEU 129          2HD2      LEU 129   2.259  16.406   1.121
  982   3HD2  LEU 129          3HD2      LEU 129   0.818  16.958   0.267
  983    H    LYS 130           H        LYS 130   2.269  13.294   1.128
  984    HA   LYS 130           HA       LYS 130   4.231  14.619   2.678
  985   1HB   LYS 130          2HB       LYS 130   2.303  14.124   3.881
  986   2HB   LYS 130          1HB       LYS 130   2.188  12.495   3.226
  987   1HG   LYS 130          2HG       LYS 130   4.449  12.183   4.574
  988   2HG   LYS 130          1HG       LYS 130   3.776  13.517   5.516
  989   1HD   LYS 130          2HD       LYS 130   3.066  11.500   6.560
  990   2HD   LYS 130          1HD       LYS 130   1.663  12.177   5.733
  991   1HE   LYS 130          2HE       LYS 130   2.339  10.646   3.780
  992   2HE   LYS 130          1HE       LYS 130   3.341   9.812   4.968
  993   1HZ   LYS 130          1HZ       LYS 130   0.661  10.266   5.880
  994   2HZ   LYS 130          2HZ       LYS 130   1.569   8.835   5.860
  995   3HZ   LYS 130          3HZ       LYS 130   0.714   9.318   4.475
  996    H    ALA 131           H        ALA 131   3.916  11.351   1.483
  997    HA   ALA 131           HA       ALA 131   6.129  10.282   2.883
  998   1HB   ALA 131          1HB       ALA 131   5.868   8.324   1.582
  999   2HB   ALA 131          2HB       ALA 131   5.035   9.207   0.302
 1000   3HB   ALA 131          3HB       ALA 131   4.249   8.966   1.861
 1001    H    MET 132           H        MET 132   5.822  11.842  -0.261
 1002    HA   MET 132           HA       MET 132   8.557  11.281  -0.988
 1003   1HB   MET 132          2HB       MET 132   8.098  12.276  -3.031
 1004   2HB   MET 132          1HB       MET 132   6.521  11.654  -2.568
 1005   1HG   MET 132          2HG       MET 132   5.790  13.824  -1.888
 1006   2HG   MET 132          1HG       MET 132   7.409  14.489  -2.101
 1007   1HE   MET 132          1HE       MET 132   5.280  12.176  -4.967
 1008   2HE   MET 132          2HE       MET 132   4.203  13.563  -5.132
 1009   3HE   MET 132          3HE       MET 132   4.449  12.820  -3.550
 1010    H    LYS 133           H        LYS 133   6.908  13.653   0.830
 1011    HA   LYS 133           HA       LYS 133   9.027  15.617   0.621
 1012   1HB   LYS 133          2HB       LYS 133   6.333  15.537   1.666
 1013   2HB   LYS 133          1HB       LYS 133   7.434  16.204   2.862
 1014   1HG   LYS 133          2HG       LYS 133   6.485  17.970   1.522
 1015   2HG   LYS 133          1HG       LYS 133   8.216  17.840   1.207
 1016   1HD   LYS 133          2HD       LYS 133   7.782  17.625  -0.962
 1017   2HD   LYS 133          1HD       LYS 133   6.910  16.127  -0.619
 1018   1HE   LYS 133          2HE       LYS 133   5.408  17.532  -1.796
 1019   2HE   LYS 133          1HE       LYS 133   4.896  17.546  -0.109
 1020   1HZ   LYS 133          1HZ       LYS 133   4.873  19.761  -1.109
 1021   2HZ   LYS 133          2HZ       LYS 133   6.538  19.653  -1.412
 1022   3HZ   LYS 133          3HZ       LYS 133   5.967  19.675   0.186
 1023    H    GLN 134           H        GLN 134   7.754  13.372   3.021
 1024    HA   GLN 134           HA       GLN 134   9.775  14.014   4.948
 1025   1HB   GLN 134          2HB       GLN 134   7.351  12.369   4.832
 1026   2HB   GLN 134          1HB       GLN 134   8.626  11.689   5.833
 1027   1HG   GLN 134          2HG       GLN 134   6.974  13.133   7.028
 1028   2HG   GLN 134          1HG       GLN 134   8.664  13.587   7.238
 1029   1HE2  GLN 134          1HE2      GLN 134   5.877  14.293   5.165
 1030   2HE2  GLN 134          2HE2      GLN 134   6.185  15.989   5.031
 1031    H    TYR 135           H        TYR 135   8.979  10.915   3.293
 1032    HA   TYR 135           HA       TYR 135  11.439   9.828   4.388
 1033   1HB   TYR 135          2HB       TYR 135   9.642   8.272   2.571
 1034   2HB   TYR 135          1HB       TYR 135  10.599   7.715   3.939
 1035    HD1  TYR 135           1HD      TYR 135   9.820   9.239   6.173
 1036    HD2  TYR 135           2HD      TYR 135   7.382   7.948   2.936
 1037    HE1  TYR 135           1HE      TYR 135   7.844   9.356   7.624
 1038    HE2  TYR 135           2HE      TYR 135   5.394   8.058   4.383
 1039    HH   TYR 135           HH       TYR 135   4.661   8.284   6.493
 1040    H    LYS 136           H        LYS 136  10.281  10.834   1.235
 1041    HA   LYS 136           HA       LYS 136  12.164   9.415  -0.314
 1042   1HB   LYS 136          2HB       LYS 136  10.272  10.335  -1.432
 1043   2HB   LYS 136          1HB       LYS 136  10.629  11.955  -0.851
 1044   1HG   LYS 136          2HG       LYS 136  12.896  11.445  -2.202
 1045   2HG   LYS 136          1HG       LYS 136  11.759  10.465  -3.128
 1046   1HD   LYS 136          2HD       LYS 136  10.684  12.264  -3.961
 1047   2HD   LYS 136          1HD       LYS 136  10.832  13.176  -2.460
 1048   1HE   LYS 136          2HE       LYS 136  12.218  14.394  -3.813
 1049   2HE   LYS 136          1HE       LYS 136  13.371  13.246  -3.133
 1050   1HZ   LYS 136          1HZ       LYS 136  13.331  11.966  -5.097
 1051   2HZ   LYS 136          2HZ       LYS 136  13.483  13.579  -5.604
 1052   3HZ   LYS 136          3HZ       LYS 136  11.984  12.793  -5.715
 1053    H    GLY 137           H        GLY 137  14.305   9.573  -0.081
 1054   1HA   GLY 137          2HA       GLY 137  16.279  10.737  -0.687
 1055   2HA   GLY 137          1HA       GLY 137  15.465  12.254  -0.324
 1056    H    VAL 138           H        VAL 138  14.934   9.808   1.969
 1057    HA   VAL 138           HA       VAL 138  16.509  11.238   3.942
 1058    HB   VAL 138           HB       VAL 138  14.512   9.005   4.075
 1059   1HG1  VAL 138          1HG1      VAL 138  16.731   9.402   5.906
 1060   2HG1  VAL 138          2HG1      VAL 138  15.566   8.080   5.811
 1061   3HG1  VAL 138          3HG1      VAL 138  15.166   9.546   6.707
 1062   1HG2  VAL 138          1HG2      VAL 138  13.238  10.809   4.382
 1063   2HG2  VAL 138          2HG2      VAL 138  14.631  11.846   4.691
 1064   3HG2  VAL 138          3HG2      VAL 138  13.945  10.878   5.995
 1065    HA   PRO 139           HA       PRO 139  19.723   8.145   4.098
 1066   1HB   PRO 139          2HB       PRO 139  21.659   9.826   4.883
 1067   2HB   PRO 139          1HB       PRO 139  21.177   9.726   3.186
 1068   1HG   PRO 139          2HG       PRO 139  20.621  11.837   5.184
 1069   2HG   PRO 139          1HG       PRO 139  20.753  11.960   3.423
 1070   1HD   PRO 139          2HD       PRO 139  18.371  11.799   4.980
 1071   2HD   PRO 139          1HD       PRO 139  18.508  11.800   3.211
 1072    H    LEU 140           H        LEU 140  20.837   7.422   6.101
 1073    HA   LEU 140           HA       LEU 140  20.129   8.680   8.552
 1074   1HB   LEU 140          2HB       LEU 140  17.964   7.718   8.124
 1075   2HB   LEU 140          1HB       LEU 140  18.675   6.157   7.759
 1076    HG   LEU 140           HG       LEU 140  19.391   5.964  10.127
 1077   1HD1  LEU 140          1HD1      LEU 140  17.889   8.558  10.396
 1078   2HD1  LEU 140          2HD1      LEU 140  19.575   8.236  10.801
 1079   3HD1  LEU 140          3HD1      LEU 140  18.285   7.511  11.758
 1080   1HD2  LEU 140          1HD2      LEU 140  17.358   4.890   9.462
 1081   2HD2  LEU 140          2HD2      LEU 140  16.458   6.401   9.600
 1082   3HD2  LEU 140          3HD2      LEU 140  17.105   5.624  11.044
 1083    H    ASP 141           H        ASP 141  22.386   8.485   8.692
 1084    HA   ASP 141           HA       ASP 141  24.332   7.588   9.485
 1085   1HB   ASP 141          2HB       ASP 141  22.464   7.161  11.359
 1086   2HB   ASP 141          1HB       ASP 141  22.910   5.489  11.030
 1087    H    GLY 142           H        GLY 142  25.013   6.751   7.491
 1088   1HA   GLY 142          2HA       GLY 142  25.867   5.110   6.131
 1089   2HA   GLY 142          1HA       GLY 142  25.653   4.008   7.480
 1090    H    ARG 143           H        ARG 143  22.662   5.149   7.003
 1091    HA   ARG 143           HA       ARG 143  22.057   3.145   4.908
 1092   1HB   ARG 143          2HB       ARG 143  21.184   3.201   7.638
 1093   2HB   ARG 143          1HB       ARG 143  19.791   3.379   6.579
 1094   1HG   ARG 143          2HG       ARG 143  19.990   1.284   5.733
 1095   2HG   ARG 143          1HG       ARG 143  21.746   1.255   5.919
 1096   1HD   ARG 143          2HD       ARG 143  20.839   1.435   8.511
 1097   2HD   ARG 143          1HD       ARG 143  19.654   0.378   7.747
 1098    HE   ARG 143           HE       ARG 143  21.257  -1.249   7.522
 1099   1HH1  ARG 143          1HH1      ARG 143  22.768   1.768   8.481
 1100   2HH1  ARG 143          2HH1      ARG 143  24.303   1.038   8.834
 1101   1HH2  ARG 143          1HH2      ARG 143  23.287  -2.213   8.006
 1102   2HH2  ARG 143          2HH2      ARG 143  24.598  -1.211   8.562
 1103    HA   PRO 144           HA       PRO 144  19.671   6.643   3.280
 1104   1HB   PRO 144          2HB       PRO 144  20.227   6.168   0.704
 1105   2HB   PRO 144          1HB       PRO 144  21.382   7.006   1.745
 1106   1HG   PRO 144          2HG       PRO 144  21.379   4.172   0.814
 1107   2HG   PRO 144          1HG       PRO 144  22.743   5.281   1.035
 1108   1HD   PRO 144          2HD       PRO 144  21.955   3.313   2.840
 1109   2HD   PRO 144          1HD       PRO 144  22.985   4.705   3.222
 1110    H    MET 145           H        MET 145  17.652   6.469   1.904
 1111    HA   MET 145           HA       MET 145  16.947   3.696   1.328
 1112   1HB   MET 145          2HB       MET 145  14.736   3.892   2.075
 1113   2HB   MET 145          1HB       MET 145  15.709   4.527   3.395
 1114   1HG   MET 145          2HG       MET 145  15.122   6.773   1.899
 1115   2HG   MET 145          1HG       MET 145  13.635   5.821   1.788
 1116   1HE   MET 145          1HE       MET 145  13.329   4.273   4.068
 1117   2HE   MET 145          2HE       MET 145  12.909   5.128   5.552
 1118   3HE   MET 145          3HE       MET 145  14.564   4.578   5.290
 1119    H    ASP 146           H        ASP 146  15.526   3.458  -0.446
 1120    HA   ASP 146           HA       ASP 146  15.502   5.820  -2.209
 1121   1HB   ASP 146          2HB       ASP 146  16.722   3.729  -3.012
 1122   2HB   ASP 146          1HB       ASP 146  15.136   2.955  -3.095
 1123    H    ILE 147           H        ILE 147  13.625   6.794  -2.006
 1124    HA   ILE 147           HA       ILE 147  11.190   5.154  -1.936
 1125    HB   ILE 147           HB       ILE 147  12.001   7.335  -0.011
 1126   1HG1  ILE 147          2HG1      ILE 147  11.316   4.417   0.203
 1127   2HG1  ILE 147          1HG1      ILE 147  12.749   5.258   0.780
 1128   1HG2  ILE 147          1HG2      ILE 147   9.767   7.147   0.975
 1129   2HG2  ILE 147          2HG2      ILE 147   9.258   6.174  -0.407
 1130   3HG2  ILE 147          3HG2      ILE 147   9.749   7.855  -0.640
 1131   1HD1  ILE 147          1HD1      ILE 147  10.699   6.439   2.195
 1132   2HD1  ILE 147          2HD1      ILE 147  11.798   5.191   2.784
 1133   3HD1  ILE 147          3HD1      ILE 147  10.229   4.743   2.113
 1134    H    GLN 148           H        GLN 148  10.150   5.704  -3.738
 1135    HA   GLN 148           HA       GLN 148   9.939   8.570  -4.390
 1136   1HB   GLN 148          2HB       GLN 148   9.942   7.886  -6.832
 1137   2HB   GLN 148          1HB       GLN 148  11.485   7.792  -5.998
 1138   1HG   GLN 148          2HG       GLN 148  10.072   5.296  -5.810
 1139   2HG   GLN 148          1HG       GLN 148  10.243   5.803  -7.491
 1140   1HE2  GLN 148          1HE2      GLN 148  11.668   4.117  -5.068
 1141   2HE2  GLN 148          2HE2      GLN 148  13.316   4.154  -5.618
 1142    H    LEU 149           H        LEU 149   7.967   9.284  -4.940
 1143    HA   LEU 149           HA       LEU 149   5.824   7.274  -5.101
 1144   1HB   LEU 149          2HB       LEU 149   5.846   9.837  -3.522
 1145   2HB   LEU 149          1HB       LEU 149   4.425   8.838  -3.772
 1146    HG   LEU 149           HG       LEU 149   6.236   7.028  -2.796
 1147   1HD1  LEU 149          1HD1      LEU 149   7.519   7.909  -1.108
 1148   2HD1  LEU 149          2HD1      LEU 149   6.543   9.372  -0.981
 1149   3HD1  LEU 149          3HD1      LEU 149   7.648   9.165  -2.340
 1150   1HD2  LEU 149          1HD2      LEU 149   4.139   6.858  -1.937
 1151   2HD2  LEU 149          2HD2      LEU 149   3.983   8.595  -1.671
 1152   3HD2  LEU 149          3HD2      LEU 149   4.957   7.616  -0.572
 1153    H    VAL 150           H        VAL 150   4.727   7.419  -6.887
 1154    HA   VAL 150           HA       VAL 150   4.529  10.047  -8.219
 1155    HB   VAL 150           HB       VAL 150   4.395   7.567  -9.869
 1156   1HG1  VAL 150          1HG1      VAL 150   4.506   9.054 -11.519
 1157   2HG1  VAL 150          2HG1      VAL 150   6.002   9.731 -10.874
 1158   3HG1  VAL 150          3HG1      VAL 150   4.445  10.332 -10.305
 1159   1HG2  VAL 150          1HG2      VAL 150   6.476   6.877  -9.511
 1160   2HG2  VAL 150          2HG2      VAL 150   6.636   8.066  -8.219
 1161   3HG2  VAL 150          3HG2      VAL 150   7.096   8.488  -9.869
 1162    H    ALA 151           H        ALA 151   2.510  10.713  -8.630
 1163    HA   ALA 151           HA       ALA 151   0.331   8.901  -7.932
 1164   1HB   ALA 151          1HB       ALA 151   0.663  11.331  -7.072
 1165   2HB   ALA 151          2HB       ALA 151  -0.956  10.759  -7.475
 1166   3HB   ALA 151          3HB       ALA 151  -0.074  11.782  -8.610
 1167    H    SER 152           H        SER 152   1.781  10.259 -10.724
 1168    HA   SER 152           HA       SER 152  -0.621   9.721 -12.319
 1169   1HB   SER 152          2HB       SER 152   1.609  10.873 -13.786
 1170   2HB   SER 152          1HB       SER 152  -0.032  11.490 -13.576
 1171    HG   SER 152           HG       SER 152   0.576  12.618 -11.847
 1172    H    GLN 153           H        GLN 153   2.835   8.989 -12.154
 1173    HA   GLN 153           HA       GLN 153   2.630   7.102 -14.351
 1174   1HB   GLN 153          2HB       GLN 153   4.965   7.817 -12.595
 1175   2HB   GLN 153          1HB       GLN 153   5.047   6.836 -14.051
 1176   1HG   GLN 153          2HG       GLN 153   3.779   9.303 -14.684
 1177   2HG   GLN 153          1HG       GLN 153   5.271   9.638 -13.807
 1178   1HE2  GLN 153          1HE2      GLN 153   7.193   8.421 -14.572
 1179   2HE2  GLN 153          2HE2      GLN 153   7.382   8.219 -16.292
 1180    H    ILE 154           H        ILE 154   1.001   6.251 -12.510
 1181    HA   ILE 154           HA       ILE 154   2.162   4.548 -10.512
 1182    HB   ILE 154           HB       ILE 154  -0.225   3.831 -10.168
 1183   1HG1  ILE 154          2HG1      ILE 154  -0.720   5.911 -12.319
 1184   2HG1  ILE 154          1HG1      ILE 154  -1.013   4.185 -12.469
 1185   1HG2  ILE 154          1HG2      ILE 154   0.849   6.568  -9.955
 1186   2HG2  ILE 154          2HG2      ILE 154   0.246   5.483  -8.700
 1187   3HG2  ILE 154          3HG2      ILE 154  -0.888   6.388  -9.704
 1188   1HD1  ILE 154          1HD1      ILE 154  -2.782   4.274 -10.876
 1189   2HD1  ILE 154          2HD1      ILE 154  -3.045   5.548 -12.068
 1190   3HD1  ILE 154          3HD1      ILE 154  -2.401   5.949 -10.475
 1191    H    ASP 155           H        ASP 155   3.204   3.766 -12.920
 1192    HA   ASP 155           HA       ASP 155   2.717   1.055 -13.245
 1193   1HB   ASP 155          2HB       ASP 155   0.487   1.682 -14.072
 1194   2HB   ASP 155          1HB       ASP 155   1.216   2.773 -15.247
 1195    H    LEU 156           H        LEU 156   3.558   4.105 -14.599
 1196    HA   LEU 156           HA       LEU 156   5.356   3.001 -16.588
 1197   1HB   LEU 156          2HB       LEU 156   4.869   5.879 -15.834
 1198   2HB   LEU 156          1HB       LEU 156   5.621   5.284 -17.310
 1199    HG   LEU 156           HG       LEU 156   3.018   4.131 -17.079
 1200   1HD1  LEU 156          1HD1      LEU 156   1.604   5.809 -16.596
 1201   2HD1  LEU 156          2HD1      LEU 156   2.648   7.040 -17.310
 1202   3HD1  LEU 156          3HD1      LEU 156   2.980   6.433 -15.685
 1203   1HD2  LEU 156          1HD2      LEU 156   3.529   6.302 -19.007
 1204   2HD2  LEU 156          2HD2      LEU 156   2.906   4.673 -19.263
 1205   3HD2  LEU 156          3HD2      LEU 156   4.638   4.932 -19.057
 1206    H    GLU 157           H        GLU 157   5.707   5.533 -14.124
 1207    HA   GLU 157           HA       GLU 157   7.311   6.048 -12.623
 1208   1HB   GLU 157          2HB       GLU 157   8.231   3.208 -13.050
 1209   2HB   GLU 157          1HB       GLU 157   8.726   4.259 -11.731
 1210   1HG   GLU 157          2HG       GLU 157   6.802   3.970 -10.597
 1211   2HG   GLU 157          1HG       GLU 157   5.825   3.886 -12.064
 1212    H    HIS 158           H        HIS 158   7.839   5.832 -15.728
 1213    HA   HIS 158           HA       HIS 158  10.276   7.267 -15.651
 1214   1HB   HIS 158          2HB       HIS 158  10.961   4.763 -15.424
 1215   2HB   HIS 158          1HB       HIS 158  10.548   4.663 -17.131
 1216    HD1  HIS 158           1HD      HIS 158  12.345   5.280 -18.732
 1217    HD2  HIS 158           2HD      HIS 158  13.052   6.788 -14.915
 1218    HE1  HIS 158           1HE      HIS 158  14.637   6.315 -18.819
 1219    HE2  HIS 158           2HE      HIS 158  15.087   7.143 -16.481
  Start of MODEL   12
    1    H    MET   1           H        MET   1-125.152 -56.341   0.366
    2    HA   MET   1           HA       MET   1-124.838 -55.515  -2.406
    3   1HB   MET   1          2HB       MET   1-123.623 -54.488  -0.414
    4   2HB   MET   1          1HB       MET   1-122.663 -55.958  -0.367
    5   1HG   MET   1          2HG       MET   1-121.879 -55.524  -2.633
    6   2HG   MET   1          1HG       MET   1-122.849 -54.053  -2.688
    7   1HE   MET   1          1HE       MET   1-120.174 -55.902  -0.494
    8   2HE   MET   1          2HE       MET   1-121.199 -55.083   0.689
    9   3HE   MET   1          3HE       MET   1-119.528 -54.565   0.461
   10    H    ALA   2           H        ALA   2-124.650 -58.335  -0.513
   11    HA   ALA   2           HA       ALA   2-123.961 -60.468  -0.844
   12   1HB   ALA   2          1HB       ALA   2-123.871 -60.435  -3.741
   13   2HB   ALA   2          2HB       ALA   2-125.336 -59.684  -3.107
   14   3HB   ALA   2          3HB       ALA   2-124.923 -61.337  -2.651
   15    H    ASP   3           H        ASP   3-121.906 -58.715  -0.375
   16    HA   ASP   3           HA       ASP   3-119.727 -59.944  -1.917
   17   1HB   ASP   3          2HB       ASP   3-119.955 -57.805  -2.980
   18   2HB   ASP   3          1HB       ASP   3-120.106 -56.985  -1.432
   19    H    LYS   4           H        LYS   4-120.058 -57.454   0.573
   20    HA   LYS   4           HA       LYS   4-118.954 -57.087   2.520
   21   1HB   LYS   4          2HB       LYS   4-120.520 -59.360   2.730
   22   2HB   LYS   4          1HB       LYS   4-118.979 -59.858   3.419
   23   1HG   LYS   4          2HG       LYS   4-120.552 -58.975   5.096
   24   2HG   LYS   4          1HG       LYS   4-119.048 -58.059   5.013
   25   1HD   LYS   4          2HD       LYS   4-120.078 -56.188   4.274
   26   2HD   LYS   4          1HD       LYS   4-121.221 -57.090   3.274
   27   1HE   LYS   4          2HE       LYS   4-122.690 -57.428   5.033
   28   2HE   LYS   4          1HE       LYS   4-121.444 -57.176   6.254
   29   1HZ   LYS   4          1HZ       LYS   4-121.408 -54.788   5.377
   30   2HZ   LYS   4          2HZ       LYS   4-122.723 -55.261   6.338
   31   3HZ   LYS   4          3HZ       LYS   4-122.895 -55.161   4.656
   32    H    MET   5           H        MET   5-117.147 -57.355   0.489
   33    HA   MET   5           HA       MET   5-114.863 -58.414   1.975
   34   1HB   MET   5          2HB       MET   5-115.880 -59.962   0.024
   35   2HB   MET   5          1HB       MET   5-114.821 -58.942  -0.942
   36   1HG   MET   5          2HG       MET   5-113.127 -59.584   1.022
   37   2HG   MET   5          1HG       MET   5-114.166 -61.010   1.057
   38   1HE   MET   5          1HE       MET   5-113.864 -62.977  -1.544
   39   2HE   MET   5          2HE       MET   5-113.715 -62.777   0.202
   40   3HE   MET   5          3HE       MET   5-112.288 -63.142  -0.770
   41    H    ASP   6           H        ASP   6-115.848 -56.792  -1.038
   42    HA   ASP   6           HA       ASP   6-113.490 -55.070  -0.879
   43   1HB   ASP   6          2HB       ASP   6-115.207 -55.997  -2.999
   44   2HB   ASP   6          1HB       ASP   6-115.176 -54.236  -2.992
   45    H    MET   7           H        MET   7-116.998 -54.952  -0.752
   46    HA   MET   7           HA       MET   7-118.464 -53.516   0.211
   47   1HB   MET   7          2HB       MET   7-115.938 -52.574   1.535
   48   2HB   MET   7          1HB       MET   7-117.459 -51.732   1.797
   49   1HG   MET   7          2HG       MET   7-118.403 -53.506   2.926
   50   2HG   MET   7          1HG       MET   7-117.305 -54.683   2.204
   51   1HE   MET   7          1HE       MET   7-113.973 -53.428   3.674
   52   2HE   MET   7          2HE       MET   7-114.822 -54.127   2.295
   53   3HE   MET   7          3HE       MET   7-114.520 -55.103   3.733
   54    H    SER   8           H        SER   8-115.809 -51.198  -0.073
   55    HA   SER   8           HA       SER   8-117.480 -49.410  -1.597
   56   1HB   SER   8          2HB       SER   8-114.553 -48.946  -1.185
   57   2HB   SER   8          1HB       SER   8-115.888 -47.793  -1.128
   58    HG   SER   8           HG       SER   8-116.549 -48.905   0.842
   59    H    LEU   9           H        LEU   9-117.479 -51.480  -3.119
   60    HA   LEU   9           HA       LEU   9-115.357 -52.174  -4.737
   61   1HB   LEU   9          2HB       LEU   9-118.305 -52.089  -5.368
   62   2HB   LEU   9          1HB       LEU   9-117.113 -52.833  -6.415
   63    HG   LEU   9           HG       LEU   9-116.879 -53.862  -3.727
   64   1HD1  LEU   9          1HD1      LEU   9-119.030 -55.094  -3.727
   65   2HD1  LEU   9          2HD1      LEU   9-119.579 -54.059  -5.045
   66   3HD1  LEU   9          3HD1      LEU   9-119.208 -53.359  -3.469
   67   1HD2  LEU   9          1HD2      LEU   9-116.360 -55.705  -4.872
   68   2HD2  LEU   9          2HD2      LEU   9-116.471 -54.703  -6.319
   69   3HD2  LEU   9          3HD2      LEU   9-117.861 -55.654  -5.795
   70    H    ASP  10           H        ASP  10-117.867 -49.748  -5.447
   71    HA   ASP  10           HA       ASP  10-116.873 -48.996  -7.954
   72   1HB   ASP  10          2HB       ASP  10-119.132 -48.406  -7.175
   73   2HB   ASP  10          1HB       ASP  10-118.433 -47.305  -5.990
   74    H    ASP  11           H        ASP  11-116.270 -47.679  -4.738
   75    HA   ASP  11           HA       ASP  11-114.674 -45.497  -5.445
   76   1HB   ASP  11          2HB       ASP  11-115.582 -46.527  -3.097
   77   2HB   ASP  11          1HB       ASP  11-113.877 -46.955  -3.002
   78    H    ILE  12           H        ILE  12-113.752 -48.816  -4.633
   79    HA   ILE  12           HA       ILE  12-110.982 -48.526  -5.022
   80    HB   ILE  12           HB       ILE  12-112.668 -50.999  -5.404
   81   1HG1  ILE  12          2HG1      ILE  12-111.102 -50.259  -2.937
   82   2HG1  ILE  12          1HG1      ILE  12-112.767 -49.730  -3.157
   83   1HG2  ILE  12          1HG2      ILE  12-109.883 -51.210  -4.458
   84   2HG2  ILE  12          2HG2      ILE  12-110.081 -50.708  -6.142
   85   3HG2  ILE  12          3HG2      ILE  12-110.784 -52.231  -5.580
   86   1HD1  ILE  12          1HD1      ILE  12-111.972 -52.057  -1.978
   87   2HD1  ILE  12          2HD1      ILE  12-112.394 -52.579  -3.610
   88   3HD1  ILE  12          3HD1      ILE  12-113.580 -51.727  -2.622
   89    H    ILE  13           H        ILE  13-113.519 -49.750  -7.173
   90    HA   ILE  13           HA       ILE  13-112.071 -50.235  -9.468
   91    HB   ILE  13           HB       ILE  13-114.854 -49.113  -9.171
   92   1HG1  ILE  13          2HG1      ILE  13-114.077 -51.872 -10.084
   93   2HG1  ILE  13          1HG1      ILE  13-114.159 -51.480  -8.370
   94   1HG2  ILE  13          1HG2      ILE  13-113.304 -49.127 -11.517
   95   2HG2  ILE  13          2HG2      ILE  13-115.031 -48.812 -11.364
   96   3HG2  ILE  13          3HG2      ILE  13-114.459 -50.450 -11.673
   97   1HD1  ILE  13          1HD1      ILE  13-116.454 -51.144  -8.432
   98   2HD1  ILE  13          2HD1      ILE  13-116.205 -52.537  -9.485
   99   3HD1  ILE  13          3HD1      ILE  13-116.473 -50.941 -10.184
  100    H    LYS  14           H        LYS  14-113.528 -47.145  -8.486
  101    HA   LYS  14           HA       LYS  14-112.738 -45.548 -10.608
  102   1HB   LYS  14          2HB       LYS  14-112.959 -44.891  -7.669
  103   2HB   LYS  14          1HB       LYS  14-112.716 -43.675  -8.914
  104   1HG   LYS  14          2HG       LYS  14-115.084 -45.518  -8.665
  105   2HG   LYS  14          1HG       LYS  14-115.047 -43.799  -8.273
  106   1HD   LYS  14          2HD       LYS  14-114.616 -43.245 -10.589
  107   2HD   LYS  14          1HD       LYS  14-114.523 -44.958 -11.007
  108   1HE   LYS  14          2HE       LYS  14-116.717 -43.653 -11.465
  109   2HE   LYS  14          1HE       LYS  14-116.802 -45.273 -10.776
  110   1HZ   LYS  14          1HZ       LYS  14-118.156 -43.298  -9.755
  111   2HZ   LYS  14          2HZ       LYS  14-116.701 -42.984  -8.944
  112   3HZ   LYS  14          3HZ       LYS  14-117.469 -44.487  -8.758
  113    H    LEU  15           H        LEU  15-110.983 -46.117  -7.570
  114    HA   LEU  15           HA       LEU  15-108.666 -44.682  -8.285
  115   1HB   LEU  15          2HB       LEU  15-109.465 -46.557  -6.163
  116   2HB   LEU  15          1HB       LEU  15-107.748 -46.550  -6.522
  117    HG   LEU  15           HG       LEU  15-107.978 -43.958  -6.275
  118   1HD1  LEU  15          1HD1      LEU  15-110.576 -44.437  -5.994
  119   2HD1  LEU  15          2HD1      LEU  15-109.768 -43.104  -5.170
  120   3HD1  LEU  15          3HD1      LEU  15-110.096 -44.606  -4.306
  121   1HD2  LEU  15          1HD2      LEU  15-107.877 -46.021  -4.110
  122   2HD2  LEU  15          2HD2      LEU  15-107.781 -44.304  -3.723
  123   3HD2  LEU  15          3HD2      LEU  15-106.574 -45.038  -4.778
  124    H    ASN  16           H        ASN  16-109.652 -48.012  -8.737
  125    HA   ASN  16           HA       ASN  16-107.214 -49.109  -9.557
  126   1HB   ASN  16          2HB       ASN  16-110.054 -49.853  -9.751
  127   2HB   ASN  16          1HB       ASN  16-109.040 -50.521 -11.027
  128   1HD2  ASN  16          1HD2      ASN  16-109.180 -50.102  -7.533
  129   2HD2  ASN  16          2HD2      ASN  16-108.418 -51.613  -7.142
  130    H    ARG  17           H        ARG  17-109.793 -47.527 -11.374
  131    HA   ARG  17           HA       ARG  17-108.720 -47.877 -13.955
  132   1HB   ARG  17          2HB       ARG  17-110.601 -45.819 -12.804
  133   2HB   ARG  17          1HB       ARG  17-110.155 -45.845 -14.506
  134   1HG   ARG  17          2HG       ARG  17-111.509 -47.566 -14.959
  135   2HG   ARG  17          1HG       ARG  17-111.095 -48.414 -13.468
  136   1HD   ARG  17          2HD       ARG  17-113.512 -47.490 -13.834
  137   2HD   ARG  17          1HD       ARG  17-112.741 -47.368 -12.253
  138    HE   ARG  17           HE       ARG  17-112.127 -45.022 -13.008
  139   1HH1  ARG  17          1HH1      ARG  17-115.010 -46.684 -14.130
  140   2HH1  ARG  17          2HH1      ARG  17-115.902 -45.208 -14.380
  141   1HH2  ARG  17          1HH2      ARG  17-113.280 -43.112 -13.338
  142   2HH2  ARG  17          2HH2      ARG  17-114.909 -43.166 -13.956
  143    H    ASN  18           H        ASN  18-108.298 -45.359 -11.521
  144    HA   ASN  18           HA       ASN  18-106.728 -43.655 -13.188
  145   1HB   ASN  18          2HB       ASN  18-108.010 -43.200 -10.902
  146   2HB   ASN  18          1HB       ASN  18-106.425 -43.562 -10.225
  147   1HD2  ASN  18          1HD2      ASN  18-107.171 -41.172  -9.674
  148   2HD2  ASN  18          2HD2      ASN  18-106.433 -39.973 -10.689
  149    H    GLN  19           H        GLN  19-106.017 -46.244 -10.938
  150    HA   GLN  19           HA       GLN  19-103.177 -45.833 -11.022
  151   1HB   GLN  19          2HB       GLN  19-104.884 -48.096  -9.981
  152   2HB   GLN  19          1HB       GLN  19-103.129 -48.088  -9.880
  153   1HG   GLN  19          2HG       GLN  19-104.357 -45.659  -8.843
  154   2HG   GLN  19          1HG       GLN  19-104.854 -47.124  -7.993
  155   1HE2  GLN  19          1HE2      GLN  19-103.560 -47.886  -6.481
  156   2HE2  GLN  19          2HE2      GLN  19-101.904 -47.421  -6.232
  157    H    ARG  20           H        ARG  20-104.559 -48.990 -11.616
  158    HA   ARG  20           HA       ARG  20-104.114 -50.598 -13.128
  159   1HB   ARG  20          2HB       ARG  20-104.750 -48.280 -14.656
  160   2HB   ARG  20          1HB       ARG  20-103.455 -49.133 -15.482
  161   1HG   ARG  20          2HG       ARG  20-105.195 -50.226 -16.401
  162   2HG   ARG  20          1HG       ARG  20-105.026 -51.212 -14.948
  163   1HD   ARG  20          2HD       ARG  20-106.656 -49.031 -14.248
  164   2HD   ARG  20          1HD       ARG  20-107.240 -49.607 -15.808
  165    HE   ARG  20           HE       ARG  20-107.173 -51.115 -13.292
  166   1HH1  ARG  20          1HH1      ARG  20-108.012 -50.971 -16.701
  167   2HH1  ARG  20          2HH1      ARG  20-109.075 -52.348 -16.623
  168   1HH2  ARG  20          1HH2      ARG  20-108.570 -52.929 -13.198
  169   2HH2  ARG  20          2HH2      ARG  20-109.362 -53.479 -14.643
  170    H    ARG  21           H        ARG  21-101.968 -48.303 -14.754
  171    HA   ARG  21           HA       ARG  21 -99.667 -49.671 -13.541
  172   1HB   ARG  21          2HB       ARG  21-100.408 -49.554 -16.385
  173   2HB   ARG  21          1HB       ARG  21 -98.743 -49.100 -16.051
  174   1HG   ARG  21          2HG       ARG  21 -98.145 -51.193 -15.472
  175   2HG   ARG  21          1HG       ARG  21 -99.700 -51.546 -14.718
  176   1HD   ARG  21          2HD       ARG  21 -98.995 -51.607 -17.641
  177   2HD   ARG  21          1HD       ARG  21 -99.528 -52.944 -16.624
  178    HE   ARG  21           HE       ARG  21-101.202 -50.809 -17.735
  179   1HH1  ARG  21          1HH1      ARG  21-100.934 -53.714 -15.796
  180   2HH1  ARG  21          2HH1      ARG  21-102.628 -54.090 -15.892
  181   1HH2  ARG  21          1HH2      ARG  21-103.435 -51.311 -17.889
  182   2HH2  ARG  21          2HH2      ARG  21-104.051 -52.740 -17.109
  183    H    VAL  22           H        VAL  22-101.272 -46.902 -13.919
  184    HA   VAL  22           HA       VAL  22-100.860 -44.685 -13.853
  185    HB   VAL  22           HB       VAL  22 -98.197 -45.373 -12.609
  186   1HG1  VAL  22          1HG1      VAL  22-100.069 -43.023 -12.419
  187   2HG1  VAL  22          2HG1      VAL  22 -98.396 -43.040 -12.974
  188   3HG1  VAL  22          3HG1      VAL  22 -98.763 -43.304 -11.268
  189   1HG2  VAL  22          1HG2      VAL  22-100.962 -45.662 -11.532
  190   2HG2  VAL  22          2HG2      VAL  22 -99.671 -45.135 -10.451
  191   3HG2  VAL  22          3HG2      VAL  22 -99.545 -46.683 -11.289
  192    H    ASN  23           H        ASN  23 -97.416 -45.163 -14.048
  193    HA   ASN  23           HA       ASN  23 -95.854 -44.505 -15.529
  194   1HB   ASN  23          2HB       ASN  23 -97.054 -46.364 -16.838
  195   2HB   ASN  23          1HB       ASN  23 -97.792 -45.058 -17.762
  196   1HD2  ASN  23          1HD2      ASN  23 -96.692 -45.982 -19.585
  197   2HD2  ASN  23          2HD2      ASN  23 -95.028 -45.598 -19.873
  198    H    ARG  24           H        ARG  24 -96.600 -42.386 -14.500
  199    HA   ARG  24           HA       ARG  24 -97.601 -40.489 -16.484
  200   1HB   ARG  24          2HB       ARG  24 -97.590 -38.864 -14.700
  201   2HB   ARG  24          1HB       ARG  24 -98.316 -40.344 -14.089
  202   1HG   ARG  24          2HG       ARG  24 -96.294 -40.913 -12.916
  203   2HG   ARG  24          1HG       ARG  24 -95.451 -39.538 -13.630
  204   1HD   ARG  24          2HD       ARG  24 -96.326 -38.087 -12.157
  205   2HD   ARG  24          1HD       ARG  24 -97.925 -38.827 -12.237
  206    HE   ARG  24           HE       ARG  24 -97.369 -40.214 -10.459
  207   1HH1  ARG  24          1HH1      ARG  24 -94.618 -38.270 -11.426
  208   2HH1  ARG  24          2HH1      ARG  24 -93.662 -38.698 -10.035
  209   1HH2  ARG  24          1HH2      ARG  24 -96.127 -40.762  -8.623
  210   2HH2  ARG  24          2HH2      ARG  24 -94.521 -40.119  -8.443
  211    H    GLY  25           H        GLY  25 -94.856 -42.019 -16.183
  212   1HA   GLY  25          2HA       GLY  25 -92.821 -41.554 -17.222
  213   2HA   GLY  25          1HA       GLY  25 -93.273 -39.856 -17.298
  214    H    GLY  26           H        GLY  26 -93.648 -38.994 -14.922
  215   1HA   GLY  26          2HA       GLY  26 -92.227 -39.896 -12.740
  216   2HA   GLY  26          1HA       GLY  26 -91.073 -38.975 -13.703
  217    H    GLY  27           H        GLY  27 -90.937 -37.448 -11.986
  218   1HA   GLY  27          2HA       GLY  27 -93.010 -35.400 -12.369
  219   2HA   GLY  27          1HA       GLY  27 -92.527 -35.822 -10.731
  220    HA   PRO  28           HA       PRO  28 -88.610 -33.834 -12.311
  221   1HB   PRO  28          2HB       PRO  28 -87.853 -33.874 -14.849
  222   2HB   PRO  28          1HB       PRO  28 -87.913 -35.377 -13.916
  223   1HG   PRO  28          2HG       PRO  28 -89.825 -34.341 -15.959
  224   2HG   PRO  28          1HG       PRO  28 -89.288 -36.003 -15.660
  225   1HD   PRO  28          2HD       PRO  28 -91.665 -34.825 -14.726
  226   2HD   PRO  28          1HD       PRO  28 -90.961 -36.358 -14.171
  227    H    ARG  29           H        ARG  29 -87.746 -31.825 -12.987
  228    HA   ARG  29           HA       ARG  29 -89.029 -30.126 -14.865
  229   1HB   ARG  29          2HB       ARG  29 -90.377 -30.055 -12.543
  230   2HB   ARG  29          1HB       ARG  29 -89.117 -28.888 -12.164
  231   1HG   ARG  29          2HG       ARG  29 -90.487 -27.405 -13.117
  232   2HG   ARG  29          1HG       ARG  29 -89.888 -28.069 -14.639
  233   1HD   ARG  29          2HD       ARG  29 -92.222 -28.108 -14.853
  234   2HD   ARG  29          1HD       ARG  29 -91.784 -29.767 -14.443
  235    HE   ARG  29           HE       ARG  29 -92.487 -28.056 -12.206
  236   1HH1  ARG  29          1HH1      ARG  29 -93.652 -30.362 -14.589
  237   2HH1  ARG  29          2HH1      ARG  29 -94.997 -30.875 -13.607
  238   1HH2  ARG  29          1HH2      ARG  29 -94.244 -28.742 -10.926
  239   2HH2  ARG  29          2HH2      ARG  29 -95.323 -29.965 -11.528
  240    H    ARG  30           H        ARG  30 -87.146 -29.634 -15.770
  241    HA   ARG  30           HA       ARG  30 -84.674 -29.460 -14.469
  242   1HB   ARG  30          2HB       ARG  30 -85.212 -29.732 -16.979
  243   2HB   ARG  30          1HB       ARG  30 -85.298 -27.977 -17.010
  244   1HG   ARG  30          2HG       ARG  30 -83.055 -27.720 -16.723
  245   2HG   ARG  30          1HG       ARG  30 -82.888 -29.218 -15.805
  246   1HD   ARG  30          2HD       ARG  30 -83.761 -29.764 -18.493
  247   2HD   ARG  30          1HD       ARG  30 -82.288 -28.795 -18.506
  248    HE   ARG  30           HE       ARG  30 -82.297 -31.133 -16.765
  249   1HH1  ARG  30          1HH1      ARG  30 -81.347 -29.698 -19.820
  250   2HH1  ARG  30          2HH1      ARG  30 -80.174 -30.928 -20.177
  251   1HH2  ARG  30          1HH2      ARG  30 -80.706 -32.733 -17.216
  252   2HH2  ARG  30          2HH2      ARG  30 -79.807 -32.645 -18.706
  253    H    ASN  31           H        ASN  31 -83.758 -27.939 -13.280
  254    HA   ASN  31           HA       ASN  31 -85.094 -25.408 -12.879
  255   1HB   ASN  31          2HB       ASN  31 -84.188 -26.180 -10.878
  256   2HB   ASN  31          1HB       ASN  31 -82.725 -26.779 -11.653
  257   1HD2  ASN  31          1HD2      ASN  31 -84.426 -23.683 -11.186
  258   2HD2  ASN  31          2HD2      ASN  31 -82.998 -22.776 -10.799
  259    H    ARG  32           H        ARG  32 -84.879 -23.862 -14.301
  260    HA   ARG  32           HA       ARG  32 -84.027 -22.358 -15.756
  261   1HB   ARG  32          2HB       ARG  32 -81.581 -23.218 -14.306
  262   2HB   ARG  32          1HB       ARG  32 -81.347 -22.383 -15.837
  263   1HG   ARG  32          2HG       ARG  32 -82.336 -20.426 -15.065
  264   2HG   ARG  32          1HG       ARG  32 -83.143 -21.250 -13.730
  265   1HD   ARG  32          2HD       ARG  32 -81.462 -20.406 -12.501
  266   2HD   ARG  32          1HD       ARG  32 -80.546 -21.764 -13.157
  267    HE   ARG  32           HE       ARG  32 -80.528 -19.107 -14.444
  268   1HH1  ARG  32          1HH1      ARG  32 -78.844 -21.854 -13.058
  269   2HH1  ARG  32          2HH1      ARG  32 -77.272 -21.311 -13.584
  270   1HH2  ARG  32          1HH2      ARG  32 -78.479 -18.411 -15.148
  271   2HH2  ARG  32          2HH2      ARG  32 -77.067 -19.357 -14.784
  272    HA   PRO  33           HA       PRO  33 -83.407 -24.549 -19.546
  273   1HB   PRO  33          2HB       PRO  33 -81.746 -22.315 -20.530
  274   2HB   PRO  33          1HB       PRO  33 -83.276 -22.940 -21.154
  275   1HG   PRO  33          2HG       PRO  33 -83.159 -20.593 -19.883
  276   2HG   PRO  33          1HG       PRO  33 -84.543 -21.683 -19.681
  277   1HD   PRO  33          2HD       PRO  33 -82.215 -21.221 -17.853
  278   2HD   PRO  33          1HD       PRO  33 -83.939 -21.402 -17.459
  279    H    ALA  34           H        ALA  34 -80.737 -23.407 -17.721
  280    HA   ALA  34           HA       ALA  34 -78.657 -24.203 -17.332
  281   1HB   ALA  34          1HB       ALA  34 -79.413 -26.542 -19.076
  282   2HB   ALA  34          2HB       ALA  34 -79.748 -26.418 -17.350
  283   3HB   ALA  34          3HB       ALA  34 -78.080 -26.466 -17.923
  284    H    ILE  35           H        ILE  35 -77.500 -22.636 -18.291
  285    HA   ILE  35           HA       ILE  35 -76.287 -23.264 -20.848
  286    HB   ILE  35           HB       ILE  35 -77.291 -20.461 -20.375
  287   1HG1  ILE  35          2HG1      ILE  35 -78.628 -21.715 -22.571
  288   2HG1  ILE  35          1HG1      ILE  35 -78.860 -22.715 -21.141
  289   1HG2  ILE  35          1HG2      ILE  35 -75.399 -21.599 -22.066
  290   2HG2  ILE  35          2HG2      ILE  35 -76.078 -19.970 -22.170
  291   3HG2  ILE  35          3HG2      ILE  35 -76.804 -21.289 -23.092
  292   1HD1  ILE  35          1HD1      ILE  35 -80.669 -21.253 -21.138
  293   2HD1  ILE  35          2HD1      ILE  35 -79.673 -19.871 -21.592
  294   3HD1  ILE  35          3HD1      ILE  35 -79.548 -20.554 -19.970
  295    H    ALA  36           H        ALA  36 -74.598 -23.746 -19.497
  296    HA   ALA  36           HA       ALA  36 -72.885 -21.512 -18.856
  297   1HB   ALA  36          1HB       ALA  36 -72.842 -21.634 -16.594
  298   2HB   ALA  36          2HB       ALA  36 -73.153 -23.369 -16.571
  299   3HB   ALA  36          3HB       ALA  36 -74.482 -22.239 -16.829
  300    H    ARG  37           H        ARG  37 -72.011 -24.108 -16.965
  301    HA   ARG  37           HA       ARG  37 -70.377 -25.671 -17.071
  302   1HB   ARG  37          2HB       ARG  37 -71.582 -25.954 -19.811
  303   2HB   ARG  37          1HB       ARG  37 -70.231 -26.955 -19.297
  304   1HG   ARG  37          2HG       ARG  37 -71.906 -28.334 -18.681
  305   2HG   ARG  37          1HG       ARG  37 -71.850 -27.349 -17.217
  306   1HD   ARG  37          2HD       ARG  37 -73.500 -25.985 -19.040
  307   2HD   ARG  37          1HD       ARG  37 -73.983 -27.679 -19.103
  308    HE   ARG  37           HE       ARG  37 -73.774 -26.259 -16.527
  309   1HH1  ARG  37          1HH1      ARG  37 -75.628 -28.068 -18.890
  310   2HH1  ARG  37          2HH1      ARG  37 -76.994 -28.295 -17.833
  311   1HH2  ARG  37          1HH2      ARG  37 -75.574 -26.554 -15.136
  312   2HH2  ARG  37          2HH2      ARG  37 -76.968 -27.425 -15.705
  313    H    GLY  38           H        GLY  38 -69.601 -23.000 -17.499
  314   1HA   GLY  38          2HA       GLY  38 -67.114 -23.488 -18.974
  315   2HA   GLY  38          1HA       GLY  38 -68.072 -22.070 -19.387
  316    H    GLY  39           H        GLY  39 -66.223 -20.799 -18.772
  317   1HA   GLY  39          2HA       GLY  39 -66.011 -19.159 -16.922
  318   2HA   GLY  39          1HA       GLY  39 -65.995 -20.539 -15.833
  319    H    ARG  40           H        ARG  40 -64.289 -22.247 -17.183
  320    HA   ARG  40           HA       ARG  40 -61.768 -20.732 -17.059
  321   1HB   ARG  40          2HB       ARG  40 -62.587 -23.176 -15.817
  322   2HB   ARG  40          1HB       ARG  40 -61.257 -23.518 -16.915
  323   1HG   ARG  40          2HG       ARG  40 -59.815 -22.027 -15.797
  324   2HG   ARG  40          1HG       ARG  40 -61.147 -21.299 -14.896
  325   1HD   ARG  40          2HD       ARG  40 -61.051 -22.859 -13.302
  326   2HD   ARG  40          1HD       ARG  40 -60.953 -24.168 -14.480
  327    HE   ARG  40           HE       ARG  40 -58.491 -23.384 -14.636
  328   1HH1  ARG  40          1HH1      ARG  40 -60.442 -23.420 -11.718
  329   2HH1  ARG  40          2HH1      ARG  40 -59.075 -23.656 -10.666
  330   1HH2  ARG  40          1HH2      ARG  40 -56.707 -23.728 -13.243
  331   2HH2  ARG  40          2HH2      ARG  40 -56.979 -23.847 -11.530
  332    H    ASN  41           H        ASN  41 -60.004 -21.659 -18.424
  333    HA   ASN  41           HA       ASN  41 -61.091 -22.423 -21.056
  334   1HB   ASN  41          2HB       ASN  41 -60.135 -20.018 -20.611
  335   2HB   ASN  41          1HB       ASN  41 -58.574 -20.820 -20.726
  336   1HD2  ASN  41          1HD2      ASN  41 -61.625 -21.186 -22.525
  337   2HD2  ASN  41          2HD2      ASN  41 -60.913 -20.930 -24.084
  338    H    ARG  42           H        ARG  42 -59.131 -23.241 -22.486
  339    HA   ARG  42           HA       ARG  42 -57.824 -25.312 -20.884
  340   1HB   ARG  42          2HB       ARG  42 -59.059 -26.324 -22.613
  341   2HB   ARG  42          1HB       ARG  42 -58.522 -25.148 -23.803
  342   1HG   ARG  42          2HG       ARG  42 -57.279 -26.983 -24.387
  343   2HG   ARG  42          1HG       ARG  42 -56.163 -26.148 -23.306
  344   1HD   ARG  42          2HD       ARG  42 -57.926 -27.924 -21.853
  345   2HD   ARG  42          1HD       ARG  42 -57.031 -28.783 -23.107
  346    HE   ARG  42           HE       ARG  42 -55.947 -27.500 -20.730
  347   1HH1  ARG  42          1HH1      ARG  42 -55.308 -29.072 -23.804
  348   2HH1  ARG  42          2HH1      ARG  42 -53.643 -29.415 -23.429
  349   1HH2  ARG  42          1HH2      ARG  42 -53.762 -27.967 -20.223
  350   2HH2  ARG  42          2HH2      ARG  42 -52.760 -28.779 -21.396
  351    HA   PRO  43           HA       PRO  43 -54.120 -23.281 -23.323
  352   1HB   PRO  43          2HB       PRO  43 -55.345 -20.756 -24.246
  353   2HB   PRO  43          1HB       PRO  43 -54.240 -21.841 -25.093
  354   1HG   PRO  43          2HG       PRO  43 -56.822 -21.673 -25.773
  355   2HG   PRO  43          1HG       PRO  43 -55.941 -23.211 -25.839
  356   1HD   PRO  43          2HD       PRO  43 -57.878 -22.221 -23.785
  357   2HD   PRO  43          1HD       PRO  43 -57.694 -23.849 -24.470
  358    H    ALA  44           H        ALA  44 -56.657 -21.552 -21.699
  359    HA   ALA  44           HA       ALA  44 -54.674 -20.077 -20.097
  360   1HB   ALA  44          1HB       ALA  44 -56.882 -19.090 -21.336
  361   2HB   ALA  44          2HB       ALA  44 -56.121 -18.363 -19.923
  362   3HB   ALA  44          3HB       ALA  44 -57.514 -19.426 -19.724
  363    HA   PRO  45           HA       PRO  45 -55.375 -23.622 -17.365
  364   1HB   PRO  45          2HB       PRO  45 -53.862 -22.331 -15.355
  365   2HB   PRO  45          1HB       PRO  45 -53.295 -23.560 -16.488
  366   1HG   PRO  45          2HG       PRO  45 -53.030 -20.605 -16.602
  367   2HG   PRO  45          1HG       PRO  45 -51.937 -21.861 -17.212
  368   1HD   PRO  45          2HD       PRO  45 -53.471 -20.421 -18.866
  369   2HD   PRO  45          1HD       PRO  45 -53.154 -22.143 -19.165
  370    H    TYR  46           H        TYR  46 -55.163 -20.474 -15.734
  371    HA   TYR  46           HA       TYR  46 -57.501 -21.191 -14.126
  372   1HB   TYR  46          2HB       TYR  46 -55.759 -18.763 -13.727
  373   2HB   TYR  46          1HB       TYR  46 -56.783 -19.577 -12.552
  374    HD1  TYR  46           1HD      TYR  46 -56.043 -21.706 -11.532
  375    HD2  TYR  46           2HD      TYR  46 -53.524 -19.501 -14.155
  376    HE1  TYR  46           1HE      TYR  46 -54.104 -23.002 -10.750
  377    HE2  TYR  46           2HE      TYR  46 -51.578 -20.788 -13.378
  378    HH   TYR  46           HH       TYR  46 -51.533 -23.475 -12.166
  379    H    SER  47           H        SER  47 -58.070 -18.399 -13.481
  380    HA   SER  47           HA       SER  47 -59.751 -17.655 -15.645
  381   1HB   SER  47          2HB       SER  47 -59.089 -15.497 -13.796
  382   2HB   SER  47          1HB       SER  47 -60.645 -16.274 -14.100
  383    HG   SER  47           HG       SER  47 -59.239 -16.513 -11.949
  384    H    ARG  48           H        ARG  48 -56.491 -16.994 -14.732
  385    HA   ARG  48           HA       ARG  48 -55.987 -15.789 -17.306
  386   1HB   ARG  48          2HB       ARG  48 -56.514 -14.027 -15.328
  387   2HB   ARG  48          1HB       ARG  48 -54.793 -14.264 -15.061
  388   1HG   ARG  48          2HG       ARG  48 -54.295 -12.929 -16.750
  389   2HG   ARG  48          1HG       ARG  48 -55.292 -13.881 -17.853
  390   1HD   ARG  48          2HD       ARG  48 -56.500 -11.988 -17.997
  391   2HD   ARG  48          1HD       ARG  48 -57.202 -12.553 -16.482
  392    HE   ARG  48           HE       ARG  48 -56.009 -10.931 -15.323
  393   1HH1  ARG  48          1HH1      ARG  48 -55.173 -10.904 -18.738
  394   2HH1  ARG  48          2HH1      ARG  48 -54.342  -9.380 -18.642
  395   1HH2  ARG  48          1HH2      ARG  48 -54.888  -8.937 -15.211
  396   2HH2  ARG  48          2HH2      ARG  48 -54.180  -8.267 -16.656
  397    HA   PRO  49           HA       PRO  49 -52.403 -18.409 -16.562
  398   1HB   PRO  49          2HB       PRO  49 -51.435 -17.185 -19.058
  399   2HB   PRO  49          1HB       PRO  49 -51.733 -18.885 -18.684
  400   1HG   PRO  49          2HG       PRO  49 -53.323 -17.487 -20.343
  401   2HG   PRO  49          1HG       PRO  49 -53.948 -18.767 -19.287
  402   1HD   PRO  49          2HD       PRO  49 -54.101 -15.799 -18.969
  403   2HD   PRO  49          1HD       PRO  49 -55.314 -17.043 -18.596
  404    H    LYS  50           H        LYS  50 -50.086 -18.078 -16.328
  405    HA   LYS  50           HA       LYS  50 -49.352 -15.245 -15.949
  406   1HB   LYS  50          2HB       LYS  50 -47.969 -17.369 -14.380
  407   2HB   LYS  50          1HB       LYS  50 -48.272 -15.690 -13.966
  408   1HG   LYS  50          2HG       LYS  50 -49.978 -16.319 -12.710
  409   2HG   LYS  50          1HG       LYS  50 -50.783 -16.979 -14.134
  410   1HD   LYS  50          2HD       LYS  50 -50.663 -18.843 -12.788
  411   2HD   LYS  50          1HD       LYS  50 -49.179 -19.009 -13.728
  412   1HE   LYS  50          2HE       LYS  50 -48.264 -17.522 -11.683
  413   2HE   LYS  50          1HE       LYS  50 -49.559 -18.396 -10.862
  414   1HZ   LYS  50          1HZ       LYS  50 -48.329 -20.226 -10.824
  415   2HZ   LYS  50          2HZ       LYS  50 -47.020 -19.321 -11.401
  416   3HZ   LYS  50          3HZ       LYS  50 -48.025 -20.149 -12.491
  417    HA   PRO  51           HA       PRO  51 -46.297 -16.388 -19.041
  418   1HB   PRO  51          2HB       PRO  51 -45.118 -13.915 -19.109
  419   2HB   PRO  51          1HB       PRO  51 -46.571 -14.338 -20.020
  420   1HG   PRO  51          2HG       PRO  51 -46.311 -12.849 -17.446
  421   2HG   PRO  51          1HG       PRO  51 -47.413 -12.562 -18.803
  422   1HD   PRO  51          2HD       PRO  51 -48.186 -13.789 -16.512
  423   2HD   PRO  51          1HD       PRO  51 -48.906 -14.162 -18.091
  424    H    LEU  52           H        LEU  52 -45.697 -14.656 -16.043
  425    HA   LEU  52           HA       LEU  52 -44.056 -14.733 -14.490
  426   1HB   LEU  52          2HB       LEU  52 -44.225 -17.460 -15.579
  427   2HB   LEU  52          1HB       LEU  52 -42.747 -17.098 -14.707
  428    HG   LEU  52           HG       LEU  52 -44.972 -16.159 -13.178
  429   1HD1  LEU  52          1HD1      LEU  52 -46.130 -18.240 -12.758
  430   2HD1  LEU  52          2HD1      LEU  52 -45.131 -19.066 -13.953
  431   3HD1  LEU  52          3HD1      LEU  52 -46.262 -17.813 -14.464
  432   1HD2  LEU  52          1HD2      LEU  52 -42.522 -17.567 -12.868
  433   2HD2  LEU  52          2HD2      LEU  52 -43.795 -18.467 -12.046
  434   3HD2  LEU  52          3HD2      LEU  52 -43.505 -16.776 -11.636
  435    HA   PRO  53           HA       PRO  53 -40.803 -13.368 -17.475
  436   1HB   PRO  53          2HB       PRO  53 -40.080 -11.262 -15.839
  437   2HB   PRO  53          1HB       PRO  53 -41.260 -11.159 -17.147
  438   1HG   PRO  53          2HG       PRO  53 -41.703 -11.467 -14.213
  439   2HG   PRO  53          1HG       PRO  53 -42.620 -10.513 -15.394
  440   1HD   PRO  53          2HD       PRO  53 -43.507 -12.880 -14.464
  441   2HD   PRO  53          1HD       PRO  53 -43.822 -12.343 -16.126
  442    H    ASP  54           H        ASP  54 -39.803 -12.241 -14.327
  443    HA   ASP  54           HA       ASP  54 -38.067 -12.804 -12.965
  444   1HB   ASP  54          2HB       ASP  54 -39.800 -14.549 -12.439
  445   2HB   ASP  54          1HB       ASP  54 -38.961 -15.635 -13.539
  446    H    LYS  55           H        LYS  55 -36.874 -12.092 -15.090
  447    HA   LYS  55           HA       LYS  55 -35.256 -14.293 -16.152
  448   1HB   LYS  55          2HB       LYS  55 -36.480 -12.564 -17.634
  449   2HB   LYS  55          1HB       LYS  55 -35.206 -11.455 -17.146
  450   1HG   LYS  55          2HG       LYS  55 -34.172 -12.227 -18.978
  451   2HG   LYS  55          1HG       LYS  55 -33.732 -13.578 -17.931
  452   1HD   LYS  55          2HD       LYS  55 -36.227 -14.294 -18.824
  453   2HD   LYS  55          1HD       LYS  55 -35.531 -13.488 -20.231
  454   1HE   LYS  55          2HE       LYS  55 -34.852 -15.680 -20.529
  455   2HE   LYS  55          1HE       LYS  55 -33.454 -14.953 -19.739
  456   1HZ   LYS  55          1HZ       LYS  55 -35.489 -16.164 -18.020
  457   2HZ   LYS  55          2HZ       LYS  55 -33.800 -16.119 -17.842
  458   3HZ   LYS  55          3HZ       LYS  55 -34.509 -17.215 -18.926
  459    H    TRP  56           H        TRP  56 -33.700 -14.653 -14.648
  460    HA   TRP  56           HA       TRP  56 -32.155 -12.337 -13.733
  461   1HB   TRP  56          2HB       TRP  56 -32.376 -13.314 -11.729
  462   2HB   TRP  56          1HB       TRP  56 -33.064 -14.761 -12.449
  463    HD1  TRP  56           HD       TRP  56 -31.646 -16.897 -12.322
  464    HE1  TRP  56           1HE      TRP  56 -29.244 -17.462 -11.575
  465    HE3  TRP  56           3HE      TRP  56 -29.859 -12.148 -11.708
  466    HZ2  TRP  56           2HZ      TRP  56 -26.909 -16.068 -10.826
  467    HZ3  TRP  56           3HZ      TRP  56 -27.531 -11.852 -10.973
  468    HH2  TRP  56           HH       TRP  56 -26.088 -13.772 -10.541
  469    H    GLN  57           H        GLN  57 -30.337 -11.924 -14.692
  470    HA   GLN  57           HA       GLN  57 -28.398 -13.955 -15.270
  471   1HB   GLN  57          2HB       GLN  57 -30.071 -13.826 -17.281
  472   2HB   GLN  57          1HB       GLN  57 -29.222 -12.331 -17.657
  473   1HG   GLN  57          2HG       GLN  57 -28.096 -13.877 -18.935
  474   2HG   GLN  57          1HG       GLN  57 -27.090 -13.783 -17.491
  475   1HE2  GLN  57          1HE2      GLN  57 -29.621 -15.647 -19.072
  476   2HE2  GLN  57          2HE2      GLN  57 -29.225 -17.158 -18.319
  477    H    HIS  58           H        HIS  58 -29.359 -10.658 -16.184
  478    HA   HIS  58           HA       HIS  58 -28.317  -8.652 -16.066
  479   1HB   HIS  58          2HB       HIS  58 -27.597 -10.047 -13.625
  480   2HB   HIS  58          1HB       HIS  58 -26.349  -8.901 -14.105
  481    HD1  HIS  58           1HD      HIS  58 -26.721  -6.555 -13.399
  482    HD2  HIS  58           2HD      HIS  58 -30.251  -8.751 -13.470
  483    HE1  HIS  58           1HE      HIS  58 -28.495  -5.019 -12.494
  484    HE2  HIS  58           2HE      HIS  58 -30.554  -6.458 -12.318
  485    H    ASP  59           H        ASP  59 -27.357 -10.410 -17.979
  486    HA   ASP  59           HA       ASP  59 -25.710 -10.610 -19.521
  487   1HB   ASP  59          2HB       ASP  59 -25.673  -8.008 -18.849
  488   2HB   ASP  59          1HB       ASP  59 -24.044  -8.450 -18.350
  489    H    LEU  60           H        LEU  60 -25.472 -11.808 -16.750
  490    HA   LEU  60           HA       LEU  60 -24.107 -13.239 -15.656
  491   1HB   LEU  60          2HB       LEU  60 -22.450 -12.977 -18.165
  492   2HB   LEU  60          1HB       LEU  60 -22.077 -14.093 -16.864
  493    HG   LEU  60           HG       LEU  60 -24.709 -14.687 -17.441
  494   1HD1  LEU  60          1HD1      LEU  60 -23.368 -14.566 -20.106
  495   2HD1  LEU  60          2HD1      LEU  60 -24.243 -13.159 -19.498
  496   3HD1  LEU  60          3HD1      LEU  60 -25.083 -14.697 -19.714
  497   1HD2  LEU  60          1HD2      LEU  60 -23.891 -16.763 -17.995
  498   2HD2  LEU  60          2HD2      LEU  60 -22.539 -16.092 -17.083
  499   3HD2  LEU  60          3HD2      LEU  60 -22.494 -16.106 -18.846
  500    H    PHE  61           H        PHE  61 -21.433 -11.606 -17.270
  501    HA   PHE  61           HA       PHE  61 -20.436 -10.717 -14.675
  502   1HB   PHE  61          2HB       PHE  61 -19.104 -11.837 -16.701
  503   2HB   PHE  61          1HB       PHE  61 -18.966 -10.157 -17.208
  504    HD1  PHE  61           1HD      PHE  61 -17.071  -9.059 -16.558
  505    HD2  PHE  61           2HD      PHE  61 -18.608 -12.151 -14.074
  506    HE1  PHE  61           1HE      PHE  61 -15.182  -8.752 -15.015
  507    HE2  PHE  61           2HE      PHE  61 -16.721 -11.849 -12.524
  508    HZ   PHE  61           HZ       PHE  61 -15.005 -10.139 -12.999
  509    H    ASP  62           H        ASP  62 -22.347  -9.626 -17.116
  510    HA   ASP  62           HA       ASP  62 -23.390  -7.666 -17.526
  511   1HB   ASP  62          2HB       ASP  62 -22.892  -7.240 -14.994
  512   2HB   ASP  62          1HB       ASP  62 -21.666  -6.139 -15.617
  513    H    SER  63           H        SER  63 -22.956  -5.468 -18.408
  514    HA   SER  63           HA       SER  63 -20.584  -5.632 -20.098
  515   1HB   SER  63          2HB       SER  63 -22.542  -3.503 -20.624
  516   2HB   SER  63          1HB       SER  63 -21.856  -4.703 -21.724
  517    HG   SER  63           HG       SER  63 -23.298  -6.254 -20.713
  518    H    GLY  64           H        GLY  64 -21.749  -4.025 -17.365
  519   1HA   GLY  64          2HA       GLY  64 -19.384  -2.364 -17.276
  520   2HA   GLY  64          1HA       GLY  64 -20.891  -1.464 -17.398
  521    H    CYS  65           H        CYS  65 -19.348  -4.052 -15.504
  522    HA   CYS  65           HA       CYS  65 -20.956  -3.193 -13.194
  523   1HB   CYS  65          2HB       CYS  65 -20.297  -5.771 -14.237
  524   2HB   CYS  65          1HB       CYS  65 -19.598  -5.620 -12.628
  525    HG   CYS  65           HG       CYS  65 -22.848  -4.746 -13.083
  526    H    GLY  66           H        GLY  66 -18.061  -2.537 -14.451
  527   1HA   GLY  66          2HA       GLY  66 -16.951  -1.218 -12.395
  528   2HA   GLY  66          1HA       GLY  66 -16.453  -2.869 -12.061
  529    H    GLY  67           H        GLY  67 -14.698  -3.653 -13.050
  530   1HA   GLY  67          2HA       GLY  67 -13.025  -3.835 -14.675
  531   2HA   GLY  67          1HA       GLY  67 -13.698  -2.431 -15.495
  532    H    GLY  68           H        GLY  68 -11.449  -1.728 -15.673
  533   1HA   GLY  68          2HA       GLY  68  -9.968  -1.009 -13.339
  534   2HA   GLY  68          1HA       GLY  68  -9.636  -0.480 -14.985
  535    H    GLU  69           H        GLU  69  -9.882   0.827 -12.222
  536    HA   GLU  69           HA       GLU  69 -11.685   3.005 -13.052
  537   1HB   GLU  69          2HB       GLU  69 -11.840   1.325 -10.745
  538   2HB   GLU  69          1HB       GLU  69 -11.449   2.953 -10.211
  539   1HG   GLU  69          2HG       GLU  69 -13.700   2.423 -12.114
  540   2HG   GLU  69          1HG       GLU  69 -13.908   2.289 -10.369
  541    H    GLY  70           H        GLY  70 -10.955   4.491 -10.615
  542   1HA   GLY  70          2HA       GLY  70  -8.132   5.113 -11.239
  543   2HA   GLY  70          1HA       GLY  70  -9.300   6.290 -10.644
  544    H    VAL  71           H        VAL  71  -9.077   3.022  -9.449
  545    HA   VAL  71           HA       VAL  71  -8.406   4.083  -6.821
  546    HB   VAL  71           HB       VAL  71 -10.376   2.797  -6.675
  547   1HG1  VAL  71          1HG1      VAL  71  -9.115   1.179  -8.747
  548   2HG1  VAL  71          2HG1      VAL  71 -10.822   1.468  -8.410
  549   3HG1  VAL  71          3HG1      VAL  71  -9.945   0.226  -7.517
  550   1HG2  VAL  71          1HG2      VAL  71  -7.956   1.714  -5.511
  551   2HG2  VAL  71          2HG2      VAL  71  -9.199   0.479  -5.718
  552   3HG2  VAL  71          3HG2      VAL  71  -9.553   1.939  -4.796
  553    H    GLU  72           H        GLU  72  -7.384   1.887  -9.266
  554    HA   GLU  72           HA       GLU  72  -5.143   0.836  -7.795
  555   1HB   GLU  72          2HB       GLU  72  -5.344   0.685 -10.776
  556   2HB   GLU  72          1HB       GLU  72  -4.765  -0.522  -9.639
  557   1HG   GLU  72          2HG       GLU  72  -6.726  -1.500 -10.190
  558   2HG   GLU  72          1HG       GLU  72  -7.314  -0.471  -8.885
  559    H    THR  73           H        THR  73  -5.832   3.502  -9.852
  560    HA   THR  73           HA       THR  73  -2.998   4.169 -10.148
  561    HB   THR  73           HB       THR  73  -4.336   6.119 -11.509
  562    HG1  THR  73           1HG      THR  73  -6.126   5.207 -12.495
  563   1HG2  THR  73          1HG2      THR  73  -2.607   4.099 -12.120
  564   2HG2  THR  73          2HG2      THR  73  -3.285   5.226 -13.295
  565   3HG2  THR  73          3HG2      THR  73  -4.027   3.642 -13.062
  566    H    GLY  74           H        GLY  74  -4.227   4.377  -7.592
  567   1HA   GLY  74          2HA       GLY  74  -4.997   7.073  -7.051
  568   2HA   GLY  74          1HA       GLY  74  -4.575   5.854  -5.856
  569    H    ALA  75           H        ALA  75  -2.404   5.614  -5.229
  570    HA   ALA  75           HA       ALA  75  -0.506   7.606  -6.256
  571   1HB   ALA  75          1HB       ALA  75   0.211   8.198  -4.041
  572   2HB   ALA  75          2HB       ALA  75  -0.858   6.996  -3.320
  573   3HB   ALA  75          3HB       ALA  75  -1.539   8.410  -4.124
  574    H    LYS  76           H        LYS  76   1.303   6.598  -6.927
  575    HA   LYS  76           HA       LYS  76   1.744   3.857  -5.981
  576   1HB   LYS  76          2HB       LYS  76   1.475   4.088  -8.378
  577   2HB   LYS  76          1HB       LYS  76   2.743   5.303  -8.438
  578   1HG   LYS  76          2HG       LYS  76   4.241   3.432  -7.458
  579   2HG   LYS  76          1HG       LYS  76   2.970   2.354  -8.039
  580   1HD   LYS  76          2HD       LYS  76   3.284   3.825 -10.237
  581   2HD   LYS  76          1HD       LYS  76   4.903   4.012  -9.558
  582   1HE   LYS  76          2HE       LYS  76   5.352   2.076 -10.589
  583   2HE   LYS  76          1HE       LYS  76   4.467   1.334  -9.257
  584   1HZ   LYS  76          1HZ       LYS  76   2.703   2.236 -11.300
  585   2HZ   LYS  76          2HZ       LYS  76   2.872   0.687 -10.638
  586   3HZ   LYS  76          3HZ       LYS  76   3.858   1.171 -11.930
  587    H    LEU  77           H        LEU  77   3.237   3.495  -4.556
  588    HA   LEU  77           HA       LEU  77   5.542   5.309  -4.335
  589   1HB   LEU  77          2HB       LEU  77   4.235   5.267  -2.339
  590   2HB   LEU  77          1HB       LEU  77   4.082   3.531  -2.387
  591    HG   LEU  77           HG       LEU  77   5.549   4.506  -0.577
  592   1HD1  LEU  77          1HD1      LEU  77   6.949   2.522  -2.335
  593   2HD1  LEU  77          2HD1      LEU  77   5.580   2.132  -1.294
  594   3HD1  LEU  77          3HD1      LEU  77   7.087   2.715  -0.587
  595   1HD2  LEU  77          1HD2      LEU  77   7.830   5.102  -1.147
  596   2HD2  LEU  77          2HD2      LEU  77   6.690   6.182  -1.951
  597   3HD2  LEU  77          3HD2      LEU  77   7.476   4.892  -2.862
  598    H    LEU  78           H        LEU  78   7.454   4.528  -4.982
  599    HA   LEU  78           HA       LEU  78   7.864   1.610  -4.943
  600   1HB   LEU  78          2HB       LEU  78   9.568   3.576  -6.450
  601   2HB   LEU  78          1HB       LEU  78   9.451   1.842  -6.677
  602    HG   LEU  78           HG       LEU  78   7.093   3.619  -7.214
  603   1HD1  LEU  78          1HD1      LEU  78   7.995   4.486  -9.044
  604   2HD1  LEU  78          2HD1      LEU  78   8.504   2.892  -9.604
  605   3HD1  LEU  78          3HD1      LEU  78   9.553   3.830  -8.537
  606   1HD2  LEU  78          1HD2      LEU  78   7.044   1.042  -7.053
  607   2HD2  LEU  78          2HD2      LEU  78   7.857   1.087  -8.618
  608   3HD2  LEU  78          3HD2      LEU  78   6.265   1.822  -8.429
  609    H    VAL  79           H        VAL  79   8.789   1.113  -3.034
  610    HA   VAL  79           HA       VAL  79  11.038   2.738  -2.084
  611    HB   VAL  79           HB       VAL  79  10.893   1.031  -0.114
  612   1HG1  VAL  79          1HG1      VAL  79   8.780   2.415   0.709
  613   2HG1  VAL  79          2HG1      VAL  79   9.216   3.395  -0.691
  614   3HG1  VAL  79          3HG1      VAL  79  10.393   3.119   0.594
  615   1HG2  VAL  79          1HG2      VAL  79   9.197  -0.398  -0.036
  616   2HG2  VAL  79          2HG2      VAL  79   8.923  -0.010  -1.734
  617   3HG2  VAL  79          3HG2      VAL  79   8.030   0.848  -0.479
  618    H    SER  80           H        SER  80  13.033   2.099  -2.647
  619    HA   SER  80           HA       SER  80  13.636  -0.764  -2.454
  620   1HB   SER  80          2HB       SER  80  15.215  -0.106  -4.569
  621   2HB   SER  80          1HB       SER  80  13.630  -0.860  -4.714
  622    HG   SER  80           HG       SER  80  12.870   1.457  -4.679
  623    H    ASN  81           H        ASN  81  16.015  -1.180  -2.455
  624    HA   ASN  81           HA       ASN  81  18.202  -0.763  -1.972
  625   1HB   ASN  81          2HB       ASN  81  17.232   2.015  -2.329
  626   2HB   ASN  81          1HB       ASN  81  18.682   1.819  -1.354
  627   1HD2  ASN  81          1HD2      ASN  81  19.462   3.150  -3.225
  628   2HD2  ASN  81          2HD2      ASN  81  20.087   2.288  -4.595
  629    H    LEU  82           H        LEU  82  16.702  -1.815  -0.079
  630    HA   LEU  82           HA       LEU  82  17.542  -0.393   2.365
  631   1HB   LEU  82          2HB       LEU  82  15.105  -1.980   1.733
  632   2HB   LEU  82          1HB       LEU  82  15.772  -2.126   3.349
  633    HG   LEU  82           HG       LEU  82  14.186  -0.467   3.614
  634   1HD1  LEU  82          1HD1      LEU  82  16.814   0.859   3.013
  635   2HD1  LEU  82          2HD1      LEU  82  16.147   0.401   4.581
  636   3HD1  LEU  82          3HD1      LEU  82  15.433   1.734   3.675
  637   1HD2  LEU  82          1HD2      LEU  82  13.968   1.439   1.968
  638   2HD2  LEU  82          2HD2      LEU  82  13.446  -0.146   1.399
  639   3HD2  LEU  82          3HD2      LEU  82  15.005   0.504   0.892
  640    H    ASP  83           H        ASP  83  18.610  -1.570   3.943
  641    HA   ASP  83           HA       ASP  83  19.601  -4.194   3.059
  642   1HB   ASP  83          2HB       ASP  83  21.099  -2.095   3.756
  643   2HB   ASP  83          1HB       ASP  83  20.857  -2.781   5.361
  644    H    PHE  84           H        PHE  84  17.288  -2.941   4.943
  645    HA   PHE  84           HA       PHE  84  17.579  -4.457   7.343
  646   1HB   PHE  84          2HB       PHE  84  15.574  -2.622   6.184
  647   2HB   PHE  84          1HB       PHE  84  14.943  -3.822   7.305
  648    HD1  PHE  84           1HD      PHE  84  15.795  -0.580   7.192
  649    HD2  PHE  84           2HD      PHE  84  16.831  -4.079   9.381
  650    HE1  PHE  84           1HE      PHE  84  16.515   0.820   9.082
  651    HE2  PHE  84           2HE      PHE  84  17.552  -2.684  11.275
  652    HZ   PHE  84           HZ       PHE  84  17.385  -0.225  11.126
  653    H    GLY  85           H        GLY  85  16.598  -5.259   4.212
  654   1HA   GLY  85          2HA       GLY  85  15.695  -7.165   3.304
  655   2HA   GLY  85          1HA       GLY  85  16.016  -7.938   4.853
  656    H    VAL  86           H        VAL  86  13.929  -5.175   4.231
  657    HA   VAL  86           HA       VAL  86  11.829  -6.237   5.799
  658    HB   VAL  86           HB       VAL  86  10.514  -4.311   4.539
  659   1HG1  VAL  86          1HG1      VAL  86  11.227  -4.432   6.937
  660   2HG1  VAL  86          2HG1      VAL  86  11.182  -2.805   6.259
  661   3HG1  VAL  86          3HG1      VAL  86  12.726  -3.631   6.465
  662   1HG2  VAL  86          1HG2      VAL  86  11.760  -2.676   3.503
  663   2HG2  VAL  86          2HG2      VAL  86  12.602  -4.132   2.970
  664   3HG2  VAL  86          3HG2      VAL  86  13.259  -3.166   4.292
  665    H    SER  87           H        SER  87  10.304  -7.615   5.291
  666    HA   SER  87           HA       SER  87  10.021  -8.515   2.548
  667   1HB   SER  87          2HB       SER  87   8.268  -9.657   4.629
  668   2HB   SER  87          1HB       SER  87   9.287 -10.469   3.446
  669    HG   SER  87           HG       SER  87  10.054  -9.325   5.930
  670    H    ASP  88           H        ASP  88   7.435  -9.341   2.428
  671    HA   ASP  88           HA       ASP  88   6.073  -7.061   1.551
  672   1HB   ASP  88          2HB       ASP  88   4.133  -8.564   1.273
  673   2HB   ASP  88          1HB       ASP  88   5.611  -9.265   0.629
  674    H    ALA  89           H        ALA  89   5.446  -9.102   4.393
  675    HA   ALA  89           HA       ALA  89   3.377  -7.498   5.433
  676   1HB   ALA  89          1HB       ALA  89   4.209  -8.717   7.639
  677   2HB   ALA  89          2HB       ALA  89   5.074  -9.702   6.459
  678   3HB   ALA  89          3HB       ALA  89   3.317  -9.567   6.377
  679    H    ASP  90           H        ASP  90   6.833  -7.295   5.621
  680    HA   ASP  90           HA       ASP  90   6.999  -5.607   7.905
  681   1HB   ASP  90          2HB       ASP  90   8.891  -6.197   5.636
  682   2HB   ASP  90          1HB       ASP  90   9.286  -5.027   6.889
  683    H    ILE  91           H        ILE  91   7.609  -4.823   4.487
  684    HA   ILE  91           HA       ILE  91   7.505  -2.080   4.652
  685    HB   ILE  91           HB       ILE  91   6.784  -3.953   2.416
  686   1HG1  ILE  91          2HG1      ILE  91   9.157  -3.690   3.109
  687   2HG1  ILE  91          1HG1      ILE  91   8.865  -3.168   1.452
  688   1HG2  ILE  91          1HG2      ILE  91   5.569  -2.329   1.472
  689   2HG2  ILE  91          2HG2      ILE  91   7.118  -1.541   1.170
  690   3HG2  ILE  91          3HG2      ILE  91   6.167  -1.103   2.589
  691   1HD1  ILE  91          1HD1      ILE  91   8.524  -0.859   2.912
  692   2HD1  ILE  91          2HD1      ILE  91   9.965  -1.319   2.006
  693   3HD1  ILE  91          3HD1      ILE  91   9.857  -1.675   3.730
  694    H    GLN  92           H        GLN  92   4.795  -4.327   4.287
  695    HA   GLN  92           HA       GLN  92   2.827  -2.321   3.870
  696   1HB   GLN  92          2HB       GLN  92   2.699  -4.897   3.469
  697   2HB   GLN  92          1HB       GLN  92   2.170  -4.951   5.146
  698   1HG   GLN  92          2HG       GLN  92   0.639  -2.942   4.018
  699   2HG   GLN  92          1HG       GLN  92   0.717  -4.184   2.769
  700   1HE2  GLN  92          1HE2      GLN  92   0.317  -6.446   3.619
  701   2HE2  GLN  92          2HE2      GLN  92  -0.983  -6.625   4.747
  702    H    GLU  93           H        GLU  93   3.812  -4.143   6.765
  703    HA   GLU  93           HA       GLU  93   2.108  -2.914   8.603
  704   1HB   GLU  93          2HB       GLU  93   4.422  -4.621   8.685
  705   2HB   GLU  93          1HB       GLU  93   4.555  -3.386   9.929
  706   1HG   GLU  93          2HG       GLU  93   1.970  -4.810   9.670
  707   2HG   GLU  93          1HG       GLU  93   3.337  -5.692  10.349
  708    H    LEU  94           H        LEU  94   5.217  -1.898   7.326
  709    HA   LEU  94           HA       LEU  94   5.670   0.264   9.083
  710   1HB   LEU  94          2HB       LEU  94   6.801  -0.770   6.603
  711   2HB   LEU  94          1HB       LEU  94   6.846   0.980   6.682
  712    HG   LEU  94           HG       LEU  94   7.836  -0.560   9.034
  713   1HD1  LEU  94          1HD1      LEU  94   8.936  -1.735   7.275
  714   2HD1  LEU  94          2HD1      LEU  94  10.096  -0.598   7.962
  715   3HD1  LEU  94          3HD1      LEU  94   9.308  -0.235   6.427
  716   1HD2  LEU  94          1HD2      LEU  94   7.897   2.141   8.022
  717   2HD2  LEU  94          2HD2      LEU  94   9.526   1.548   8.348
  718   3HD2  LEU  94          3HD2      LEU  94   8.309   1.530   9.625
  719    H    PHE  95           H        PHE  95   4.773   0.442   5.659
  720    HA   PHE  95           HA       PHE  95   3.856   3.053   5.759
  721   1HB   PHE  95          2HB       PHE  95   3.793   0.899   3.820
  722   2HB   PHE  95          1HB       PHE  95   2.378   1.948   3.701
  723    HD1  PHE  95           1HD      PHE  95   2.857   4.510   3.703
  724    HD2  PHE  95           2HD      PHE  95   5.754   1.525   2.803
  725    HE1  PHE  95           1HE      PHE  95   4.196   6.178   2.482
  726    HE2  PHE  95           2HE      PHE  95   7.097   3.188   1.588
  727    HZ   PHE  95           HZ       PHE  95   6.331   5.583   1.536
  728    H    ALA  96           H        ALA  96   2.109   0.178   6.733
  729    HA   ALA  96           HA       ALA  96  -0.435   1.443   6.953
  730   1HB   ALA  96          1HB       ALA  96  -1.097  -0.421   8.251
  731   2HB   ALA  96          2HB       ALA  96   0.566  -0.775   8.726
  732   3HB   ALA  96          3HB       ALA  96   0.046  -1.048   7.061
  733    H    GLU  97           H        GLU  97   2.180   0.913   9.181
  734    HA   GLU  97           HA       GLU  97   1.326   2.486  11.344
  735   1HB   GLU  97          2HB       GLU  97   3.788   1.313  10.540
  736   2HB   GLU  97          1HB       GLU  97   4.118   2.989  10.964
  737   1HG   GLU  97          2HG       GLU  97   2.439   1.405  12.820
  738   2HG   GLU  97          1HG       GLU  97   4.160   1.033  12.747
  739    H    PHE  98           H        PHE  98   2.863   3.413   8.324
  740    HA   PHE  98           HA       PHE  98   2.900   6.213   8.811
  741   1HB   PHE  98          2HB       PHE  98   3.110   4.553   6.308
  742   2HB   PHE  98          1HB       PHE  98   3.175   6.310   6.277
  743    HD1  PHE  98           1HD      PHE  98   5.315   4.482   5.279
  744    HD2  PHE  98           2HD      PHE  98   4.702   6.272   9.089
  745    HE1  PHE  98           1HE      PHE  98   7.735   4.395   5.701
  746    HE2  PHE  98           2HE      PHE  98   7.124   6.193   9.518
  747    HZ   PHE  98           HZ       PHE  98   8.642   5.253   7.820
  748    H    GLY  99           H        GLY  99   0.262   4.280   8.476
  749   1HA   GLY  99          2HA       GLY  99  -1.832   5.733   8.447
  750   2HA   GLY  99          1HA       GLY  99  -1.240   6.276   6.889
  751    H    THR 100           H        THR 100  -3.572   5.507   6.512
  752    HA   THR 100           HA       THR 100  -4.065   2.706   6.420
  753    HB   THR 100           HB       THR 100  -5.814   4.104   4.656
  754    HG1  THR 100           1HG      THR 100  -6.065   5.393   7.093
  755   1HG2  THR 100          1HG2      THR 100  -6.413   3.383   7.510
  756   2HG2  THR 100          2HG2      THR 100  -6.172   2.137   6.288
  757   3HG2  THR 100          3HG2      THR 100  -7.476   3.312   6.104
  758    H    LEU 101           H        LEU 101  -3.429   1.302   4.944
  759    HA   LEU 101           HA       LEU 101  -2.318   2.308   2.425
  760   1HB   LEU 101          2HB       LEU 101  -1.625   0.174   4.268
  761   2HB   LEU 101          1HB       LEU 101  -1.765  -0.417   2.624
  762    HG   LEU 101           HG       LEU 101   0.096   1.722   3.646
  763   1HD1  LEU 101          1HD1      LEU 101   1.427  -0.037   3.931
  764   2HD1  LEU 101          2HD1      LEU 101   1.479  -0.173   2.173
  765   3HD1  LEU 101          3HD1      LEU 101   0.308  -1.114   3.097
  766   1HD2  LEU 101          1HD2      LEU 101  -0.178   0.815   0.788
  767   2HD2  LEU 101          2HD2      LEU 101   0.833   2.113   1.422
  768   3HD2  LEU 101          3HD2      LEU 101  -0.921   2.285   1.416
  769    H    LYS 102           H        LYS 102  -3.248   1.873   0.539
  770    HA   LYS 102           HA       LYS 102  -5.642   0.284   0.403
  771   1HB   LYS 102          2HB       LYS 102  -4.593   2.301  -1.170
  772   2HB   LYS 102          1HB       LYS 102  -4.394   0.871  -2.175
  773   1HG   LYS 102          2HG       LYS 102  -6.524   2.099  -2.543
  774   2HG   LYS 102          1HG       LYS 102  -6.731   0.404  -2.106
  775   1HD   LYS 102          2HD       LYS 102  -6.681   2.251   0.173
  776   2HD   LYS 102          1HD       LYS 102  -8.036   2.490  -0.931
  777   1HE   LYS 102          2HE       LYS 102  -9.061   0.659  -0.185
  778   2HE   LYS 102          1HE       LYS 102  -7.608  -0.315  -0.407
  779   1HZ   LYS 102          1HZ       LYS 102  -7.029  -0.103   1.753
  780   2HZ   LYS 102          2HZ       LYS 102  -8.687   0.165   1.964
  781   3HZ   LYS 102          3HZ       LYS 102  -7.624   1.479   1.888
  782    H    LYS 103           H        LYS 103  -2.545  -0.012  -1.354
  783    HA   LYS 103           HA       LYS 103  -2.497  -2.832  -0.624
  784   1HB   LYS 103          2HB       LYS 103  -1.989  -3.561  -2.891
  785   2HB   LYS 103          1HB       LYS 103  -3.566  -2.791  -2.826
  786   1HG   LYS 103          2HG       LYS 103  -2.868  -0.949  -4.016
  787   2HG   LYS 103          1HG       LYS 103  -1.173  -1.182  -3.587
  788   1HD   LYS 103          2HD       LYS 103  -1.094  -1.920  -5.740
  789   2HD   LYS 103          1HD       LYS 103  -1.541  -3.435  -4.950
  790   1HE   LYS 103          2HE       LYS 103  -3.543  -1.494  -6.090
  791   2HE   LYS 103          1HE       LYS 103  -2.876  -2.848  -7.000
  792   1HZ   LYS 103          1HZ       LYS 103  -4.687  -2.885  -4.677
  793   2HZ   LYS 103          2HZ       LYS 103  -3.688  -4.221  -4.986
  794   3HZ   LYS 103          3HZ       LYS 103  -4.817  -3.720  -6.147
  795    H    ALA 104           H        ALA 104  -0.421  -3.767  -0.646
  796    HA   ALA 104           HA       ALA 104   1.828  -2.188  -1.555
  797   1HB   ALA 104          1HB       ALA 104   2.617  -2.976   1.029
  798   2HB   ALA 104          2HB       ALA 104   1.063  -2.161   1.201
  799   3HB   ALA 104          3HB       ALA 104   2.410  -1.334   0.410
  800    H    ALA 105           H        ALA 105   2.629  -3.698  -2.849
  801    HA   ALA 105           HA       ALA 105   3.161  -6.372  -1.719
  802   1HB   ALA 105          1HB       ALA 105   2.719  -7.347  -3.735
  803   2HB   ALA 105          2HB       ALA 105   3.235  -5.932  -4.653
  804   3HB   ALA 105          3HB       ALA 105   1.653  -5.948  -3.872
  805    H    VAL 106           H        VAL 106   5.270  -7.234  -2.032
  806    HA   VAL 106           HA       VAL 106   7.224  -5.114  -2.451
  807    HB   VAL 106           HB       VAL 106   8.842  -6.780  -1.466
  808   1HG1  VAL 106          1HG1      VAL 106   7.912  -4.980  -0.150
  809   2HG1  VAL 106          2HG1      VAL 106   8.015  -6.443   0.830
  810   3HG1  VAL 106          3HG1      VAL 106   6.461  -5.929   0.171
  811   1HG2  VAL 106          1HG2      VAL 106   8.242  -8.881  -1.087
  812   2HG2  VAL 106          2HG2      VAL 106   6.693  -8.544  -1.858
  813   3HG2  VAL 106          3HG2      VAL 106   6.869  -8.356  -0.114
  814    H    ASP 107           H        ASP 107   9.379  -5.850  -3.231
  815    HA   ASP 107           HA       ASP 107   9.194  -7.534  -5.614
  816   1HB   ASP 107          2HB       ASP 107   8.945  -4.831  -5.877
  817   2HB   ASP 107          1HB       ASP 107  10.695  -5.007  -5.965
  818    H    TYR 108           H        TYR 108  11.460  -7.932  -6.477
  819    HA   TYR 108           HA       TYR 108  13.383  -7.903  -4.254
  820   1HB   TYR 108          2HB       TYR 108  12.460 -10.323  -5.802
  821   2HB   TYR 108          1HB       TYR 108  13.971 -10.298  -4.902
  822    HD1  TYR 108           1HD      TYR 108  10.297  -9.858  -4.508
  823    HD2  TYR 108           2HD      TYR 108  13.990 -10.779  -2.611
  824    HE1  TYR 108           1HE      TYR 108   9.086 -10.480  -2.459
  825    HE2  TYR 108           2HE      TYR 108  12.792 -11.406  -0.563
  826    HH   TYR 108           HH       TYR 108  10.769 -11.146   0.531
  827    H    ASP 109           H        ASP 109  15.574  -8.809  -5.083
  828    HA   ASP 109           HA       ASP 109  16.105  -7.514  -7.662
  829   1HB   ASP 109          2HB       ASP 109  17.525  -6.455  -6.182
  830   2HB   ASP 109          1HB       ASP 109  17.660  -7.863  -5.138
  831    H    ARG 110           H        ARG 110  17.623  -8.592  -9.098
  832    HA   ARG 110           HA       ARG 110  16.883 -11.130  -9.785
  833   1HB   ARG 110          2HB       ARG 110  18.981 -11.193 -11.160
  834   2HB   ARG 110          1HB       ARG 110  17.979  -9.765 -11.379
  835   1HG   ARG 110          2HG       ARG 110  19.464  -8.430 -10.084
  836   2HG   ARG 110          1HG       ARG 110  20.388  -9.848  -9.581
  837   1HD   ARG 110          2HD       ARG 110  20.560 -10.094 -12.256
  838   2HD   ARG 110          1HD       ARG 110  20.447  -8.339 -12.115
  839    HE   ARG 110           HE       ARG 110  22.457  -8.341 -10.845
  840   1HH1  ARG 110          1HH1      ARG 110  21.607 -11.464 -12.190
  841   2HH1  ARG 110          2HH1      ARG 110  23.219 -12.103 -12.058
  842   1HH2  ARG 110          1HH2      ARG 110  24.572  -9.193 -10.623
  843   2HH2  ARG 110          2HH2      ARG 110  24.903 -10.820 -11.145
  844    H    SER 111           H        SER 111  19.338 -10.295  -7.416
  845    HA   SER 111           HA       SER 111  20.532 -12.917  -7.430
  846   1HB   SER 111          2HB       SER 111  20.798 -10.714  -5.373
  847   2HB   SER 111          1HB       SER 111  21.850 -12.119  -5.545
  848    HG   SER 111           HG       SER 111  22.288 -11.310  -7.723
  849    H    GLY 112           H        GLY 112  17.551 -12.139  -6.588
  850   1HA   GLY 112          2HA       GLY 112  15.961 -13.242  -5.361
  851   2HA   GLY 112          1HA       GLY 112  17.177 -14.462  -5.011
  852    H    ARG 113           H        ARG 113  17.540 -11.079  -4.211
  853    HA   ARG 113           HA       ARG 113  17.588 -11.864  -1.381
  854   1HB   ARG 113          2HB       ARG 113  19.118 -10.027  -0.997
  855   2HB   ARG 113          1HB       ARG 113  19.731 -11.032  -2.302
  856   1HG   ARG 113          2HG       ARG 113  18.887  -9.412  -3.936
  857   2HG   ARG 113          1HG       ARG 113  18.302  -8.399  -2.616
  858   1HD   ARG 113          2HD       ARG 113  20.357  -7.610  -2.146
  859   2HD   ARG 113          1HD       ARG 113  21.125  -9.176  -2.412
  860    HE   ARG 113           HE       ARG 113  20.565  -8.476  -4.917
  861   1HH1  ARG 113          1HH1      ARG 113  21.936  -6.558  -2.310
  862   2HH1  ARG 113          2HH1      ARG 113  22.889  -5.566  -3.381
  863   1HH2  ARG 113          1HH2      ARG 113  21.819  -7.183  -6.310
  864   2HH2  ARG 113          2HH2      ARG 113  22.833  -5.929  -5.651
  865    H    SER 114           H        SER 114  16.608 -10.581   0.165
  866    HA   SER 114           HA       SER 114  14.342  -9.032  -0.739
  867   1HB   SER 114          2HB       SER 114  14.796  -8.877   2.105
  868   2HB   SER 114          1HB       SER 114  13.489  -9.683   1.237
  869    HG   SER 114           HG       SER 114  14.411 -11.428   1.989
  870    H    LEU 115           H        LEU 115  15.637  -7.402  -1.806
  871    HA   LEU 115           HA       LEU 115  17.528  -5.867  -0.288
  872   1HB   LEU 115          2HB       LEU 115  18.221  -5.010  -2.291
  873   2HB   LEU 115          1HB       LEU 115  17.526  -6.533  -2.814
  874    HG   LEU 115           HG       LEU 115  15.983  -3.947  -2.907
  875   1HD1  LEU 115          1HD1      LEU 115  16.760  -3.464  -5.008
  876   2HD1  LEU 115          2HD1      LEU 115  17.260  -5.127  -5.322
  877   3HD1  LEU 115          3HD1      LEU 115  18.225  -4.102  -4.258
  878   1HD2  LEU 115          1HD2      LEU 115  14.870  -6.256  -3.019
  879   2HD2  LEU 115          2HD2      LEU 115  15.624  -6.389  -4.609
  880   3HD2  LEU 115          3HD2      LEU 115  14.482  -5.083  -4.279
  881    H    GLY 116           H        GLY 116  14.509  -5.830   0.281
  882   1HA   GLY 116          2HA       GLY 116  13.096  -4.299   1.229
  883   2HA   GLY 116          1HA       GLY 116  14.441  -3.169   1.207
  884    H    THR 117           H        THR 117  12.311  -4.729  -1.190
  885    HA   THR 117           HA       THR 117  11.798  -2.048  -2.263
  886    HB   THR 117           HB       THR 117  12.296  -4.522  -3.929
  887    HG1  THR 117           1HG      THR 117  13.988  -2.860  -2.794
  888   1HG2  THR 117          1HG2      THR 117  12.322  -1.873  -5.199
  889   2HG2  THR 117          2HG2      THR 117  10.739  -2.380  -4.610
  890   3HG2  THR 117          3HG2      THR 117  11.617  -3.389  -5.759
  891    H    ALA 118           H        ALA 118   9.734  -1.624  -2.895
  892    HA   ALA 118           HA       ALA 118   7.792  -3.719  -3.244
  893   1HB   ALA 118          1HB       ALA 118   8.059  -3.264  -0.696
  894   2HB   ALA 118          2HB       ALA 118   6.446  -3.404  -1.398
  895   3HB   ALA 118          3HB       ALA 118   7.119  -1.812  -1.045
  896    H    ASP 119           H        ASP 119   5.673  -2.883  -3.753
  897    HA   ASP 119           HA       ASP 119   5.632  -0.077  -4.657
  898   1HB   ASP 119          2HB       ASP 119   5.653  -1.390  -6.658
  899   2HB   ASP 119          1HB       ASP 119   4.533  -2.565  -5.985
  900    H    VAL 120           H        VAL 120   4.436   0.896  -3.094
  901    HA   VAL 120           HA       VAL 120   2.009  -0.509  -2.229
  902    HB   VAL 120           HB       VAL 120   2.129   0.464  -0.134
  903   1HG1  VAL 120          1HG1      VAL 120   3.931  -1.023  -0.114
  904   2HG1  VAL 120          2HG1      VAL 120   4.607   0.468   0.545
  905   3HG1  VAL 120          3HG1      VAL 120   4.924   0.022  -1.132
  906   1HG2  VAL 120          1HG2      VAL 120   2.217   2.759  -0.681
  907   2HG2  VAL 120          2HG2      VAL 120   3.821   2.584  -1.399
  908   3HG2  VAL 120          3HG2      VAL 120   3.616   2.441   0.350
  909    H    HIS 121           H        HIS 121   0.076   0.672  -2.085
  910    HA   HIS 121           HA       HIS 121   0.039   3.118  -3.725
  911   1HB   HIS 121          2HB       HIS 121  -1.398   0.538  -4.043
  912   2HB   HIS 121          1HB       HIS 121  -2.329   2.005  -4.344
  913    HD1  HIS 121           1HD      HIS 121   0.648   0.086  -5.655
  914    HD2  HIS 121           2HD      HIS 121  -1.717   3.350  -6.675
  915    HE1  HIS 121           1HE      HIS 121   1.254   0.644  -8.024
  916    HE2  HIS 121           2HE      HIS 121  -0.321   2.501  -8.685
  917    H    PHE 122           H        PHE 122  -0.807   4.763  -2.590
  918    HA   PHE 122           HA       PHE 122  -2.901   4.170  -0.623
  919   1HB   PHE 122          2HB       PHE 122  -2.051   6.968  -0.871
  920   2HB   PHE 122          1HB       PHE 122  -2.219   5.968   0.564
  921    HD1  PHE 122           1HD      PHE 122   0.046   7.272  -1.937
  922    HD2  PHE 122           2HD      PHE 122  -0.351   4.559   1.313
  923    HE1  PHE 122           1HE      PHE 122   2.494   7.117  -1.771
  924    HE2  PHE 122           2HE      PHE 122   2.096   4.402   1.489
  925    HZ   PHE 122           HZ       PHE 122   3.523   5.740  -0.014
  926    H    GLU 123           H        GLU 123  -4.826   5.540  -0.610
  927    HA   GLU 123           HA       GLU 123  -5.808   6.003  -3.289
  928   1HB   GLU 123          2HB       GLU 123  -7.719   7.018  -1.555
  929   2HB   GLU 123          1HB       GLU 123  -7.694   5.403  -2.245
  930   1HG   GLU 123          2HG       GLU 123  -6.802   4.459  -0.315
  931   2HG   GLU 123          1HG       GLU 123  -6.248   6.015   0.302
  932    H    ARG 124           H        ARG 124  -4.219   7.839  -0.918
  933    HA   ARG 124           HA       ARG 124  -5.386  10.365  -1.836
  934   1HB   ARG 124          2HB       ARG 124  -3.870   9.571   0.637
  935   2HB   ARG 124          1HB       ARG 124  -4.131  11.256   0.207
  936   1HG   ARG 124          2HG       ARG 124  -5.887  10.891   1.624
  937   2HG   ARG 124          1HG       ARG 124  -6.637  10.525   0.071
  938   1HD   ARG 124          2HD       ARG 124  -7.261   8.803   1.595
  939   2HD   ARG 124          1HD       ARG 124  -6.092   8.119   0.467
  940    HE   ARG 124           HE       ARG 124  -4.470   8.789   2.446
  941   1HH1  ARG 124          1HH1      ARG 124  -7.575   7.152   2.510
  942   2HH1  ARG 124          2HH1      ARG 124  -7.258   6.352   4.023
  943   1HH2  ARG 124          1HH2      ARG 124  -4.049   7.735   4.408
  944   2HH2  ARG 124          2HH2      ARG 124  -5.244   6.677   5.105
  945    H    ARG 125           H        ARG 125  -4.220  11.846  -2.925
  946    HA   ARG 125           HA       ARG 125  -1.631  11.236  -3.902
  947   1HB   ARG 125          2HB       ARG 125  -2.770  12.535  -5.394
  948   2HB   ARG 125          1HB       ARG 125  -3.609  13.431  -4.139
  949   1HG   ARG 125          2HG       ARG 125  -1.570  14.728  -3.717
  950   2HG   ARG 125          1HG       ARG 125  -0.757  13.844  -5.011
  951   1HD   ARG 125          2HD       ARG 125  -2.040  14.826  -6.666
  952   2HD   ARG 125          1HD       ARG 125  -3.341  15.243  -5.551
  953    HE   ARG 125           HE       ARG 125  -1.768  16.946  -4.625
  954   1HH1  ARG 125          1HH1      ARG 125  -1.369  15.750  -7.888
  955   2HH1  ARG 125          2HH1      ARG 125  -0.566  17.182  -8.458
  956   1HH2  ARG 125          1HH2      ARG 125  -0.751  18.846  -5.370
  957   2HH2  ARG 125          2HH2      ARG 125  -0.250  18.961  -7.031
  958    H    ALA 126           H        ALA 126  -2.852  13.361  -1.348
  959    HA   ALA 126           HA       ALA 126  -0.425  14.716  -0.837
  960   1HB   ALA 126          1HB       ALA 126  -1.704  14.721   1.580
  961   2HB   ALA 126          2HB       ALA 126  -3.034  14.467   0.449
  962   3HB   ALA 126          3HB       ALA 126  -1.983  15.873   0.274
  963    H    ASP 127           H        ASP 127  -1.680  11.645   0.167
  964    HA   ASP 127           HA       ASP 127   0.107  11.045   2.245
  965   1HB   ASP 127          2HB       ASP 127  -1.579   9.446   0.387
  966   2HB   ASP 127          1HB       ASP 127  -0.274   8.596   1.209
  967    H    ALA 128           H        ALA 128   0.423  10.918  -1.235
  968    HA   ALA 128           HA       ALA 128   3.001   9.612  -1.195
  969   1HB   ALA 128          1HB       ALA 128   2.687  10.838  -3.679
  970   2HB   ALA 128          2HB       ALA 128   1.051  10.387  -3.194
  971   3HB   ALA 128          3HB       ALA 128   2.316   9.161  -3.274
  972    H    LEU 129           H        LEU 129   1.703  12.832  -1.703
  973    HA   LEU 129           HA       LEU 129   4.024  14.262  -2.231
  974   1HB   LEU 129          2HB       LEU 129   1.666  15.118  -2.287
  975   2HB   LEU 129          1HB       LEU 129   1.713  15.211  -0.539
  976    HG   LEU 129           HG       LEU 129   3.937  16.629  -1.766
  977   1HD1  LEU 129          1HD1      LEU 129   2.891  18.165  -3.071
  978   2HD1  LEU 129          2HD1      LEU 129   1.361  18.023  -2.206
  979   3HD1  LEU 129          3HD1      LEU 129   1.828  16.794  -3.380
  980   1HD2  LEU 129          1HD2      LEU 129   1.702  17.462   0.079
  981   2HD2  LEU 129          2HD2      LEU 129   3.159  18.396  -0.267
  982   3HD2  LEU 129          3HD2      LEU 129   3.280  16.849   0.572
  983    H    LYS 130           H        LYS 130   2.533  13.534   0.906
  984    HA   LYS 130           HA       LYS 130   4.549  14.761   2.463
  985   1HB   LYS 130          2HB       LYS 130   2.750  14.489   3.801
  986   2HB   LYS 130          1HB       LYS 130   2.187  13.074   2.925
  987   1HG   LYS 130          2HG       LYS 130   4.578  12.467   4.409
  988   2HG   LYS 130          1HG       LYS 130   3.333  13.150   5.461
  989   1HD   LYS 130          2HD       LYS 130   3.023  10.784   3.611
  990   2HD   LYS 130          1HD       LYS 130   3.123  10.732   5.373
  991   1HE   LYS 130          2HE       LYS 130   1.070  12.281   5.323
  992   2HE   LYS 130          1HE       LYS 130   0.910  11.782   3.640
  993   1HZ   LYS 130          1HZ       LYS 130  -0.267  10.104   4.478
  994   2HZ   LYS 130          2HZ       LYS 130   0.327  10.327   6.053
  995   3HZ   LYS 130          3HZ       LYS 130   1.227   9.432   4.929
  996    H    ALA 131           H        ALA 131   4.106  11.473   1.263
  997    HA   ALA 131           HA       ALA 131   6.150  10.255   2.753
  998   1HB   ALA 131          1HB       ALA 131   5.520   9.305  -0.003
  999   2HB   ALA 131          2HB       ALA 131   4.279   9.220   1.249
 1000   3HB   ALA 131          3HB       ALA 131   5.814   8.373   1.467
 1001    H    MET 132           H        MET 132   6.200  11.883  -0.381
 1002    HA   MET 132           HA       MET 132   8.948  11.186  -0.870
 1003   1HB   MET 132          2HB       MET 132   8.742  12.303  -2.931
 1004   2HB   MET 132          1HB       MET 132   7.169  11.573  -2.654
 1005   1HG   MET 132          2HG       MET 132   6.170  13.625  -2.171
 1006   2HG   MET 132          1HG       MET 132   7.721  14.416  -1.894
 1007   1HE   MET 132          1HE       MET 132   5.805  12.544  -5.094
 1008   2HE   MET 132          2HE       MET 132   5.331  14.145  -5.661
 1009   3HE   MET 132          3HE       MET 132   4.926  13.634  -4.021
 1010    H    LYS 133           H        LYS 133   7.268  13.742   0.713
 1011    HA   LYS 133           HA       LYS 133   9.547  15.520   0.711
 1012   1HB   LYS 133          2HB       LYS 133   6.750  15.634   1.517
 1013   2HB   LYS 133          1HB       LYS 133   7.810  16.365   2.712
 1014   1HG   LYS 133          2HG       LYS 133   6.965  17.988   1.078
 1015   2HG   LYS 133          1HG       LYS 133   8.724  17.855   1.047
 1016   1HD   LYS 133          2HD       LYS 133   8.674  16.560  -0.946
 1017   2HD   LYS 133          1HD       LYS 133   6.926  16.344  -0.838
 1018   1HE   LYS 133          2HE       LYS 133   6.744  18.107  -2.195
 1019   2HE   LYS 133          1HE       LYS 133   7.263  19.094  -0.831
 1020   1HZ   LYS 133          1HZ       LYS 133   8.753  18.251  -3.193
 1021   2HZ   LYS 133          2HZ       LYS 133   9.621  18.320  -1.736
 1022   3HZ   LYS 133          3HZ       LYS 133   8.831  19.703  -2.321
 1023    H    GLN 134           H        GLN 134   7.833  13.523   3.084
 1024    HA   GLN 134           HA       GLN 134   9.701  14.215   5.163
 1025   1HB   GLN 134          2HB       GLN 134   7.117  12.836   4.977
 1026   2HB   GLN 134          1HB       GLN 134   8.194  12.188   6.207
 1027   1HG   GLN 134          2HG       GLN 134   6.563  14.017   6.897
 1028   2HG   GLN 134          1HG       GLN 134   8.246  14.189   7.393
 1029   1HE2  GLN 134          1HE2      GLN 134   5.787  15.312   5.174
 1030   2HE2  GLN 134          2HE2      GLN 134   6.560  16.806   4.765
 1031    H    TYR 135           H        TYR 135   8.757  11.076   3.677
 1032    HA   TYR 135           HA       TYR 135  10.760   9.706   5.188
 1033   1HB   TYR 135          2HB       TYR 135   9.374   8.629   2.733
 1034   2HB   TYR 135          1HB       TYR 135  10.075   7.718   4.064
 1035    HD1  TYR 135           1HD      TYR 135   7.202   7.573   2.876
 1036    HD2  TYR 135           2HD      TYR 135   8.869   9.575   6.238
 1037    HE1  TYR 135           1HE      TYR 135   5.014   7.499   3.998
 1038    HE2  TYR 135           2HE      TYR 135   6.688   9.505   7.369
 1039    HH   TYR 135           HH       TYR 135   3.836   8.078   5.783
 1040    H    LYS 136           H        LYS 136  10.489  10.719   1.804
 1041    HA   LYS 136           HA       LYS 136  12.971   9.615   1.003
 1042   1HB   LYS 136          2HB       LYS 136  10.999  10.438  -0.456
 1043   2HB   LYS 136          1HB       LYS 136  11.735  12.026  -0.299
 1044   1HG   LYS 136          2HG       LYS 136  13.606   9.927  -1.091
 1045   2HG   LYS 136          1HG       LYS 136  12.299  10.203  -2.244
 1046   1HD   LYS 136          2HD       LYS 136  14.068  12.370  -1.116
 1047   2HD   LYS 136          1HD       LYS 136  14.328  11.578  -2.672
 1048   1HE   LYS 136          2HE       LYS 136  12.725  12.781  -3.672
 1049   2HE   LYS 136          1HE       LYS 136  11.612  12.582  -2.321
 1050   1HZ   LYS 136          1HZ       LYS 136  12.375  14.916  -2.811
 1051   2HZ   LYS 136          2HZ       LYS 136  13.902  14.458  -2.227
 1052   3HZ   LYS 136          3HZ       LYS 136  12.552  14.407  -1.202
 1053    H    GLY 137           H        GLY 137  14.913  10.204   1.616
 1054   1HA   GLY 137          2HA       GLY 137  16.526  12.094   1.707
 1055   2HA   GLY 137          1HA       GLY 137  15.289  12.962   2.613
 1056    H    VAL 138           H        VAL 138  14.913   9.924   3.617
 1057    HA   VAL 138           HA       VAL 138  16.604  10.324   5.970
 1058    HB   VAL 138           HB       VAL 138  14.347   8.373   5.490
 1059   1HG1  VAL 138          1HG1      VAL 138  14.824   7.335   7.411
 1060   2HG1  VAL 138          2HG1      VAL 138  15.153   8.852   8.248
 1061   3HG1  VAL 138          3HG1      VAL 138  16.414   8.084   7.285
 1062   1HG2  VAL 138          1HG2      VAL 138  13.519   9.951   7.506
 1063   2HG2  VAL 138          2HG2      VAL 138  13.163  10.270   5.809
 1064   3HG2  VAL 138          3HG2      VAL 138  14.501  11.102   6.601
 1065    HA   PRO 139           HA       PRO 139  19.441   7.159   4.492
 1066   1HB   PRO 139          2HB       PRO 139  21.016   7.319   6.725
 1067   2HB   PRO 139          1HB       PRO 139  21.188   8.395   5.335
 1068   1HG   PRO 139          2HG       PRO 139  19.817   8.872   7.946
 1069   2HG   PRO 139          1HG       PRO 139  20.822   9.974   6.988
 1070   1HD   PRO 139          2HD       PRO 139  18.120  10.110   7.000
 1071   2HD   PRO 139          1HD       PRO 139  19.088  10.524   5.571
 1072    H    LEU 140           H        LEU 140  18.857   5.054   4.747
 1073    HA   LEU 140           HA       LEU 140  17.795   4.296   7.372
 1074   1HB   LEU 140          2HB       LEU 140  16.413   4.406   4.836
 1075   2HB   LEU 140          1HB       LEU 140  16.450   2.761   5.441
 1076    HG   LEU 140           HG       LEU 140  15.686   4.744   7.460
 1077   1HD1  LEU 140          1HD1      LEU 140  13.283   4.553   6.260
 1078   2HD1  LEU 140          2HD1      LEU 140  14.334   4.659   4.847
 1079   3HD1  LEU 140          3HD1      LEU 140  14.370   5.929   6.070
 1080   1HD2  LEU 140          1HD2      LEU 140  15.230   2.671   8.227
 1081   2HD2  LEU 140          2HD2      LEU 140  15.014   2.002   6.610
 1082   3HD2  LEU 140          3HD2      LEU 140  13.712   2.922   7.364
 1083    H    ASP 141           H        ASP 141  18.879   2.602   8.150
 1084    HA   ASP 141           HA       ASP 141  20.607   1.137   8.299
 1085   1HB   ASP 141          2HB       ASP 141  18.554  -0.055   7.002
 1086   2HB   ASP 141          1HB       ASP 141  19.840  -0.272   5.817
 1087    H    GLY 142           H        GLY 142  21.988   3.039   7.640
 1088   1HA   GLY 142          2HA       GLY 142  24.195   3.153   6.828
 1089   2HA   GLY 142          1HA       GLY 142  23.769   2.006   5.568
 1090    H    ARG 143           H        ARG 143  21.804   3.029   4.160
 1091    HA   ARG 143           HA       ARG 143  22.875   5.645   3.292
 1092   1HB   ARG 143          2HB       ARG 143  22.911   3.158   1.938
 1093   2HB   ARG 143          1HB       ARG 143  21.728   4.165   1.116
 1094   1HG   ARG 143          2HG       ARG 143  23.287   5.616   0.350
 1095   2HG   ARG 143          1HG       ARG 143  24.335   5.405   1.754
 1096   1HD   ARG 143          2HD       ARG 143  23.924   3.281  -0.338
 1097   2HD   ARG 143          1HD       ARG 143  25.215   4.481  -0.419
 1098    HE   ARG 143           HE       ARG 143  24.928   2.476   1.732
 1099   1HH1  ARG 143          1HH1      ARG 143  26.893   4.527  -0.327
 1100   2HH1  ARG 143          2HH1      ARG 143  28.399   3.944   0.329
 1101   1HH2  ARG 143          1HH2      ARG 143  26.875   1.735   2.608
 1102   2HH2  ARG 143          2HH2      ARG 143  28.391   2.376   2.030
 1103    HA   PRO 144           HA       PRO 144  18.664   7.170   3.219
 1104   1HB   PRO 144          2HB       PRO 144  19.446   8.433   0.643
 1105   2HB   PRO 144          1HB       PRO 144  18.747   9.170   2.088
 1106   1HG   PRO 144          2HG       PRO 144  21.320   9.521   1.482
 1107   2HG   PRO 144          1HG       PRO 144  20.793   9.320   3.163
 1108   1HD   PRO 144          2HD       PRO 144  22.120   7.355   1.344
 1109   2HD   PRO 144          1HD       PRO 144  22.345   7.611   3.086
 1110    H    MET 145           H        MET 145  16.920   6.106   2.530
 1111    HA   MET 145           HA       MET 145  17.322   4.029   0.590
 1112   1HB   MET 145          2HB       MET 145  15.424   3.039   1.423
 1113   2HB   MET 145          1HB       MET 145  15.930   3.993   2.807
 1114   1HG   MET 145          2HG       MET 145  14.014   5.095   2.822
 1115   2HG   MET 145          1HG       MET 145  14.190   5.538   1.125
 1116   1HE   MET 145          1HE       MET 145  12.857   3.286   3.755
 1117   2HE   MET 145          2HE       MET 145  11.526   2.419   2.989
 1118   3HE   MET 145          3HE       MET 145  11.428   4.166   3.213
 1119    H    ASP 146           H        ASP 146  15.483   3.567  -0.978
 1120    HA   ASP 146           HA       ASP 146  15.117   6.016  -2.566
 1121   1HB   ASP 146          2HB       ASP 146  16.215   3.727  -3.402
 1122   2HB   ASP 146          1HB       ASP 146  14.527   3.354  -3.753
 1123    H    ILE 147           H        ILE 147  13.245   6.943  -2.430
 1124    HA   ILE 147           HA       ILE 147  10.826   5.296  -2.160
 1125    HB   ILE 147           HB       ILE 147  10.431   7.879  -0.964
 1126   1HG1  ILE 147          2HG1      ILE 147  12.897   6.423  -0.159
 1127   2HG1  ILE 147          1HG1      ILE 147  12.554   8.148  -0.137
 1128   1HG2  ILE 147          1HG2      ILE 147   9.192   6.693   0.502
 1129   2HG2  ILE 147          2HG2      ILE 147  10.424   5.446   0.702
 1130   3HG2  ILE 147          3HG2      ILE 147   9.376   5.431  -0.719
 1131   1HD1  ILE 147          1HD1      ILE 147  10.899   7.385   1.797
 1132   2HD1  ILE 147          2HD1      ILE 147  12.595   7.773   2.087
 1133   3HD1  ILE 147          3HD1      ILE 147  12.090   6.091   1.929
 1134    H    GLN 148           H        GLN 148   9.974   5.522  -4.148
 1135    HA   GLN 148           HA       GLN 148  10.000   8.207  -5.342
 1136   1HB   GLN 148          2HB       GLN 148   9.450   5.641  -6.816
 1137   2HB   GLN 148          1HB       GLN 148   9.947   7.194  -7.476
 1138   1HG   GLN 148          2HG       GLN 148  12.152   6.943  -6.568
 1139   2HG   GLN 148          1HG       GLN 148  11.677   5.477  -5.712
 1140   1HE2  GLN 148          1HE2      GLN 148  13.367   4.357  -6.782
 1141   2HE2  GLN 148          2HE2      GLN 148  13.188   3.854  -8.431
 1142    H    LEU 149           H        LEU 149   8.156   9.257  -5.422
 1143    HA   LEU 149           HA       LEU 149   5.655   7.739  -5.075
 1144   1HB   LEU 149          2HB       LEU 149   6.561  10.421  -4.092
 1145   2HB   LEU 149          1HB       LEU 149   4.852  10.153  -4.381
 1146    HG   LEU 149           HG       LEU 149   5.170   9.761  -2.087
 1147   1HD1  LEU 149          1HD1      LEU 149   4.588   7.540  -3.825
 1148   2HD1  LEU 149          2HD1      LEU 149   3.832   8.010  -2.302
 1149   3HD1  LEU 149          3HD1      LEU 149   5.273   6.991  -2.295
 1150   1HD2  LEU 149          1HD2      LEU 149   7.709   8.522  -2.963
 1151   2HD2  LEU 149          2HD2      LEU 149   6.935   7.841  -1.532
 1152   3HD2  LEU 149          3HD2      LEU 149   7.366   9.551  -1.572
 1153    H    VAL 150           H        VAL 150   4.777   7.491  -7.074
 1154    HA   VAL 150           HA       VAL 150   4.805   9.854  -8.828
 1155    HB   VAL 150           HB       VAL 150   4.966   8.015 -10.715
 1156   1HG1  VAL 150          1HG1      VAL 150   7.196   9.268  -9.151
 1157   2HG1  VAL 150          2HG1      VAL 150   6.519   9.761 -10.701
 1158   3HG1  VAL 150          3HG1      VAL 150   7.507   8.305 -10.594
 1159   1HG2  VAL 150          1HG2      VAL 150   5.106   6.003  -9.601
 1160   2HG2  VAL 150          2HG2      VAL 150   6.072   6.674  -8.287
 1161   3HG2  VAL 150          3HG2      VAL 150   6.811   6.374  -9.862
 1162    H    ALA 151           H        ALA 151   3.095  10.149 -10.134
 1163    HA   ALA 151           HA       ALA 151   1.059   9.936 -11.114
 1164   1HB   ALA 151          1HB       ALA 151   0.172   7.397 -11.058
 1165   2HB   ALA 151          2HB       ALA 151   1.893   7.123 -10.796
 1166   3HB   ALA 151          3HB       ALA 151   1.348   7.994 -12.229
 1167    H    SER 152           H        SER 152   1.498  10.130  -8.119
 1168    HA   SER 152           HA       SER 152  -0.794   9.062  -6.833
 1169   1HB   SER 152          2HB       SER 152   0.176  11.464  -5.588
 1170   2HB   SER 152          1HB       SER 152   0.351   9.792  -5.050
 1171    HG   SER 152           HG       SER 152   2.319   9.752  -5.818
 1172    H    GLN 153           H        GLN 153  -2.530   9.612  -8.232
 1173    HA   GLN 153           HA       GLN 153  -4.173  10.859  -9.183
 1174   1HB   GLN 153          2HB       GLN 153  -3.500  12.412  -6.730
 1175   2HB   GLN 153          1HB       GLN 153  -4.521  13.187  -7.935
 1176   1HG   GLN 153          2HG       GLN 153  -5.341  10.464  -7.294
 1177   2HG   GLN 153          1HG       GLN 153  -5.383  11.561  -5.915
 1178   1HE2  GLN 153          1HE2      GLN 153  -7.107  10.395  -8.467
 1179   2HE2  GLN 153          2HE2      GLN 153  -8.300  11.642  -8.604
 1180    H    ILE 154           H        ILE 154  -1.192  11.304  -9.685
 1181    HA   ILE 154           HA       ILE 154  -0.996  13.965 -10.725
 1182    HB   ILE 154           HB       ILE 154   0.882  11.608 -11.021
 1183   1HG1  ILE 154          2HG1      ILE 154   0.332  12.217  -8.641
 1184   2HG1  ILE 154          1HG1      ILE 154   2.033  12.344  -9.065
 1185   1HG2  ILE 154          1HG2      ILE 154   2.289  13.996 -10.885
 1186   2HG2  ILE 154          2HG2      ILE 154   0.951  14.285 -11.998
 1187   3HG2  ILE 154          3HG2      ILE 154   2.066  12.949 -12.285
 1188   1HD1  ILE 154          1HD1      ILE 154   1.315  14.203  -7.675
 1189   2HD1  ILE 154          2HD1      ILE 154   0.089  14.634  -8.867
 1190   3HD1  ILE 154          3HD1      ILE 154   1.801  14.762  -9.276
 1191    H    ASP 155           H        ASP 155  -3.043  13.312 -11.990
 1192    HA   ASP 155           HA       ASP 155  -2.230  12.736 -14.729
 1193   1HB   ASP 155          2HB       ASP 155  -3.139  10.640 -13.292
 1194   2HB   ASP 155          1HB       ASP 155  -4.671  11.290 -13.867
 1195    H    LEU 156           H        LEU 156  -3.814  14.655 -12.644
 1196    HA   LEU 156           HA       LEU 156  -6.126  15.167 -14.384
 1197   1HB   LEU 156          2HB       LEU 156  -5.916  16.531 -11.772
 1198   2HB   LEU 156          1HB       LEU 156  -7.312  15.830 -12.566
 1199    HG   LEU 156           HG       LEU 156  -5.173  14.145 -11.284
 1200   1HD1  LEU 156          1HD1      LEU 156  -6.527  14.009  -9.314
 1201   2HD1  LEU 156          2HD1      LEU 156  -7.765  15.036 -10.037
 1202   3HD1  LEU 156          3HD1      LEU 156  -6.183  15.707  -9.642
 1203   1HD2  LEU 156          1HD2      LEU 156  -6.888  13.284 -13.020
 1204   2HD2  LEU 156          2HD2      LEU 156  -8.044  13.423 -11.696
 1205   3HD2  LEU 156          3HD2      LEU 156  -6.637  12.373 -11.531
 1206    H    GLU 157           H        GLU 157  -3.489  16.729 -12.656
 1207    HA   GLU 157           HA       GLU 157  -2.523  18.750 -12.794
 1208   1HB   GLU 157          2HB       GLU 157  -3.182  18.034 -15.576
 1209   2HB   GLU 157          1HB       GLU 157  -2.694  19.704 -15.275
 1210   1HG   GLU 157          2HG       GLU 157  -0.947  18.065 -13.816
 1211   2HG   GLU 157          1HG       GLU 157  -1.093  17.359 -15.417
 1212    H    HIS 158           H        HIS 158  -4.626  19.170 -11.469
 1213    HA   HIS 158           HA       HIS 158  -5.781  21.629 -12.537
 1214   1HB   HIS 158          2HB       HIS 158  -7.226  19.178 -12.290
 1215   2HB   HIS 158          1HB       HIS 158  -7.833  20.297 -11.075
 1216    HD1  HIS 158           1HD      HIS 158  -9.518  21.936 -11.857
 1217    HD2  HIS 158           2HD      HIS 158  -7.269  20.385 -14.990
 1218    HE1  HIS 158           1HE      HIS 158 -10.543  22.869 -13.954
 1219    HE2  HIS 158           2HE      HIS 158  -9.013  22.115 -15.808
  Start of MODEL   13
    1    H    MET   1           H        MET   1-128.440  68.153 -26.561
    2    HA   MET   1           HA       MET   1-127.197  65.613 -25.885
    3   1HB   MET   1          2HB       MET   1-127.588  67.081 -28.276
    4   2HB   MET   1          1HB       MET   1-125.850  66.991 -28.013
    5   1HG   MET   1          2HG       MET   1-127.641  64.582 -27.916
    6   2HG   MET   1          1HG       MET   1-126.873  65.153 -29.397
    7   1HE   MET   1          1HE       MET   1-123.381  64.856 -29.151
    8   2HE   MET   1          2HE       MET   1-124.873  65.054 -30.073
    9   3HE   MET   1          3HE       MET   1-124.181  63.446 -29.848
   10    H    ALA   2           H        ALA   2-126.338  69.022 -26.208
   11    HA   ALA   2           HA       ALA   2-124.763  70.315 -25.209
   12   1HB   ALA   2          1HB       ALA   2-125.574  69.456 -23.109
   13   2HB   ALA   2          2HB       ALA   2-123.815  69.584 -23.042
   14   3HB   ALA   2          3HB       ALA   2-124.578  68.011 -23.273
   15    H    ASP   3           H        ASP   3-124.108  68.299 -27.267
   16    HA   ASP   3           HA       ASP   3-121.194  68.316 -26.881
   17   1HB   ASP   3          2HB       ASP   3-121.799  66.012 -26.724
   18   2HB   ASP   3          1HB       ASP   3-122.921  66.142 -28.071
   19    H    LYS   4           H        LYS   4-123.274  67.411 -29.591
   20    HA   LYS   4           HA       LYS   4-123.286  68.021 -31.775
   21   1HB   LYS   4          2HB       LYS   4-123.491  70.463 -30.191
   22   2HB   LYS   4          1HB       LYS   4-122.847  70.754 -31.801
   23   1HG   LYS   4          2HG       LYS   4-124.890  70.667 -32.632
   24   2HG   LYS   4          1HG       LYS   4-125.052  69.002 -32.067
   25   1HD   LYS   4          2HD       LYS   4-126.380  69.599 -30.362
   26   2HD   LYS   4          1HD       LYS   4-125.369  70.986 -29.948
   27   1HE   LYS   4          2HE       LYS   4-126.525  72.412 -31.322
   28   2HE   LYS   4          1HE       LYS   4-127.028  71.123 -32.415
   29   1HZ   LYS   4          1HZ       LYS   4-128.831  72.091 -31.023
   30   2HZ   LYS   4          2HZ       LYS   4-128.079  71.428 -29.655
   31   3HZ   LYS   4          3HZ       LYS   4-128.665  70.409 -30.879
   32    H    MET   5           H        MET   5-120.805  67.109 -30.841
   33    HA   MET   5           HA       MET   5-118.996  68.515 -32.678
   34   1HB   MET   5          2HB       MET   5-118.783  68.986 -30.030
   35   2HB   MET   5          1HB       MET   5-117.779  67.548 -30.157
   36   1HG   MET   5          2HG       MET   5-116.246  69.225 -30.455
   37   2HG   MET   5          1HG       MET   5-116.658  68.815 -32.120
   38   1HE   MET   5          1HE       MET   5-117.333  71.487 -29.187
   39   2HE   MET   5          2HE       MET   5-118.843  70.654 -29.550
   40   3HE   MET   5          3HE       MET   5-118.656  72.359 -29.959
   41    H    ASP   6           H        ASP   6-119.656  65.673 -30.687
   42    HA   ASP   6           HA       ASP   6-117.774  64.017 -32.126
   43   1HB   ASP   6          2HB       ASP   6-119.384  63.790 -29.748
   44   2HB   ASP   6          1HB       ASP   6-119.656  62.390 -30.781
   45    H    MET   7           H        MET   7-121.062  64.954 -32.344
   46    HA   MET   7           HA       MET   7-122.613  64.770 -33.976
   47   1HB   MET   7          2HB       MET   7-120.190  64.410 -35.348
   48   2HB   MET   7          1HB       MET   7-121.261  63.146 -35.930
   49   1HG   MET   7          2HG       MET   7-121.522  66.098 -36.161
   50   2HG   MET   7          1HG       MET   7-121.723  64.847 -37.385
   51   1HE   MET   7          1HE       MET   7-124.517  63.047 -36.867
   52   2HE   MET   7          2HE       MET   7-123.449  63.803 -38.050
   53   3HE   MET   7          3HE       MET   7-125.107  64.375 -37.866
   54    H    SER   8           H        SER   8-120.975  61.737 -34.763
   55    HA   SER   8           HA       SER   8-123.497  60.344 -34.589
   56   1HB   SER   8          2HB       SER   8-121.353  58.545 -35.054
   57   2HB   SER   8          1HB       SER   8-122.507  59.180 -36.230
   58    HG   SER   8           HG       SER   8-121.106  60.726 -36.814
   59    H    LEU   9           H        LEU   9-123.279  61.058 -32.139
   60    HA   LEU   9           HA       LEU   9-121.536  59.911 -30.349
   61   1HB   LEU   9          2HB       LEU   9-123.730  61.524 -30.180
   62   2HB   LEU   9          1HB       LEU   9-124.314  60.069 -29.400
   63    HG   LEU   9           HG       LEU   9-123.079  62.051 -28.085
   64   1HD1  LEU   9          1HD1      LEU   9-124.012  60.512 -26.712
   65   2HD1  LEU   9          2HD1      LEU   9-122.323  60.053 -26.506
   66   3HD1  LEU   9          3HD1      LEU   9-123.355  59.143 -27.611
   67   1HD2  LEU   9          1HD2      LEU   9-120.887  60.151 -28.898
   68   2HD2  LEU   9          2HD2      LEU   9-120.773  61.277 -27.545
   69   3HD2  LEU   9          3HD2      LEU   9-120.964  61.889 -29.189
   70    H    ASP  10           H        ASP  10-124.743  58.612 -31.242
   71    HA   ASP  10           HA       ASP  10-124.491  56.308 -29.619
   72   1HB   ASP  10          2HB       ASP  10-126.501  55.516 -30.645
   73   2HB   ASP  10          1HB       ASP  10-126.658  57.258 -30.459
   74    H    ASP  11           H        ASP  11-123.530  56.988 -32.912
   75    HA   ASP  11           HA       ASP  11-123.072  54.259 -33.626
   76   1HB   ASP  11          2HB       ASP  11-123.399  56.276 -35.209
   77   2HB   ASP  11          1HB       ASP  11-121.690  56.596 -34.927
   78    H    ILE  12           H        ILE  12-121.000  56.916 -32.516
   79    HA   ILE  12           HA       ILE  12-118.569  55.523 -32.457
   80    HB   ILE  12           HB       ILE  12-119.528  57.617 -30.510
   81   1HG1  ILE  12          2HG1      ILE  12-117.620  58.163 -32.752
   82   2HG1  ILE  12          1HG1      ILE  12-119.345  58.078 -33.104
   83   1HG2  ILE  12          1HG2      ILE  12-116.833  57.896 -30.616
   84   2HG2  ILE  12          2HG2      ILE  12-116.991  56.148 -30.818
   85   3HG2  ILE  12          3HG2      ILE  12-117.683  56.938 -29.401
   86   1HD1  ILE  12          1HD1      ILE  12-118.741  59.728 -30.792
   87   2HD1  ILE  12          2HD1      ILE  12-119.724  60.078 -32.214
   88   3HD1  ILE  12          3HD1      ILE  12-117.975  60.298 -32.276
   89    H    ILE  13           H        ILE  13-121.075  55.932 -30.006
   90    HA   ILE  13           HA       ILE  13-120.082  54.500 -27.909
   91    HB   ILE  13           HB       ILE  13-122.886  54.665 -28.990
   92   1HG1  ILE  13          2HG1      ILE  13-121.696  55.746 -26.433
   93   2HG1  ILE  13          1HG1      ILE  13-121.719  56.643 -27.950
   94   1HG2  ILE  13          1HG2      ILE  13-123.462  53.788 -26.594
   95   2HG2  ILE  13          2HG2      ILE  13-121.881  53.016 -26.719
   96   3HG2  ILE  13          3HG2      ILE  13-123.134  52.656 -27.907
   97   1HD1  ILE  13          1HD1      ILE  13-124.115  55.685 -26.400
   98   2HD1  ILE  13          2HD1      ILE  13-124.174  56.515 -27.955
   99   3HD1  ILE  13          3HD1      ILE  13-123.539  57.347 -26.535
  100    H    LYS  14           H        LYS  14-121.999  53.094 -30.577
  101    HA   LYS  14           HA       LYS  14-121.707  50.424 -29.765
  102   1HB   LYS  14          2HB       LYS  14-122.077  51.441 -32.585
  103   2HB   LYS  14          1HB       LYS  14-122.469  49.831 -31.992
  104   1HG   LYS  14          2HG       LYS  14-123.783  52.377 -31.070
  105   2HG   LYS  14          1HG       LYS  14-124.445  51.265 -32.268
  106   1HD   LYS  14          2HD       LYS  14-124.296  49.469 -30.501
  107   2HD   LYS  14          1HD       LYS  14-123.939  50.754 -29.346
  108   1HE   LYS  14          2HE       LYS  14-126.344  50.068 -29.441
  109   2HE   LYS  14          1HE       LYS  14-126.054  51.784 -29.722
  110   1HZ   LYS  14          1HZ       LYS  14-127.529  50.161 -31.309
  111   2HZ   LYS  14          2HZ       LYS  14-126.048  50.214 -32.132
  112   3HZ   LYS  14          3HZ       LYS  14-126.867  51.653 -31.778
  113    H    LEU  15           H        LEU  15-119.920  52.276 -32.222
  114    HA   LEU  15           HA       LEU  15-118.269  50.170 -33.053
  115   1HB   LEU  15          2HB       LEU  15-118.684  52.369 -34.223
  116   2HB   LEU  15          1HB       LEU  15-117.546  53.094 -33.104
  117    HG   LEU  15           HG       LEU  15-116.212  50.877 -34.191
  118   1HD1  LEU  15          1HD1      LEU  15-117.813  52.382 -36.240
  119   2HD1  LEU  15          2HD1      LEU  15-117.694  50.639 -36.004
  120   3HD1  LEU  15          3HD1      LEU  15-116.315  51.538 -36.635
  121   1HD2  LEU  15          1HD2      LEU  15-114.968  52.752 -33.636
  122   2HD2  LEU  15          2HD2      LEU  15-116.048  53.849 -34.497
  123   3HD2  LEU  15          3HD2      LEU  15-114.965  52.789 -35.399
  124    H    ASN  16           H        ASN  16-117.596  52.809 -30.747
  125    HA   ASN  16           HA       ASN  16-114.938  51.936 -30.277
  126   1HB   ASN  16          2HB       ASN  16-114.676  53.832 -29.077
  127   2HB   ASN  16          1HB       ASN  16-116.187  54.275 -29.855
  128   1HD2  ASN  16          1HD2      ASN  16-117.995  54.513 -28.657
  129   2HD2  ASN  16          2HD2      ASN  16-118.019  54.441 -26.929
  130    H    ARG  17           H        ARG  17-118.008  51.248 -28.690
  131    HA   ARG  17           HA       ARG  17-116.755  50.059 -26.401
  132   1HB   ARG  17          2HB       ARG  17-118.855  49.724 -25.541
  133   2HB   ARG  17          1HB       ARG  17-119.157  51.068 -26.628
  134   1HG   ARG  17          2HG       ARG  17-119.812  49.239 -28.332
  135   2HG   ARG  17          1HG       ARG  17-119.940  48.197 -26.912
  136   1HD   ARG  17          2HD       ARG  17-121.478  49.842 -25.893
  137   2HD   ARG  17          1HD       ARG  17-121.395  50.798 -27.370
  138    HE   ARG  17           HE       ARG  17-122.275  48.586 -28.418
  139   1HH1  ARG  17          1HH1      ARG  17-123.144  49.917 -25.293
  140   2HH1  ARG  17          2HH1      ARG  17-124.750  49.251 -25.312
  141   1HH2  ARG  17          1HH2      ARG  17-124.418  47.731 -28.453
  142   2HH2  ARG  17          2HH2      ARG  17-125.469  48.022 -27.095
  143    H    ASN  18           H        ASN  18-117.599  48.967 -29.563
  144    HA   ASN  18           HA       ASN  18-117.145  46.182 -28.767
  145   1HB   ASN  18          2HB       ASN  18-118.990  47.056 -30.436
  146   2HB   ASN  18          1HB       ASN  18-117.669  46.992 -31.599
  147   1HD2  ASN  18          1HD2      ASN  18-119.610  45.106 -29.370
  148   2HD2  ASN  18          2HD2      ASN  18-119.310  43.566 -30.123
  149    H    GLN  19           H        GLN  19-115.357  48.798 -29.666
  150    HA   GLN  19           HA       GLN  19-113.483  47.495 -31.425
  151   1HB   GLN  19          2HB       GLN  19-113.868  50.201 -30.323
  152   2HB   GLN  19          1HB       GLN  19-112.190  49.739 -30.575
  153   1HG   GLN  19          2HG       GLN  19-114.211  49.358 -32.742
  154   2HG   GLN  19          1HG       GLN  19-113.474  50.936 -32.463
  155   1HE2  GLN  19          1HE2      GLN  19-113.034  47.744 -33.662
  156   2HE2  GLN  19          2HE2      GLN  19-111.432  47.974 -34.292
  157    H    ARG  20           H        ARG  20-113.715  48.289 -28.028
  158    HA   ARG  20           HA       ARG  20-112.538  47.677 -26.195
  159   1HB   ARG  20          2HB       ARG  20-111.362  45.473 -27.887
  160   2HB   ARG  20          1HB       ARG  20-111.527  45.504 -26.138
  161   1HG   ARG  20          2HG       ARG  20-113.902  45.587 -27.968
  162   2HG   ARG  20          1HG       ARG  20-113.167  44.073 -27.436
  163   1HD   ARG  20          2HD       ARG  20-113.969  44.270 -25.337
  164   2HD   ARG  20          1HD       ARG  20-113.742  46.019 -25.305
  165    HE   ARG  20           HE       ARG  20-115.904  46.289 -26.004
  166   1HH1  ARG  20          1HH1      ARG  20-114.968  42.947 -26.506
  167   2HH1  ARG  20          2HH1      ARG  20-116.573  42.438 -26.955
  168   1HH2  ARG  20          1HH2      ARG  20-118.005  45.618 -26.569
  169   2HH2  ARG  20          2HH2      ARG  20-118.301  43.952 -26.977
  170    H    ARG  21           H        ARG  21-110.020  46.665 -25.775
  171    HA   ARG  21           HA       ARG  21-108.110  48.121 -27.386
  172   1HB   ARG  21          2HB       ARG  21-109.014  49.074 -24.752
  173   2HB   ARG  21          1HB       ARG  21-107.268  48.964 -24.924
  174   1HG   ARG  21          2HG       ARG  21-109.163  50.546 -26.645
  175   2HG   ARG  21          1HG       ARG  21-107.974  51.177 -25.502
  176   1HD   ARG  21          2HD       ARG  21-107.092  49.420 -27.753
  177   2HD   ARG  21          1HD       ARG  21-107.439  51.123 -28.055
  178    HE   ARG  21           HE       ARG  21-105.779  51.487 -26.130
  179   1HH1  ARG  21          1HH1      ARG  21-105.571  48.916 -28.513
  180   2HH1  ARG  21          2HH1      ARG  21-103.838  48.771 -28.382
  181   1HH2  ARG  21          1HH2      ARG  21-103.511  51.300 -25.970
  182   2HH2  ARG  21          2HH2      ARG  21-102.673  50.120 -26.935
  183    H    VAL  22           H        VAL  22-106.943  47.680 -24.253
  184    HA   VAL  22           HA       VAL  22-105.848  45.047 -25.005
  185    HB   VAL  22           HB       VAL  22-104.416  47.104 -23.317
  186   1HG1  VAL  22          1HG1      VAL  22-103.704  44.850 -22.859
  187   2HG1  VAL  22          2HG1      VAL  22-102.450  45.664 -23.795
  188   3HG1  VAL  22          3HG1      VAL  22-103.529  44.512 -24.581
  189   1HG2  VAL  22          1HG2      VAL  22-103.430  46.466 -26.030
  190   2HG2  VAL  22          2HG2      VAL  22-103.379  47.981 -25.129
  191   3HG2  VAL  22          3HG2      VAL  22-104.868  47.483 -25.933
  192    H    ASN  23           H        ASN  23-107.298  43.835 -23.886
  193    HA   ASN  23           HA       ASN  23-107.134  44.037 -20.946
  194   1HB   ASN  23          2HB       ASN  23-109.433  44.461 -22.087
  195   2HB   ASN  23          1HB       ASN  23-109.438  42.727 -22.386
  196   1HD2  ASN  23          1HD2      ASN  23-109.593  45.227 -19.967
  197   2HD2  ASN  23          2HD2      ASN  23-110.130  44.206 -18.668
  198    H    ARG  24           H        ARG  24-105.265  42.776 -22.561
  199    HA   ARG  24           HA       ARG  24-105.564  39.992 -21.737
  200   1HB   ARG  24          2HB       ARG  24-104.790  39.175 -23.921
  201   2HB   ARG  24          1HB       ARG  24-106.313  40.042 -24.073
  202   1HG   ARG  24          2HG       ARG  24-104.924  42.067 -24.716
  203   2HG   ARG  24          1HG       ARG  24-103.565  40.953 -24.868
  204   1HD   ARG  24          2HD       ARG  24-106.166  40.868 -26.391
  205   2HD   ARG  24          1HD       ARG  24-104.575  41.278 -27.032
  206    HE   ARG  24           HE       ARG  24-103.992  38.885 -26.333
  207   1HH1  ARG  24          1HH1      ARG  24-107.116  39.924 -27.554
  208   2HH1  ARG  24          2HH1      ARG  24-107.560  38.332 -28.108
  209   1HH2  ARG  24          1HH2      ARG  24-104.577  36.808 -27.050
  210   2HH2  ARG  24          2HH2      ARG  24-106.118  36.561 -27.817
  211    H    GLY  25           H        GLY  25-103.280  38.909 -22.592
  212   1HA   GLY  25          2HA       GLY  25-101.073  40.762 -22.207
  213   2HA   GLY  25          1HA       GLY  25-101.298  39.573 -20.931
  214    H    GLY  26           H        GLY  26 -99.105  38.935 -21.585
  215   1HA   GLY  26          2HA       GLY  26 -99.197  36.569 -23.146
  216   2HA   GLY  26          1HA       GLY  26 -98.431  37.862 -24.063
  217    H    GLY  27           H        GLY  27 -97.692  35.274 -22.337
  218   1HA   GLY  27          2HA       GLY  27 -95.070  36.314 -21.644
  219   2HA   GLY  27          1HA       GLY  27 -96.028  35.747 -20.285
  220    HA   PRO  28           HA       PRO  28 -94.985  31.926 -23.055
  221   1HB   PRO  28          2HB       PRO  28 -92.700  32.750 -24.657
  222   2HB   PRO  28          1HB       PRO  28 -94.243  32.079 -25.191
  223   1HG   PRO  28          2HG       PRO  28 -93.503  34.652 -25.659
  224   2HG   PRO  28          1HG       PRO  28 -95.192  34.146 -25.473
  225   1HD   PRO  28          2HD       PRO  28 -93.373  35.455 -23.484
  226   2HD   PRO  28          1HD       PRO  28 -95.092  35.766 -23.817
  227    H    ARG  29           H        ARG  29 -94.193  30.957 -21.285
  228    HA   ARG  29           HA       ARG  29 -92.670  29.864 -20.003
  229   1HB   ARG  29          2HB       ARG  29 -90.845  31.030 -22.040
  230   2HB   ARG  29          1HB       ARG  29 -90.130  30.478 -20.532
  231   1HG   ARG  29          2HG       ARG  29 -89.968  28.568 -21.743
  232   2HG   ARG  29          1HG       ARG  29 -91.577  28.329 -21.058
  233   1HD   ARG  29          2HD       ARG  29 -92.301  29.650 -23.228
  234   2HD   ARG  29          1HD       ARG  29 -90.771  29.019 -23.834
  235    HE   ARG  29           HE       ARG  29 -92.398  27.007 -22.605
  236   1HH1  ARG  29          1HH1      ARG  29 -91.896  28.830 -25.551
  237   2HH1  ARG  29          2HH1      ARG  29 -92.525  27.575 -26.586
  238   1HH2  ARG  29          1HH2      ARG  29 -93.235  25.359 -23.956
  239   2HH2  ARG  29          2HH2      ARG  29 -93.303  25.613 -25.677
  240    H    ARG  30           H        ARG  30 -91.660  33.206 -20.658
  241    HA   ARG  30           HA       ARG  30 -91.045  34.921 -19.310
  242   1HB   ARG  30          2HB       ARG  30 -93.329  33.898 -18.189
  243   2HB   ARG  30          1HB       ARG  30 -92.211  33.842 -16.834
  244   1HG   ARG  30          2HG       ARG  30 -92.495  36.337 -18.455
  245   2HG   ARG  30          1HG       ARG  30 -93.661  35.944 -17.189
  246   1HD   ARG  30          2HD       ARG  30 -91.992  35.976 -15.514
  247   2HD   ARG  30          1HD       ARG  30 -90.694  35.982 -16.706
  248    HE   ARG  30           HE       ARG  30 -92.550  38.261 -16.446
  249   1HH1  ARG  30          1HH1      ARG  30 -89.291  36.958 -16.487
  250   2HH1  ARG  30          2HH1      ARG  30 -88.534  38.522 -16.472
  251   1HH2  ARG  30          1HH2      ARG  30 -91.558  40.307 -16.425
  252   2HH2  ARG  30          2HH2      ARG  30 -89.825  40.429 -16.400
  253    H    ASN  31           H        ASN  31 -89.007  33.412 -19.688
  254    HA   ASN  31           HA       ASN  31 -87.731  33.064 -17.074
  255   1HB   ASN  31          2HB       ASN  31 -88.611  30.852 -17.858
  256   2HB   ASN  31          1HB       ASN  31 -87.580  30.996 -19.277
  257   1HD2  ASN  31          1HD2      ASN  31 -87.795  30.010 -16.061
  258   2HD2  ASN  31          2HD2      ASN  31 -86.125  29.609 -15.818
  259    H    ARG  32           H        ARG  32 -85.712  33.830 -17.025
  260    HA   ARG  32           HA       ARG  32 -84.411  34.446 -19.596
  261   1HB   ARG  32          2HB       ARG  32 -83.991  35.885 -16.970
  262   2HB   ARG  32          1HB       ARG  32 -83.354  36.345 -18.543
  263   1HG   ARG  32          2HG       ARG  32 -86.251  36.118 -18.533
  264   2HG   ARG  32          1HG       ARG  32 -85.649  37.306 -17.374
  265   1HD   ARG  32          2HD       ARG  32 -86.075  38.373 -19.503
  266   2HD   ARG  32          1HD       ARG  32 -84.345  38.364 -19.171
  267    HE   ARG  32           HE       ARG  32 -85.718  36.603 -21.101
  268   1HH1  ARG  32          1HH1      ARG  32 -82.852  38.255 -19.943
  269   2HH1  ARG  32          2HH1      ARG  32 -81.865  37.761 -21.291
  270   1HH2  ARG  32          1HH2      ARG  32 -84.423  35.959 -22.888
  271   2HH2  ARG  32          2HH2      ARG  32 -82.764  36.481 -22.971
  272    HA   PRO  33           HA       PRO  33 -81.647  31.385 -17.744
  273   1HB   PRO  33          2HB       PRO  33 -80.668  30.904 -20.416
  274   2HB   PRO  33          1HB       PRO  33 -81.649  29.848 -19.400
  275   1HG   PRO  33          2HG       PRO  33 -82.557  31.033 -21.697
  276   2HG   PRO  33          1HG       PRO  33 -83.605  30.539 -20.357
  277   1HD   PRO  33          2HD       PRO  33 -82.552  33.257 -21.039
  278   2HD   PRO  33          1HD       PRO  33 -84.161  32.785 -20.448
  279    H    ALA  34           H        ALA  34 -79.996  32.366 -16.734
  280    HA   ALA  34           HA       ALA  34 -78.033  33.816 -18.396
  281   1HB   ALA  34          1HB       ALA  34 -79.372  35.129 -16.658
  282   2HB   ALA  34          2HB       ALA  34 -77.619  35.314 -16.642
  283   3HB   ALA  34          3HB       ALA  34 -78.406  34.278 -15.453
  284    H    ILE  35           H        ILE  35 -78.474  30.960 -17.010
  285    HA   ILE  35           HA       ILE  35 -76.065  30.559 -15.557
  286    HB   ILE  35           HB       ILE  35 -77.593  28.939 -15.007
  287   1HG1  ILE  35          2HG1      ILE  35 -76.092  27.584 -17.262
  288   2HG1  ILE  35          1HG1      ILE  35 -75.481  27.821 -15.628
  289   1HG2  ILE  35          1HG2      ILE  35 -78.797  29.611 -17.394
  290   2HG2  ILE  35          2HG2      ILE  35 -79.399  28.451 -16.208
  291   3HG2  ILE  35          3HG2      ILE  35 -78.438  27.892 -17.578
  292   1HD1  ILE  35          1HD1      ILE  35 -76.315  25.539 -16.056
  293   2HD1  ILE  35          2HD1      ILE  35 -77.926  26.207 -16.319
  294   3HD1  ILE  35          3HD1      ILE  35 -77.157  26.351 -14.737
  295    H    ALA  36           H        ALA  36 -77.056  29.570 -18.833
  296    HA   ALA  36           HA       ALA  36 -75.944  29.345 -20.783
  297   1HB   ALA  36          1HB       ALA  36 -74.967  31.434 -20.690
  298   2HB   ALA  36          2HB       ALA  36 -73.575  30.369 -20.888
  299   3HB   ALA  36          3HB       ALA  36 -73.967  31.020 -19.297
  300    H    ARG  37           H        ARG  37 -73.363  28.942 -18.358
  301    HA   ARG  37           HA       ARG  37 -72.638  26.446 -19.737
  302   1HB   ARG  37          2HB       ARG  37 -70.870  28.272 -18.102
  303   2HB   ARG  37          1HB       ARG  37 -70.354  26.828 -18.962
  304   1HG   ARG  37          2HG       ARG  37 -71.439  29.345 -20.207
  305   2HG   ARG  37          1HG       ARG  37 -69.752  28.825 -20.192
  306   1HD   ARG  37          2HD       ARG  37 -70.476  26.757 -21.409
  307   2HD   ARG  37          1HD       ARG  37 -72.073  27.488 -21.573
  308    HE   ARG  37           HE       ARG  37 -71.190  29.072 -23.058
  309   1HH1  ARG  37          1HH1      ARG  37 -68.772  26.793 -21.937
  310   2HH1  ARG  37          2HH1      ARG  37 -67.626  27.194 -23.188
  311   1HH2  ARG  37          1HH2      ARG  37 -69.685  29.607 -24.700
  312   2HH2  ARG  37          2HH2      ARG  37 -68.143  28.801 -24.753
  313    H    GLY  38           H        GLY  38 -73.654  24.888 -18.602
  314   1HA   GLY  38          2HA       GLY  38 -73.675  24.873 -15.711
  315   2HA   GLY  38          1HA       GLY  38 -74.282  23.606 -16.770
  316    H    GLY  39           H        GLY  39 -71.198  25.119 -15.877
  317   1HA   GLY  39          2HA       GLY  39 -70.072  22.529 -15.219
  318   2HA   GLY  39          1HA       GLY  39 -69.354  23.317 -16.620
  319    H    ARG  40           H        ARG  40 -70.160  23.837 -13.223
  320    HA   ARG  40           HA       ARG  40 -68.243  26.033 -13.059
  321   1HB   ARG  40          2HB       ARG  40 -69.786  25.031 -10.701
  322   2HB   ARG  40          1HB       ARG  40 -69.296  26.672 -11.097
  323   1HG   ARG  40          2HG       ARG  40 -71.209  27.096 -12.147
  324   2HG   ARG  40          1HG       ARG  40 -71.154  25.575 -13.038
  325   1HD   ARG  40          2HD       ARG  40 -71.863  24.481 -10.830
  326   2HD   ARG  40          1HD       ARG  40 -72.275  26.113 -10.307
  327    HE   ARG  40           HE       ARG  40 -73.676  24.483 -12.244
  328   1HH1  ARG  40          1HH1      ARG  40 -73.192  27.693 -10.917
  329   2HH1  ARG  40          2HH1      ARG  40 -74.685  28.321 -11.551
  330   1HH2  ARG  40          1HH2      ARG  40 -75.660  25.289 -13.048
  331   2HH2  ARG  40          2HH2      ARG  40 -76.106  26.944 -12.738
  332    H    ASN  41           H        ASN  41 -68.492  22.703 -12.397
  333    HA   ASN  41           HA       ASN  41 -65.851  22.719 -11.183
  334   1HB   ASN  41          2HB       ASN  41 -67.889  22.521  -9.475
  335   2HB   ASN  41          1HB       ASN  41 -67.833  20.837  -9.990
  336   1HD2  ASN  41          1HD2      ASN  41 -66.420  19.540  -9.038
  337   2HD2  ASN  41          2HD2      ASN  41 -65.112  20.048  -8.028
  338    H    ARG  42           H        ARG  42 -64.948  21.862 -12.919
  339    HA   ARG  42           HA       ARG  42 -65.219  19.096 -13.457
  340   1HB   ARG  42          2HB       ARG  42 -67.188  19.706 -14.690
  341   2HB   ARG  42          1HB       ARG  42 -66.342  21.021 -15.492
  342   1HG   ARG  42          2HG       ARG  42 -65.167  19.584 -16.884
  343   2HG   ARG  42          1HG       ARG  42 -65.420  18.194 -15.825
  344   1HD   ARG  42          2HD       ARG  42 -66.934  17.708 -17.458
  345   2HD   ARG  42          1HD       ARG  42 -67.952  18.676 -16.392
  346    HE   ARG  42           HE       ARG  42 -66.739  20.408 -18.220
  347   1HH1  ARG  42          1HH1      ARG  42 -69.007  17.738 -18.249
  348   2HH1  ARG  42          2HH1      ARG  42 -69.884  18.325 -19.632
  349   1HH2  ARG  42          1HH2      ARG  42 -67.889  21.193 -20.033
  350   2HH2  ARG  42          2HH2      ARG  42 -69.257  20.303 -20.633
  351    HA   PRO  43           HA       PRO  43 -61.851  21.312 -16.332
  352   1HB   PRO  43          2HB       PRO  43 -61.813  23.902 -14.866
  353   2HB   PRO  43          1HB       PRO  43 -61.561  23.576 -16.585
  354   1HG   PRO  43          2HG       PRO  43 -63.838  24.652 -15.718
  355   2HG   PRO  43          1HG       PRO  43 -63.829  23.460 -17.032
  356   1HD   PRO  43          2HD       PRO  43 -64.595  23.122 -14.167
  357   2HD   PRO  43          1HD       PRO  43 -65.298  22.384 -15.619
  358    H    ALA  44           H        ALA  44 -62.400  22.061 -12.930
  359    HA   ALA  44           HA       ALA  44 -59.653  21.134 -12.356
  360   1HB   ALA  44          1HB       ALA  44 -61.387  22.991 -10.723
  361   2HB   ALA  44          2HB       ALA  44 -59.980  23.454 -11.682
  362   3HB   ALA  44          3HB       ALA  44 -59.782  22.420 -10.267
  363    HA   PRO  45           HA       PRO  45 -61.712  17.461 -10.832
  364   1HB   PRO  45          2HB       PRO  45 -59.068  17.270  -9.457
  365   2HB   PRO  45          1HB       PRO  45 -59.950  16.041 -10.375
  366   1HG   PRO  45          2HG       PRO  45 -57.875  17.270 -11.464
  367   2HG   PRO  45          1HG       PRO  45 -59.331  16.954 -12.428
  368   1HD   PRO  45          2HD       PRO  45 -58.387  19.510 -11.203
  369   2HD   PRO  45          1HD       PRO  45 -59.195  19.235 -12.760
  370    H    TYR  46           H        TYR  46 -59.652  19.351  -8.616
  371    HA   TYR  46           HA       TYR  46 -61.878  19.547  -6.753
  372   1HB   TYR  46          2HB       TYR  46 -60.617  17.467  -6.133
  373   2HB   TYR  46          1HB       TYR  46 -59.198  18.470  -5.849
  374    HD1  TYR  46           1HD      TYR  46 -58.801  18.447  -3.560
  375    HD2  TYR  46           2HD      TYR  46 -62.780  18.996  -4.957
  376    HE1  TYR  46           1HE      TYR  46 -59.550  18.845  -1.252
  377    HE2  TYR  46           2HE      TYR  46 -63.539  19.397  -2.657
  378    HH   TYR  46           HH       TYR  46 -62.198  18.519  -0.095
  379    H    SER  47           H        SER  47 -58.399  20.169  -7.111
  380    HA   SER  47           HA       SER  47 -58.901  22.933  -6.225
  381   1HB   SER  47          2HB       SER  47 -56.127  22.068  -6.025
  382   2HB   SER  47          1HB       SER  47 -57.166  22.793  -4.798
  383    HG   SER  47           HG       SER  47 -57.484  20.892  -3.978
  384    H    ARG  48           H        ARG  48 -56.260  21.213  -7.893
  385    HA   ARG  48           HA       ARG  48 -56.483  23.197 -10.064
  386   1HB   ARG  48          2HB       ARG  48 -53.927  21.879  -9.135
  387   2HB   ARG  48          1HB       ARG  48 -54.087  23.158 -10.329
  388   1HG   ARG  48          2HG       ARG  48 -53.988  24.729  -8.771
  389   2HG   ARG  48          1HG       ARG  48 -55.242  23.945  -7.808
  390   1HD   ARG  48          2HD       ARG  48 -53.517  23.758  -6.342
  391   2HD   ARG  48          1HD       ARG  48 -53.237  22.286  -7.269
  392    HE   ARG  48           HE       ARG  48 -51.426  23.336  -8.362
  393   1HH1  ARG  48          1HH1      ARG  48 -52.885  25.331  -5.885
  394   2HH1  ARG  48          2HH1      ARG  48 -51.541  26.423  -5.777
  395   1HH2  ARG  48          1HH2      ARG  48 -49.637  24.754  -8.227
  396   2HH2  ARG  48          2HH2      ARG  48 -49.673  26.078  -7.103
  397    HA   PRO  49           HA       PRO  49 -56.935  19.618 -12.717
  398   1HB   PRO  49          2HB       PRO  49 -56.223  20.886 -15.046
  399   2HB   PRO  49          1HB       PRO  49 -57.838  20.967 -14.335
  400   1HG   PRO  49          2HG       PRO  49 -55.596  22.939 -14.175
  401   2HG   PRO  49          1HG       PRO  49 -57.332  23.229 -14.396
  402   1HD   PRO  49          2HD       PRO  49 -56.128  23.565 -12.013
  403   2HD   PRO  49          1HD       PRO  49 -57.792  22.958 -12.145
  404    H    LYS  50           H        LYS  50 -55.382  18.122 -12.543
  405    HA   LYS  50           HA       LYS  50 -52.600  18.829 -12.582
  406   1HB   LYS  50          2HB       LYS  50 -52.541  16.133 -12.584
  407   2HB   LYS  50          1HB       LYS  50 -52.768  17.097 -11.133
  408   1HG   LYS  50          2HG       LYS  50 -55.152  16.780 -11.235
  409   2HG   LYS  50          1HG       LYS  50 -55.008  15.944 -12.784
  410   1HD   LYS  50          2HD       LYS  50 -53.373  14.831 -10.608
  411   2HD   LYS  50          1HD       LYS  50 -55.117  14.706 -10.370
  412   1HE   LYS  50          2HE       LYS  50 -54.966  13.913 -12.923
  413   2HE   LYS  50          1HE       LYS  50 -53.369  13.407 -12.375
  414   1HZ   LYS  50          1HZ       LYS  50 -54.290  11.985 -10.787
  415   2HZ   LYS  50          2HZ       LYS  50 -55.246  11.744 -12.165
  416   3HZ   LYS  50          3HZ       LYS  50 -55.829  12.699 -10.890
  417    HA   PRO  51           HA       PRO  51 -52.340  18.194 -17.009
  418   1HB   PRO  51          2HB       PRO  51 -49.610  19.143 -16.766
  419   2HB   PRO  51          1HB       PRO  51 -50.987  19.934 -17.531
  420   1HG   PRO  51          2HG       PRO  51 -49.825  20.846 -15.246
  421   2HG   PRO  51          1HG       PRO  51 -51.534  21.101 -15.640
  422   1HD   PRO  51          2HD       PRO  51 -50.291  19.079 -13.813
  423   2HD   PRO  51          1HD       PRO  51 -51.764  20.051 -13.587
  424    H    LEU  52           H        LEU  52 -50.151  17.113 -14.528
  425    HA   LEU  52           HA       LEU  52 -48.884  15.278 -14.242
  426   1HB   LEU  52          2HB       LEU  52 -50.481  14.345 -16.607
  427   2HB   LEU  52          1HB       LEU  52 -49.283  13.328 -15.825
  428    HG   LEU  52           HG       LEU  52 -50.864  14.210 -13.725
  429   1HD1  LEU  52          1HD1      LEU  52 -53.152  13.734 -14.406
  430   2HD1  LEU  52          2HD1      LEU  52 -52.621  13.521 -16.074
  431   3HD1  LEU  52          3HD1      LEU  52 -52.495  15.104 -15.305
  432   1HD2  LEU  52          1HD2      LEU  52 -50.141  11.780 -15.022
  433   2HD2  LEU  52          2HD2      LEU  52 -51.853  11.717 -14.603
  434   3HD2  LEU  52          3HD2      LEU  52 -50.650  12.038 -13.353
  435    HA   PRO  53           HA       PRO  53 -45.595  16.500 -16.972
  436   1HB   PRO  53          2HB       PRO  53 -43.607  16.211 -15.239
  437   2HB   PRO  53          1HB       PRO  53 -44.862  17.410 -14.938
  438   1HG   PRO  53          2HG       PRO  53 -44.580  14.657 -13.788
  439   2HG   PRO  53          1HG       PRO  53 -44.932  16.184 -12.953
  440   1HD   PRO  53          2HD       PRO  53 -46.848  14.361 -13.753
  441   2HD   PRO  53          1HD       PRO  53 -47.158  16.087 -13.475
  442    H    ASP  54           H        ASP  54 -43.077  14.889 -16.141
  443    HA   ASP  54           HA       ASP  54 -43.707  12.578 -17.808
  444   1HB   ASP  54          2HB       ASP  54 -41.291  12.520 -18.320
  445   2HB   ASP  54          1HB       ASP  54 -42.016  14.061 -18.748
  446    H    LYS  55           H        LYS  55 -40.805  11.979 -16.548
  447    HA   LYS  55           HA       LYS  55 -41.911  10.051 -14.673
  448   1HB   LYS  55          2HB       LYS  55 -39.364  10.347 -16.177
  449   2HB   LYS  55          1HB       LYS  55 -39.292   9.504 -14.637
  450   1HG   LYS  55          2HG       LYS  55 -41.511   8.521 -16.134
  451   2HG   LYS  55          1HG       LYS  55 -40.061   8.489 -17.141
  452   1HD   LYS  55          2HD       LYS  55 -39.024   7.512 -14.884
  453   2HD   LYS  55          1HD       LYS  55 -40.697   6.990 -14.669
  454   1HE   LYS  55          2HE       LYS  55 -39.932   6.449 -17.351
  455   2HE   LYS  55          1HE       LYS  55 -38.672   5.830 -16.284
  456   1HZ   LYS  55          1HZ       LYS  55 -40.319   4.584 -15.073
  457   2HZ   LYS  55          2HZ       LYS  55 -40.423   4.196 -16.723
  458   3HZ   LYS  55          3HZ       LYS  55 -41.569   5.231 -16.021
  459    H    TRP  56           H        TRP  56 -41.150   9.848 -12.534
  460    HA   TRP  56           HA       TRP  56 -40.132  12.347 -11.401
  461   1HB   TRP  56          2HB       TRP  56 -41.484   9.955 -10.138
  462   2HB   TRP  56          1HB       TRP  56 -40.820  11.301  -9.216
  463    HD1  TRP  56           HD       TRP  56 -43.901  10.223 -11.001
  464    HE1  TRP  56           1HE      TRP  56 -45.611  12.149 -11.082
  465    HE3  TRP  56           3HE      TRP  56 -40.876  14.048  -9.467
  466    HZ2  TRP  56           2HZ      TRP  56 -45.660  14.922 -10.558
  467    HZ3  TRP  56           3HZ      TRP  56 -41.832  16.305  -9.283
  468    HH2  TRP  56           HH       TRP  56 -44.176  16.733  -9.818
  469    H    GLN  57           H        GLN  57 -37.999  12.348 -11.592
  470    HA   GLN  57           HA       GLN  57 -36.420   9.990 -11.679
  471   1HB   GLN  57          2HB       GLN  57 -36.027  12.870 -12.004
  472   2HB   GLN  57          1HB       GLN  57 -34.650  12.064 -11.268
  473   1HG   GLN  57          2HG       GLN  57 -34.670  12.296 -13.799
  474   2HG   GLN  57          1HG       GLN  57 -34.291  10.711 -13.127
  475   1HE2  GLN  57          1HE2      GLN  57 -36.894  12.648 -14.510
  476   2HE2  GLN  57          2HE2      GLN  57 -37.757  11.311 -15.192
  477    H    HIS  58           H        HIS  58 -34.702   9.408 -10.295
  478    HA   HIS  58           HA       HIS  58 -34.809  10.480  -7.575
  479   1HB   HIS  58          2HB       HIS  58 -35.956   8.061  -8.208
  480   2HB   HIS  58          1HB       HIS  58 -34.344   7.582  -7.689
  481    HD1  HIS  58           1HD      HIS  58 -34.065   7.277  -5.254
  482    HD2  HIS  58           2HD      HIS  58 -37.263   9.782  -6.157
  483    HE1  HIS  58           1HE      HIS  58 -35.144   7.829  -3.047
  484    HE2  HIS  58           2HE      HIS  58 -36.946   9.504  -3.600
  485    H    ASP  59           H        ASP  59 -32.979   7.866  -7.268
  486    HA   ASP  59           HA       ASP  59 -30.537   9.290  -7.281
  487   1HB   ASP  59          2HB       ASP  59 -30.445   6.326  -7.389
  488   2HB   ASP  59          1HB       ASP  59 -29.625   7.434  -6.296
  489    H    LEU  60           H        LEU  60 -31.708   6.624  -9.315
  490    HA   LEU  60           HA       LEU  60 -31.308   6.030 -11.459
  491   1HB   LEU  60          2HB       LEU  60 -31.058   8.950 -11.458
  492   2HB   LEU  60          1HB       LEU  60 -30.206   8.168 -12.777
  493    HG   LEU  60           HG       LEU  60 -32.369   6.974 -13.320
  494   1HD1  LEU  60          1HD1      LEU  60 -34.314   7.448 -12.265
  495   2HD1  LEU  60          2HD1      LEU  60 -33.848   9.111 -11.913
  496   3HD1  LEU  60          3HD1      LEU  60 -33.225   7.791 -10.921
  497   1HD2  LEU  60          1HD2      LEU  60 -32.061   8.560 -14.884
  498   2HD2  LEU  60          2HD2      LEU  60 -31.706   9.814 -13.695
  499   3HD2  LEU  60          3HD2      LEU  60 -33.379   9.374 -14.041
  500    H    PHE  61           H        PHE  61 -28.743   8.268 -11.997
  501    HA   PHE  61           HA       PHE  61 -26.894   6.009 -12.185
  502   1HB   PHE  61          2HB       PHE  61 -27.425   8.139 -13.875
  503   2HB   PHE  61          1HB       PHE  61 -25.915   8.600 -13.099
  504    HD1  PHE  61           1HD      PHE  61 -23.880   7.490 -13.607
  505    HD2  PHE  61           2HD      PHE  61 -27.559   6.061 -15.192
  506    HE1  PHE  61           1HE      PHE  61 -22.642   6.022 -15.145
  507    HE2  PHE  61           2HE      PHE  61 -26.329   4.589 -16.733
  508    HZ   PHE  61           HZ       PHE  61 -23.868   4.586 -16.725
  509    H    ASP  62           H        ASP  62 -27.756   7.659  -9.748
  510    HA   ASP  62           HA       ASP  62 -26.832   8.260  -7.758
  511   1HB   ASP  62          2HB       ASP  62 -25.196   6.293  -8.561
  512   2HB   ASP  62          1HB       ASP  62 -24.051   7.626  -8.619
  513    H    SER  63           H        SER  63 -24.549   9.564  -7.034
  514    HA   SER  63           HA       SER  63 -24.816  12.128  -8.210
  515   1HB   SER  63          2HB       SER  63 -22.314  11.829  -6.815
  516   2HB   SER  63          1HB       SER  63 -23.757  12.716  -6.318
  517    HG   SER  63           HG       SER  63 -22.822  10.600  -5.172
  518    H    GLY  64           H        GLY  64 -22.315   9.621  -8.377
  519   1HA   GLY  64          2HA       GLY  64 -21.758  10.254 -11.121
  520   2HA   GLY  64          1HA       GLY  64 -20.467  10.753 -10.035
  521    H    CYS  65           H        CYS  65 -22.584   7.908 -10.417
  522    HA   CYS  65           HA       CYS  65 -20.456   6.181  -9.509
  523   1HB   CYS  65          2HB       CYS  65 -23.342   5.974  -9.899
  524   2HB   CYS  65          1HB       CYS  65 -22.478   4.534 -10.427
  525    HG   CYS  65           HG       CYS  65 -22.965   5.728  -7.314
  526    H    GLY  66           H        GLY  66 -19.837   4.237 -10.745
  527   1HA   GLY  66          2HA       GLY  66 -20.239   3.730 -13.402
  528   2HA   GLY  66          1HA       GLY  66 -19.020   4.998 -13.395
  529    H    GLY  67           H        GLY  67 -17.763   4.153 -10.945
  530   1HA   GLY  67          2HA       GLY  67 -16.544   2.288 -10.087
  531   2HA   GLY  67          1HA       GLY  67 -16.751   1.480 -11.636
  532    H    GLY  68           H        GLY  68 -14.848   3.680  -9.780
  533   1HA   GLY  68          2HA       GLY  68 -12.507   3.293 -11.223
  534   2HA   GLY  68          1HA       GLY  68 -13.272   4.722 -11.904
  535    H    GLU  69           H        GLU  69 -12.913   3.442  -8.615
  536    HA   GLU  69           HA       GLU  69 -12.317   6.123  -7.665
  537   1HB   GLU  69          2HB       GLU  69 -12.800   3.505  -6.237
  538   2HB   GLU  69          1HB       GLU  69 -12.411   5.008  -5.409
  539   1HG   GLU  69          2HG       GLU  69 -14.629   5.247  -5.288
  540   2HG   GLU  69          1HG       GLU  69 -14.479   5.810  -6.953
  541    H    GLY  70           H        GLY  70 -10.706   5.457  -5.448
  542   1HA   GLY  70          2HA       GLY  70  -8.154   5.304  -6.840
  543   2HA   GLY  70          1HA       GLY  70  -8.412   5.845  -5.187
  544    H    VAL  71           H        VAL  71  -8.820   2.903  -7.126
  545    HA   VAL  71           HA       VAL  71  -7.929   1.331  -4.851
  546    HB   VAL  71           HB       VAL  71  -8.432  -0.391  -7.024
  547   1HG1  VAL  71          1HG1      VAL  71 -10.109  -1.310  -5.586
  548   2HG1  VAL  71          2HG1      VAL  71 -10.210   0.190  -4.663
  549   3HG1  VAL  71          3HG1      VAL  71  -8.749  -0.796  -4.588
  550   1HG2  VAL  71          1HG2      VAL  71  -9.686   1.272  -8.180
  551   2HG2  VAL  71          2HG2      VAL  71 -10.541   1.738  -6.708
  552   3HG2  VAL  71          3HG2      VAL  71 -10.842   0.163  -7.443
  553    H    GLU  72           H        GLU  72  -7.391   1.062  -8.304
  554    HA   GLU  72           HA       GLU  72  -4.657   0.176  -7.803
  555   1HB   GLU  72          2HB       GLU  72  -5.166   0.304 -10.590
  556   2HB   GLU  72          1HB       GLU  72  -5.007  -1.127  -9.582
  557   1HG   GLU  72          2HG       GLU  72  -7.056  -1.414 -10.610
  558   2HG   GLU  72          1HG       GLU  72  -7.491  -0.762  -9.032
  559    H    THR  73           H        THR  73  -6.453   2.785  -9.306
  560    HA   THR  73           HA       THR  73  -3.974   4.224  -9.848
  561    HB   THR  73           HB       THR  73  -5.860   4.288 -11.510
  562    HG1  THR  73           1HG      THR  73  -4.543   5.959 -11.849
  563   1HG2  THR  73          1HG2      THR  73  -7.298   5.242  -9.168
  564   2HG2  THR  73          2HG2      THR  73  -7.919   4.630 -10.702
  565   3HG2  THR  73          3HG2      THR  73  -7.465   6.327 -10.548
  566    H    GLY  74           H        GLY  74  -3.706   6.409  -9.020
  567   1HA   GLY  74          2HA       GLY  74  -4.797   7.933  -7.231
  568   2HA   GLY  74          1HA       GLY  74  -4.571   6.512  -6.219
  569    H    ALA  75           H        ALA  75  -2.612   6.123  -5.321
  570    HA   ALA  75           HA       ALA  75  -0.348   7.756  -6.261
  571   1HB   ALA  75          1HB       ALA  75   0.329   8.178  -4.050
  572   2HB   ALA  75          2HB       ALA  75  -0.756   6.947  -3.396
  573   3HB   ALA  75          3HB       ALA  75  -1.414   8.452  -4.048
  574    H    LYS  76           H        LYS  76   1.190   6.477  -7.072
  575    HA   LYS  76           HA       LYS  76   1.469   3.759  -6.013
  576   1HB   LYS  76          2HB       LYS  76   1.229   3.971  -8.453
  577   2HB   LYS  76          1HB       LYS  76   2.659   4.994  -8.504
  578   1HG   LYS  76          2HG       LYS  76   3.938   3.059  -7.523
  579   2HG   LYS  76          1HG       LYS  76   2.503   2.074  -7.812
  580   1HD   LYS  76          2HD       LYS  76   2.814   3.264 -10.232
  581   2HD   LYS  76          1HD       LYS  76   4.494   3.125  -9.706
  582   1HE   LYS  76          2HE       LYS  76   3.517   0.676  -9.046
  583   2HE   LYS  76          1HE       LYS  76   2.573   1.044 -10.488
  584   1HZ   LYS  76          1HZ       LYS  76   4.377   0.124 -11.462
  585   2HZ   LYS  76          2HZ       LYS  76   5.440   0.558 -10.214
  586   3HZ   LYS  76          3HZ       LYS  76   4.966   1.714 -11.363
  587    H    LEU  77           H        LEU  77   2.848   3.486  -4.513
  588    HA   LEU  77           HA       LEU  77   5.157   5.276  -4.245
  589   1HB   LEU  77          2HB       LEU  77   3.242   4.876  -2.499
  590   2HB   LEU  77          1HB       LEU  77   4.120   3.407  -2.160
  591    HG   LEU  77           HG       LEU  77   4.741   4.961  -0.534
  592   1HD1  LEU  77          1HD1      LEU  77   7.076   5.076  -0.735
  593   2HD1  LEU  77          2HD1      LEU  77   6.996   5.079  -2.498
  594   3HD1  LEU  77          3HD1      LEU  77   6.556   3.625  -1.596
  595   1HD2  LEU  77          1HD2      LEU  77   3.960   6.969  -1.745
  596   2HD2  LEU  77          2HD2      LEU  77   5.427   6.916  -2.723
  597   3HD2  LEU  77          3HD2      LEU  77   5.535   7.193  -0.984
  598    H    LEU  78           H        LEU  78   7.049   4.418  -4.824
  599    HA   LEU  78           HA       LEU  78   7.364   1.495  -4.737
  600   1HB   LEU  78          2HB       LEU  78   9.272   3.377  -6.091
  601   2HB   LEU  78          1HB       LEU  78   9.036   1.665  -6.381
  602    HG   LEU  78           HG       LEU  78   7.067   3.834  -7.120
  603   1HD1  LEU  78          1HD1      LEU  78   7.767   3.582  -9.359
  604   2HD1  LEU  78          2HD1      LEU  78   8.750   2.171  -8.974
  605   3HD1  LEU  78          3HD1      LEU  78   9.240   3.767  -8.408
  606   1HD2  LEU  78          1HD2      LEU  78   7.010   1.010  -8.101
  607   2HD2  LEU  78          2HD2      LEU  78   5.710   2.201  -8.039
  608   3HD2  LEU  78          3HD2      LEU  78   6.273   1.432  -6.555
  609    H    VAL  79           H        VAL  79   9.621   0.769  -4.044
  610    HA   VAL  79           HA       VAL  79  10.820   2.521  -2.098
  611    HB   VAL  79           HB       VAL  79  10.447   1.335  -0.115
  612   1HG1  VAL  79          1HG1      VAL  79   7.710   0.858  -1.112
  613   2HG1  VAL  79          2HG1      VAL  79   8.345   2.495  -1.284
  614   3HG1  VAL  79          3HG1      VAL  79   8.266   1.742   0.309
  615   1HG2  VAL  79          1HG2      VAL  79  10.231  -0.894  -1.816
  616   2HG2  VAL  79          2HG2      VAL  79   8.774  -0.840  -0.821
  617   3HG2  VAL  79          3HG2      VAL  79  10.367  -0.862  -0.057
  618    H    SER  80           H        SER  80  12.718   1.538  -1.087
  619    HA   SER  80           HA       SER  80  13.785  -0.879  -2.218
  620   1HB   SER  80          2HB       SER  80  15.507   1.530  -2.704
  621   2HB   SER  80          1HB       SER  80  15.523  -0.035  -3.514
  622    HG   SER  80           HG       SER  80  14.142   2.242  -4.131
  623    H    ASN  81           H        ASN  81  14.287  -1.717  -0.284
  624    HA   ASN  81           HA       ASN  81  15.516  -0.047   1.760
  625   1HB   ASN  81          2HB       ASN  81  13.791  -1.539   2.523
  626   2HB   ASN  81          1HB       ASN  81  14.574  -2.919   1.763
  627   1HD2  ASN  81          1HD2      ASN  81  14.496  -0.825   4.496
  628   2HD2  ASN  81          2HD2      ASN  81  15.677  -1.666   5.437
  629    H    LEU  82           H        LEU  82  16.280  -2.868  -0.198
  630    HA   LEU  82           HA       LEU  82  18.204  -3.476  -1.207
  631   1HB   LEU  82          2HB       LEU  82  18.695  -0.996  -1.209
  632   2HB   LEU  82          1HB       LEU  82  19.642  -1.270   0.241
  633    HG   LEU  82           HG       LEU  82  20.849  -3.063  -1.264
  634   1HD1  LEU  82          1HD1      LEU  82  19.373  -2.843  -3.177
  635   2HD1  LEU  82          2HD1      LEU  82  21.005  -2.321  -3.596
  636   3HD1  LEU  82          3HD1      LEU  82  19.748  -1.123  -3.291
  637   1HD2  LEU  82          1HD2      LEU  82  21.590  -0.294  -1.999
  638   2HD2  LEU  82          2HD2      LEU  82  22.583  -1.606  -1.363
  639   3HD2  LEU  82          3HD2      LEU  82  21.538  -0.685  -0.280
  640    H    ASP  83           H        ASP  83  19.533  -2.297   1.901
  641    HA   ASP  83           HA       ASP  83  21.280  -4.555   1.920
  642   1HB   ASP  83          2HB       ASP  83  21.805  -2.227   2.808
  643   2HB   ASP  83          1HB       ASP  83  20.880  -2.679   4.239
  644    H    PHE  84           H        PHE  84  18.512  -3.634   3.947
  645    HA   PHE  84           HA       PHE  84  18.910  -5.922   5.660
  646   1HB   PHE  84          2HB       PHE  84  16.492  -4.116   5.640
  647   2HB   PHE  84          1HB       PHE  84  17.112  -5.083   6.973
  648    HD1  PHE  84           1HD      PHE  84  17.641  -2.049   4.962
  649    HD2  PHE  84           2HD      PHE  84  18.869  -4.283   8.370
  650    HE1  PHE  84           1HE      PHE  84  18.918  -0.109   5.765
  651    HE2  PHE  84           2HE      PHE  84  20.147  -2.346   9.180
  652    HZ   PHE  84           HZ       PHE  84  20.172  -0.257   7.877
  653    H    GLY  85           H        GLY  85  16.412  -4.874   3.360
  654   1HA   GLY  85          2HA       GLY  85  15.315  -6.324   1.845
  655   2HA   GLY  85          1HA       GLY  85  15.797  -7.692   2.842
  656    H    VAL  86           H        VAL  86  13.348  -5.428   2.148
  657    HA   VAL  86           HA       VAL  86  11.850  -6.068   4.570
  658    HB   VAL  86           HB       VAL  86  10.140  -4.454   3.529
  659   1HG1  VAL  86          1HG1      VAL  86  11.330  -2.509   4.384
  660   2HG1  VAL  86          2HG1      VAL  86  12.849  -3.403   4.336
  661   3HG1  VAL  86          3HG1      VAL  86  11.566  -3.903   5.438
  662   1HG2  VAL  86          1HG2      VAL  86  12.417  -3.288   2.011
  663   2HG2  VAL  86          2HG2      VAL  86  10.681  -3.138   1.741
  664   3HG2  VAL  86          3HG2      VAL  86  11.519  -4.620   1.282
  665    H    SER  87           H        SER  87  10.419  -7.681   4.591
  666    HA   SER  87           HA       SER  87   9.643  -9.084   2.261
  667   1HB   SER  87          2HB       SER  87   7.976  -9.434   4.660
  668   2HB   SER  87          1HB       SER  87   8.902 -10.626   3.746
  669    HG   SER  87           HG       SER  87   9.725  -8.964   5.874
  670    H    ASP  88           H        ASP  88   7.227  -9.561   1.922
  671    HA   ASP  88           HA       ASP  88   5.979  -7.402   0.776
  672   1HB   ASP  88          2HB       ASP  88   5.475 -10.050   0.866
  673   2HB   ASP  88          1HB       ASP  88   4.179  -9.468   1.903
  674    H    ALA  89           H        ALA  89   5.428  -8.709   4.023
  675    HA   ALA  89           HA       ALA  89   3.507  -6.596   4.586
  676   1HB   ALA  89          1HB       ALA  89   2.591  -8.068   5.962
  677   2HB   ALA  89          2HB       ALA  89   4.097  -8.226   6.868
  678   3HB   ALA  89          3HB       ALA  89   3.809  -9.239   5.454
  679    H    ASP  90           H        ASP  90   6.824  -6.824   4.724
  680    HA   ASP  90           HA       ASP  90   7.362  -5.684   7.282
  681   1HB   ASP  90          2HB       ASP  90   8.869  -6.531   4.998
  682   2HB   ASP  90          1HB       ASP  90   9.373  -4.903   5.429
  683    H    ILE  91           H        ILE  91   7.845  -4.193   4.090
  684    HA   ILE  91           HA       ILE  91   7.691  -1.561   5.009
  685    HB   ILE  91           HB       ILE  91   8.627  -2.381   2.786
  686   1HG1  ILE  91          2HG1      ILE  91   7.827  -0.232   1.598
  687   2HG1  ILE  91          1HG1      ILE  91   6.914   0.074   3.071
  688   1HG2  ILE  91          1HG2      ILE  91   5.785  -2.797   2.313
  689   2HG2  ILE  91          2HG2      ILE  91   7.185  -3.457   1.468
  690   3HG2  ILE  91          3HG2      ILE  91   6.573  -1.857   1.046
  691   1HD1  ILE  91          1HD1      ILE  91   9.097  -0.153   4.314
  692   2HD1  ILE  91          2HD1      ILE  91   8.930   1.264   3.278
  693   3HD1  ILE  91          3HD1      ILE  91   9.890  -0.114   2.740
  694    H    GLN  92           H        GLN  92   5.201  -3.835   4.194
  695    HA   GLN  92           HA       GLN  92   3.076  -2.053   3.781
  696   1HB   GLN  92          2HB       GLN  92   3.084  -4.539   3.331
  697   2HB   GLN  92          1HB       GLN  92   2.858  -4.776   5.059
  698   1HG   GLN  92          2HG       GLN  92   0.845  -3.113   4.659
  699   2HG   GLN  92          1HG       GLN  92   0.969  -3.750   3.018
  700   1HE2  GLN  92          1HE2      GLN  92  -0.851  -4.935   2.974
  701   2HE2  GLN  92          2HE2      GLN  92  -1.151  -6.303   3.989
  702    H    GLU  93           H        GLU  93   3.966  -3.831   6.749
  703    HA   GLU  93           HA       GLU  93   2.130  -2.459   8.383
  704   1HB   GLU  93          2HB       GLU  93   3.103  -3.546  10.213
  705   2HB   GLU  93          1HB       GLU  93   3.355  -4.651   8.871
  706   1HG   GLU  93          2HG       GLU  93   5.627  -4.244   8.793
  707   2HG   GLU  93          1HG       GLU  93   5.483  -2.699   9.631
  708    H    LEU  94           H        LEU  94   5.349  -1.649   7.323
  709    HA   LEU  94           HA       LEU  94   5.862   0.398   9.217
  710   1HB   LEU  94          2HB       LEU  94   7.119  -0.705   6.869
  711   2HB   LEU  94          1HB       LEU  94   7.185   1.045   6.821
  712    HG   LEU  94           HG       LEU  94   8.116   0.875   9.222
  713   1HD1  LEU  94          1HD1      LEU  94   7.653  -1.849   8.716
  714   2HD1  LEU  94          2HD1      LEU  94   8.451  -1.126  10.112
  715   3HD1  LEU  94          3HD1      LEU  94   9.403  -1.628   8.715
  716   1HD2  LEU  94          1HD2      LEU  94  10.345   0.755   8.398
  717   2HD2  LEU  94          2HD2      LEU  94   9.363   1.504   7.139
  718   3HD2  LEU  94          3HD2      LEU  94   9.841  -0.187   6.995
  719    H    PHE  95           H        PHE  95   5.192   0.797   5.744
  720    HA   PHE  95           HA       PHE  95   4.392   3.427   5.766
  721   1HB   PHE  95          2HB       PHE  95   4.259   1.228   3.948
  722   2HB   PHE  95          1HB       PHE  95   2.752   2.130   3.870
  723    HD1  PHE  95           1HD      PHE  95   2.832   4.586   3.402
  724    HD2  PHE  95           2HD      PHE  95   6.221   2.049   2.984
  725    HE1  PHE  95           1HE      PHE  95   3.920   6.277   1.987
  726    HE2  PHE  95           2HE      PHE  95   7.315   3.736   1.567
  727    HZ   PHE  95           HZ       PHE  95   6.150   5.841   1.050
  728    H    ALA  96           H        ALA  96   2.498   0.671   6.836
  729    HA   ALA  96           HA       ALA  96  -0.002   2.047   6.948
  730   1HB   ALA  96          1HB       ALA  96   0.720  -0.149   8.854
  731   2HB   ALA  96          2HB       ALA  96   0.490  -0.498   7.140
  732   3HB   ALA  96          3HB       ALA  96  -0.828   0.198   8.083
  733    H    GLU  97           H        GLU  97   2.441   1.318   9.362
  734    HA   GLU  97           HA       GLU  97   1.610   2.990  11.440
  735   1HB   GLU  97          2HB       GLU  97   4.001   1.602  10.772
  736   2HB   GLU  97          1HB       GLU  97   4.453   3.247  11.200
  737   1HG   GLU  97          2HG       GLU  97   2.588   2.424  13.123
  738   2HG   GLU  97          1HG       GLU  97   3.697   1.073  12.895
  739    H    PHE  98           H        PHE  98   3.481   3.731   8.574
  740    HA   PHE  98           HA       PHE  98   3.795   6.497   8.947
  741   1HB   PHE  98          2HB       PHE  98   5.013   4.941   7.350
  742   2HB   PHE  98          1HB       PHE  98   3.618   5.094   6.290
  743    HD1  PHE  98           1HD      PHE  98   4.099   6.403   4.514
  744    HD2  PHE  98           2HD      PHE  98   5.573   7.527   8.335
  745    HE1  PHE  98           1HE      PHE  98   5.038   8.459   3.538
  746    HE2  PHE  98           2HE      PHE  98   6.525   9.577   7.377
  747    HZ   PHE  98           HZ       PHE  98   6.253  10.055   4.972
  748    H    GLY  99           H        GLY  99   0.918   5.010   8.740
  749   1HA   GLY  99          2HA       GLY  99  -0.940   6.687   8.657
  750   2HA   GLY  99          1HA       GLY  99  -0.275   7.176   7.112
  751    H    THR 100           H        THR 100  -0.756   5.979   5.267
  752    HA   THR 100           HA       THR 100  -3.015   4.129   5.656
  753    HB   THR 100           HB       THR 100  -3.129   5.743   3.224
  754    HG1  THR 100           1HG      THR 100  -2.662   7.591   4.168
  755   1HG2  THR 100          1HG2      THR 100  -5.439   6.215   4.398
  756   2HG2  THR 100          2HG2      THR 100  -4.947   4.863   5.418
  757   3HG2  THR 100          3HG2      THR 100  -5.097   4.643   3.674
  758    H    LEU 101           H        LEU 101  -2.267   2.181   4.954
  759    HA   LEU 101           HA       LEU 101  -1.020   2.173   2.296
  760   1HB   LEU 101          2HB       LEU 101  -0.117   1.015   4.722
  761   2HB   LEU 101          1HB       LEU 101  -0.517  -0.286   3.613
  762    HG   LEU 101           HG       LEU 101   1.634   1.744   3.451
  763   1HD1  LEU 101          1HD1      LEU 101   2.704  -0.254   2.300
  764   2HD1  LEU 101          2HD1      LEU 101   1.281  -1.158   2.818
  765   3HD1  LEU 101          3HD1      LEU 101   2.333  -0.403   4.016
  766   1HD2  LEU 101          1HD2      LEU 101   1.701   1.040   0.914
  767   2HD2  LEU 101          2HD2      LEU 101   0.771   2.439   1.449
  768   3HD2  LEU 101          3HD2      LEU 101  -0.043   0.905   1.141
  769    H    LYS 102           H        LYS 102  -3.174   2.208   1.547
  770    HA   LYS 102           HA       LYS 102  -5.119   0.282   1.744
  771   1HB   LYS 102          2HB       LYS 102  -4.177   1.809  -0.674
  772   2HB   LYS 102          1HB       LYS 102  -5.564   0.730  -0.735
  773   1HG   LYS 102          2HG       LYS 102  -5.368   2.966   1.256
  774   2HG   LYS 102          1HG       LYS 102  -6.026   3.196  -0.365
  775   1HD   LYS 102          2HD       LYS 102  -7.978   2.303   0.231
  776   2HD   LYS 102          1HD       LYS 102  -7.181   0.869   0.886
  777   1HE   LYS 102          2HE       LYS 102  -8.117   1.660   2.803
  778   2HE   LYS 102          1HE       LYS 102  -6.600   2.556   2.848
  779   1HZ   LYS 102          1HZ       LYS 102  -7.769   4.421   1.756
  780   2HZ   LYS 102          2HZ       LYS 102  -8.393   4.051   3.289
  781   3HZ   LYS 102          3HZ       LYS 102  -9.228   3.561   1.896
  782    H    LYS 103           H        LYS 103  -2.507   0.177  -0.718
  783    HA   LYS 103           HA       LYS 103  -2.483  -2.743  -0.395
  784   1HB   LYS 103          2HB       LYS 103  -1.764  -2.214  -3.072
  785   2HB   LYS 103          1HB       LYS 103  -3.166  -3.095  -2.487
  786   1HG   LYS 103          2HG       LYS 103  -3.301  -0.132  -2.553
  787   2HG   LYS 103          1HG       LYS 103  -3.388  -1.011  -4.081
  788   1HD   LYS 103          2HD       LYS 103  -5.083  -2.347  -2.249
  789   2HD   LYS 103          1HD       LYS 103  -5.433  -0.623  -2.123
  790   1HE   LYS 103          2HE       LYS 103  -6.856  -1.264  -3.815
  791   2HE   LYS 103          1HE       LYS 103  -5.448  -0.713  -4.722
  792   1HZ   LYS 103          1HZ       LYS 103  -5.973  -3.550  -4.016
  793   2HZ   LYS 103          2HZ       LYS 103  -4.746  -2.962  -5.031
  794   3HZ   LYS 103          3HZ       LYS 103  -6.369  -2.847  -5.509
  795    H    ALA 104           H        ALA 104  -0.454  -3.704  -0.512
  796    HA   ALA 104           HA       ALA 104   1.782  -2.180  -1.552
  797   1HB   ALA 104          1HB       ALA 104   2.862  -3.009   0.848
  798   2HB   ALA 104          2HB       ALA 104   1.276  -2.379   1.301
  799   3HB   ALA 104          3HB       ALA 104   2.415  -1.353   0.418
  800    H    ALA 105           H        ALA 105   3.177  -3.486  -2.535
  801    HA   ALA 105           HA       ALA 105   3.487  -6.244  -1.598
  802   1HB   ALA 105          1HB       ALA 105   3.472  -6.047  -4.512
  803   2HB   ALA 105          2HB       ALA 105   1.910  -5.687  -3.777
  804   3HB   ALA 105          3HB       ALA 105   2.703  -7.229  -3.453
  805    H    VAL 106           H        VAL 106   5.553  -7.058  -1.882
  806    HA   VAL 106           HA       VAL 106   7.484  -5.082  -2.905
  807    HB   VAL 106           HB       VAL 106   9.166  -5.875  -1.485
  808   1HG1  VAL 106          1HG1      VAL 106   6.693  -6.041   0.211
  809   2HG1  VAL 106          2HG1      VAL 106   7.346  -4.536  -0.436
  810   3HG1  VAL 106          3HG1      VAL 106   8.305  -5.503   0.687
  811   1HG2  VAL 106          1HG2      VAL 106   7.611  -8.349  -1.452
  812   2HG2  VAL 106          2HG2      VAL 106   8.287  -7.906   0.117
  813   3HG2  VAL 106          3HG2      VAL 106   9.348  -8.092  -1.281
  814    H    ASP 107           H        ASP 107   8.769  -5.527  -4.497
  815    HA   ASP 107           HA       ASP 107   8.868  -8.280  -5.533
  816   1HB   ASP 107          2HB       ASP 107   7.491  -7.142  -7.039
  817   2HB   ASP 107          1HB       ASP 107   8.394  -5.639  -6.877
  818    H    TYR 108           H        TYR 108  10.889  -8.848  -4.777
  819    HA   TYR 108           HA       TYR 108  13.175  -7.278  -4.869
  820   1HB   TYR 108          2HB       TYR 108  12.692 -10.236  -4.762
  821   2HB   TYR 108          1HB       TYR 108  14.333  -9.616  -4.904
  822    HD1  TYR 108           1HD      TYR 108  15.479  -9.537  -2.915
  823    HD2  TYR 108           2HD      TYR 108  11.297  -8.764  -2.884
  824    HE1  TYR 108           1HE      TYR 108  15.568  -9.198  -0.484
  825    HE2  TYR 108           2HE      TYR 108  11.375  -8.420  -0.449
  826    HH   TYR 108           HH       TYR 108  13.126  -7.753   1.267
  827    H    ASP 109           H        ASP 109  15.215  -8.571  -6.190
  828    HA   ASP 109           HA       ASP 109  14.651  -7.288  -8.751
  829   1HB   ASP 109          2HB       ASP 109  17.103  -7.379  -9.073
  830   2HB   ASP 109          1HB       ASP 109  16.664  -6.569  -7.574
  831    H    ARG 110           H        ARG 110  15.546  -8.318 -10.726
  832    HA   ARG 110           HA       ARG 110  14.405 -10.783 -11.225
  833   1HB   ARG 110          2HB       ARG 110  16.430  -9.101 -12.601
  834   2HB   ARG 110          1HB       ARG 110  16.287 -10.772 -13.130
  835   1HG   ARG 110          2HG       ARG 110  13.847 -10.384 -13.457
  836   2HG   ARG 110          1HG       ARG 110  14.129  -8.677 -13.109
  837   1HD   ARG 110          2HD       ARG 110  14.161  -8.838 -15.452
  838   2HD   ARG 110          1HD       ARG 110  15.855  -8.743 -14.973
  839    HE   ARG 110           HE       ARG 110  15.853 -11.248 -15.215
  840   1HH1  ARG 110          1HH1      ARG 110  13.604  -9.237 -16.993
  841   2HH1  ARG 110          2HH1      ARG 110  13.445 -10.359 -18.314
  842   1HH2  ARG 110          1HH2      ARG 110  15.659 -12.722 -16.941
  843   2HH2  ARG 110          2HH2      ARG 110  14.623 -12.347 -18.287
  844    H    SER 111           H        SER 111  17.669 -10.052 -10.162
  845    HA   SER 111           HA       SER 111  18.592 -12.757 -10.435
  846   1HB   SER 111          2HB       SER 111  20.354 -11.330  -8.770
  847   2HB   SER 111          1HB       SER 111  20.527 -11.633 -10.501
  848    HG   SER 111           HG       SER 111  19.364  -9.390  -9.197
  849    H    GLY 112           H        GLY 112  16.594 -11.318  -8.217
  850   1HA   GLY 112          2HA       GLY 112  16.066 -11.648  -5.992
  851   2HA   GLY 112          1HA       GLY 112  16.516 -13.319  -6.318
  852    H    ARG 113           H        ARG 113  18.090 -10.167  -5.775
  853    HA   ARG 113           HA       ARG 113  20.475 -11.617  -4.878
  854   1HB   ARG 113          2HB       ARG 113  20.743  -9.869  -6.554
  855   2HB   ARG 113          1HB       ARG 113  20.010  -8.691  -5.474
  856   1HG   ARG 113          2HG       ARG 113  21.941  -9.230  -3.882
  857   2HG   ARG 113          1HG       ARG 113  22.699  -9.996  -5.282
  858   1HD   ARG 113          2HD       ARG 113  21.730  -7.489  -6.137
  859   2HD   ARG 113          1HD       ARG 113  22.549  -7.220  -4.601
  860    HE   ARG 113           HE       ARG 113  24.531  -7.565  -5.660
  861   1HH1  ARG 113          1HH1      ARG 113  22.007  -9.002  -7.621
  862   2HH1  ARG 113          2HH1      ARG 113  23.081  -9.441  -8.912
  863   1HH2  ARG 113          1HH2      ARG 113  25.940  -8.102  -7.352
  864   2HH2  ARG 113          2HH2      ARG 113  25.329  -8.926  -8.761
  865    H    SER 114           H        SER 114  18.941  -8.629  -3.773
  866    HA   SER 114           HA       SER 114  18.504  -9.168  -1.122
  867   1HB   SER 114          2HB       SER 114  20.623  -7.928  -0.199
  868   2HB   SER 114          1HB       SER 114  20.737  -9.648  -0.563
  869    HG   SER 114           HG       SER 114  21.806  -7.447  -1.935
  870    H    LEU 115           H        LEU 115  16.882  -7.709  -1.494
  871    HA   LEU 115           HA       LEU 115  17.658  -4.947  -2.027
  872   1HB   LEU 115          2HB       LEU 115  16.765  -6.716  -4.019
  873   2HB   LEU 115          1HB       LEU 115  15.401  -5.679  -3.661
  874    HG   LEU 115           HG       LEU 115  17.243  -3.781  -3.932
  875   1HD1  LEU 115          1HD1      LEU 115  18.767  -4.365  -5.773
  876   2HD1  LEU 115          2HD1      LEU 115  18.243  -6.045  -5.657
  877   3HD1  LEU 115          3HD1      LEU 115  19.101  -5.292  -4.312
  878   1HD2  LEU 115          1HD2      LEU 115  16.143  -5.069  -6.401
  879   2HD2  LEU 115          2HD2      LEU 115  16.302  -3.353  -6.015
  880   3HD2  LEU 115          3HD2      LEU 115  15.074  -4.332  -5.206
  881    H    GLY 116           H        GLY 116  14.479  -6.066  -2.678
  882   1HA   GLY 116          2HA       GLY 116  12.614  -6.056  -1.173
  883   2HA   GLY 116          1HA       GLY 116  13.547  -5.021  -0.094
  884    H    THR 117           H        THR 117  12.942  -4.853  -3.573
  885    HA   THR 117           HA       THR 117  12.103  -2.095  -3.390
  886    HB   THR 117           HB       THR 117  11.466  -2.961  -5.932
  887    HG1  THR 117           1HG      THR 117  12.362  -4.918  -5.955
  888   1HG2  THR 117          1HG2      THR 117  13.132  -1.117  -4.847
  889   2HG2  THR 117          2HG2      THR 117  13.051  -1.478  -6.571
  890   3HG2  THR 117          3HG2      THR 117  14.298  -2.225  -5.571
  891    H    ALA 118           H        ALA 118   9.902  -1.449  -4.070
  892    HA   ALA 118           HA       ALA 118   7.940  -3.571  -4.193
  893   1HB   ALA 118          1HB       ALA 118   8.616  -2.561  -1.671
  894   2HB   ALA 118          2HB       ALA 118   7.243  -3.586  -2.087
  895   3HB   ALA 118          3HB       ALA 118   7.063  -1.831  -2.078
  896    H    ASP 119           H        ASP 119   5.764  -2.796  -4.349
  897    HA   ASP 119           HA       ASP 119   5.454  -0.020  -5.242
  898   1HB   ASP 119          2HB       ASP 119   5.247  -0.846  -7.351
  899   2HB   ASP 119          1HB       ASP 119   5.033  -2.495  -6.783
  900    H    VAL 120           H        VAL 120   4.171   0.841  -3.750
  901    HA   VAL 120           HA       VAL 120   1.927  -0.773  -2.736
  902    HB   VAL 120           HB       VAL 120   2.199   0.126  -0.572
  903   1HG1  VAL 120          1HG1      VAL 120   5.064   0.133  -0.832
  904   2HG1  VAL 120          2HG1      VAL 120   4.364  -1.142  -1.828
  905   3HG1  VAL 120          3HG1      VAL 120   4.012  -1.081  -0.102
  906   1HG2  VAL 120          1HG2      VAL 120   4.165   2.108  -1.699
  907   2HG2  VAL 120          2HG2      VAL 120   3.680   1.968  -0.005
  908   3HG2  VAL 120          3HG2      VAL 120   2.504   2.471  -1.221
  909    H    HIS 121           H        HIS 121  -0.077   0.387  -2.347
  910    HA   HIS 121           HA       HIS 121  -0.228   2.896  -3.893
  911   1HB   HIS 121          2HB       HIS 121  -1.639   0.311  -4.239
  912   2HB   HIS 121          1HB       HIS 121  -2.614   1.766  -4.425
  913    HD1  HIS 121           1HD      HIS 121  -0.038  -0.277  -6.103
  914    HD2  HIS 121           2HD      HIS 121  -1.832   3.445  -6.603
  915    HE1  HIS 121           1HE      HIS 121   0.526   0.437  -8.445
  916    HE2  HIS 121           2HE      HIS 121  -0.789   2.554  -8.806
  917    H    PHE 122           H        PHE 122  -1.186   4.522  -2.783
  918    HA   PHE 122           HA       PHE 122  -3.492   3.754  -1.118
  919   1HB   PHE 122          2HB       PHE 122  -2.787   6.320  -0.299
  920   2HB   PHE 122          1HB       PHE 122  -2.531   4.830   0.596
  921    HD1  PHE 122           1HD      PHE 122  -0.335   3.696   0.485
  922    HD2  PHE 122           2HD      PHE 122  -0.975   7.543  -1.214
  923    HE1  PHE 122           1HE      PHE 122   2.093   4.060   0.398
  924    HE2  PHE 122           2HE      PHE 122   1.452   7.912  -1.300
  925    HZ   PHE 122           HZ       PHE 122   2.980   6.230  -0.415
  926    H    GLU 123           H        GLU 123  -5.265   5.347  -1.131
  927    HA   GLU 123           HA       GLU 123  -5.726   6.139  -3.858
  928   1HB   GLU 123          2HB       GLU 123  -7.810   7.071  -2.145
  929   2HB   GLU 123          1HB       GLU 123  -7.855   5.785  -3.342
  930   1HG   GLU 123          2HG       GLU 123  -8.328   4.475  -1.607
  931   2HG   GLU 123          1HG       GLU 123  -6.596   4.553  -1.278
  932    H    ARG 124           H        ARG 124  -4.461   7.734  -1.129
  933    HA   ARG 124           HA       ARG 124  -5.419  10.345  -2.018
  934   1HB   ARG 124          2HB       ARG 124  -3.633   9.847   0.349
  935   2HB   ARG 124          1HB       ARG 124  -4.744  11.181   0.074
  936   1HG   ARG 124          2HG       ARG 124  -6.160   8.675   0.128
  937   2HG   ARG 124          1HG       ARG 124  -5.193   8.889   1.590
  938   1HD   ARG 124          2HD       ARG 124  -6.228  11.015   2.024
  939   2HD   ARG 124          1HD       ARG 124  -7.087  10.957   0.485
  940    HE   ARG 124           HE       ARG 124  -7.597   9.086   2.719
  941   1HH1  ARG 124          1HH1      ARG 124  -8.702  11.076   0.054
  942   2HH1  ARG 124          2HH1      ARG 124 -10.370  10.645   0.248
  943   1HH2  ARG 124          1HH2      ARG 124  -9.794   8.511   2.988
  944   2HH2  ARG 124          2HH2      ARG 124 -10.993   9.181   1.919
  945    H    ARG 125           H        ARG 125  -4.167  11.558  -3.340
  946    HA   ARG 125           HA       ARG 125  -1.534  10.677  -4.023
  947   1HB   ARG 125          2HB       ARG 125  -3.173  13.096  -4.772
  948   2HB   ARG 125          1HB       ARG 125  -1.532  12.850  -5.358
  949   1HG   ARG 125          2HG       ARG 125  -2.326  11.613  -7.009
  950   2HG   ARG 125          1HG       ARG 125  -2.950  10.456  -5.833
  951   1HD   ARG 125          2HD       ARG 125  -4.903  12.181  -5.627
  952   2HD   ARG 125          1HD       ARG 125  -4.342  12.703  -7.214
  953    HE   ARG 125           HE       ARG 125  -4.698  10.347  -7.929
  954   1HH1  ARG 125          1HH1      ARG 125  -6.380  11.585  -5.118
  955   2HH1  ARG 125          2HH1      ARG 125  -7.745  10.521  -5.305
  956   1HH2  ARG 125          1HH2      ARG 125  -6.488   8.937  -8.181
  957   2HH2  ARG 125          2HH2      ARG 125  -7.813   9.024  -7.054
  958    H    ALA 126           H        ALA 126  -2.897  13.185  -1.979
  959    HA   ALA 126           HA       ALA 126  -0.541  14.600  -1.418
  960   1HB   ALA 126          1HB       ALA 126  -1.844  15.035   0.819
  961   2HB   ALA 126          2HB       ALA 126  -3.167  14.267  -0.056
  962   3HB   ALA 126          3HB       ALA 126  -2.408  15.719  -0.705
  963    H    ASP 127           H        ASP 127  -1.891  11.679  -0.062
  964    HA   ASP 127           HA       ASP 127  -0.159  11.275   2.084
  965   1HB   ASP 127          2HB       ASP 127  -2.165   9.802   1.014
  966   2HB   ASP 127          1HB       ASP 127  -0.773   8.852   0.500
  967    H    ALA 128           H        ALA 128   0.372  10.846  -1.345
  968    HA   ALA 128           HA       ALA 128   2.921   9.516  -0.982
  969   1HB   ALA 128          1HB       ALA 128   1.240  10.304  -3.306
  970   2HB   ALA 128          2HB       ALA 128   2.033   8.767  -2.949
  971   3HB   ALA 128          3HB       ALA 128   2.977  10.123  -3.567
  972    H    LEU 129           H        LEU 129   1.650  12.695  -1.618
  973    HA   LEU 129           HA       LEU 129   4.059  14.026  -2.227
  974   1HB   LEU 129          2HB       LEU 129   1.783  14.955  -2.578
  975   2HB   LEU 129          1HB       LEU 129   1.603  15.110  -0.840
  976    HG   LEU 129           HG       LEU 129   3.998  16.449  -1.804
  977   1HD1  LEU 129          1HD1      LEU 129   1.330  17.367  -2.867
  978   2HD1  LEU 129          2HD1      LEU 129   2.672  16.740  -3.825
  979   3HD1  LEU 129          3HD1      LEU 129   2.845  18.267  -2.959
  980   1HD2  LEU 129          1HD2      LEU 129   2.973  16.747   0.414
  981   2HD2  LEU 129          2HD2      LEU 129   1.545  17.443  -0.353
  982   3HD2  LEU 129          3HD2      LEU 129   3.101  18.266  -0.473
  983    H    LYS 130           H        LYS 130   2.306  13.591   0.830
  984    HA   LYS 130           HA       LYS 130   4.226  14.827   2.480
  985   1HB   LYS 130          2HB       LYS 130   2.525  14.517   3.902
  986   2HB   LYS 130          1HB       LYS 130   1.770  13.367   2.812
  987   1HG   LYS 130          2HG       LYS 130   3.874  11.979   4.033
  988   2HG   LYS 130          1HG       LYS 130   3.091  12.910   5.316
  989   1HD   LYS 130          2HD       LYS 130   0.934  11.971   4.725
  990   2HD   LYS 130          1HD       LYS 130   1.654  11.107   3.366
  991   1HE   LYS 130          2HE       LYS 130   3.023   9.806   4.914
  992   2HE   LYS 130          1HE       LYS 130   2.325  10.681   6.276
  993   1HZ   LYS 130          1HZ       LYS 130   0.866   8.900   4.389
  994   2HZ   LYS 130          2HZ       LYS 130   0.140   9.802   5.630
  995   3HZ   LYS 130          3HZ       LYS 130   1.239   8.567   6.015
  996    H    ALA 131           H        ALA 131   3.883  11.583   1.220
  997    HA   ALA 131           HA       ALA 131   5.901  10.370   2.782
  998   1HB   ALA 131          1HB       ALA 131   5.921   8.667   0.897
  999   2HB   ALA 131          2HB       ALA 131   4.663   9.648   0.142
 1000   3HB   ALA 131          3HB       ALA 131   4.384   8.919   1.725
 1001    H    MET 132           H        MET 132   6.006  12.034  -0.377
 1002    HA   MET 132           HA       MET 132   8.726  11.490  -0.875
 1003   1HB   MET 132          2HB       MET 132   8.363  12.599  -2.805
 1004   2HB   MET 132          1HB       MET 132   6.678  12.541  -2.324
 1005   1HG   MET 132          2HG       MET 132   7.489  14.804  -1.085
 1006   2HG   MET 132          1HG       MET 132   8.517  14.814  -2.514
 1007   1HE   MET 132          1HE       MET 132   5.589  12.868  -3.702
 1008   2HE   MET 132          2HE       MET 132   6.875  13.497  -4.732
 1009   3HE   MET 132          3HE       MET 132   5.213  14.035  -4.970
 1010    H    LYS 133           H        LYS 133   7.072  13.882   1.045
 1011    HA   LYS 133           HA       LYS 133   9.427  15.536   1.331
 1012   1HB   LYS 133          2HB       LYS 133   6.595  15.703   2.023
 1013   2HB   LYS 133          1HB       LYS 133   7.640  16.303   3.302
 1014   1HG   LYS 133          2HG       LYS 133   7.018  18.132   1.894
 1015   2HG   LYS 133          1HG       LYS 133   8.732  17.792   1.649
 1016   1HD   LYS 133          2HD       LYS 133   8.320  17.667  -0.536
 1017   2HD   LYS 133          1HD       LYS 133   7.381  16.207  -0.220
 1018   1HE   LYS 133          2HE       LYS 133   5.431  17.250  -0.575
 1019   2HE   LYS 133          1HE       LYS 133   5.925  18.675   0.338
 1020   1HZ   LYS 133          1HZ       LYS 133   6.628  18.066  -2.487
 1021   2HZ   LYS 133          2HZ       LYS 133   7.203  19.397  -1.615
 1022   3HZ   LYS 133          3HZ       LYS 133   5.550  19.259  -1.953
 1023    H    GLN 134           H        GLN 134   7.628  13.199   3.261
 1024    HA   GLN 134           HA       GLN 134   9.444  13.539   5.507
 1025   1HB   GLN 134          2HB       GLN 134   6.808  12.310   5.079
 1026   2HB   GLN 134          1HB       GLN 134   7.840  11.464   6.224
 1027   1HG   GLN 134          2HG       GLN 134   6.992  12.884   7.717
 1028   2HG   GLN 134          1HG       GLN 134   8.136  14.039   7.032
 1029   1HE2  GLN 134          1HE2      GLN 134   7.266  15.162   5.024
 1030   2HE2  GLN 134          2HE2      GLN 134   5.632  15.738   5.110
 1031    H    TYR 135           H        TYR 135   8.291  10.678   3.687
 1032    HA   TYR 135           HA       TYR 135  10.164   8.953   4.897
 1033   1HB   TYR 135          2HB       TYR 135   7.983   8.690   3.132
 1034   2HB   TYR 135          1HB       TYR 135   9.364   7.949   2.328
 1035    HD1  TYR 135           1HD      TYR 135   8.465   8.087   5.947
 1036    HD2  TYR 135           2HD      TYR 135   9.072   5.669   2.506
 1037    HE1  TYR 135           1HE      TYR 135   8.196   6.067   7.325
 1038    HE2  TYR 135           2HE      TYR 135   8.811   3.646   3.861
 1039    HH   TYR 135           HH       TYR 135   7.416   3.327   6.443
 1040    H    LYS 136           H        LYS 136  10.131  10.355   1.617
 1041    HA   LYS 136           HA       LYS 136  12.628   9.217   0.908
 1042   1HB   LYS 136          2HB       LYS 136  10.879  10.070  -0.705
 1043   2HB   LYS 136          1HB       LYS 136  11.409  11.701  -0.303
 1044   1HG   LYS 136          2HG       LYS 136  13.767  10.732  -0.928
 1045   2HG   LYS 136          1HG       LYS 136  12.797   9.573  -1.839
 1046   1HD   LYS 136          2HD       LYS 136  11.792  12.215  -2.287
 1047   2HD   LYS 136          1HD       LYS 136  13.531  12.190  -2.588
 1048   1HE   LYS 136          2HE       LYS 136  11.370  10.581  -3.905
 1049   2HE   LYS 136          1HE       LYS 136  12.569  11.636  -4.648
 1050   1HZ   LYS 136          1HZ       LYS 136  12.916   8.908  -3.579
 1051   2HZ   LYS 136          2HZ       LYS 136  14.246   9.951  -3.715
 1052   3HZ   LYS 136          3HZ       LYS 136  13.355   9.526  -5.094
 1053    H    GLY 137           H        GLY 137  14.548   9.711   1.709
 1054   1HA   GLY 137          2HA       GLY 137  16.247  11.429   2.027
 1055   2HA   GLY 137          1HA       GLY 137  14.981  12.466   2.673
 1056    H    VAL 138           H        VAL 138  14.077   9.676   3.897
 1057    HA   VAL 138           HA       VAL 138  15.345  10.252   6.446
 1058    HB   VAL 138           HB       VAL 138  12.953   8.687   5.599
 1059   1HG1  VAL 138          1HG1      VAL 138  13.004   8.099   8.241
 1060   2HG1  VAL 138          2HG1      VAL 138  14.712   7.934   7.835
 1061   3HG1  VAL 138          3HG1      VAL 138  13.505   6.984   6.969
 1062   1HG2  VAL 138          1HG2      VAL 138  12.508   9.990   8.007
 1063   2HG2  VAL 138          2HG2      VAL 138  12.050  10.553   6.398
 1064   3HG2  VAL 138          3HG2      VAL 138  13.579  11.068   7.112
 1065    HA   PRO 139           HA       PRO 139  18.230   6.830   6.072
 1066   1HB   PRO 139          2HB       PRO 139  18.932   7.612   8.809
 1067   2HB   PRO 139          1HB       PRO 139  19.944   7.592   7.363
 1068   1HG   PRO 139          2HG       PRO 139  19.147   9.892   8.525
 1069   2HG   PRO 139          1HG       PRO 139  19.372   9.744   6.771
 1070   1HD   PRO 139          2HD       PRO 139  16.836   9.671   8.370
 1071   2HD   PRO 139          1HD       PRO 139  17.170  10.486   6.825
 1072    H    LEU 140           H        LEU 140  17.508   4.803   6.441
 1073    HA   LEU 140           HA       LEU 140  15.668   4.443   8.701
 1074   1HB   LEU 140          2HB       LEU 140  14.988   4.087   6.177
 1075   2HB   LEU 140          1HB       LEU 140  15.809   2.552   6.386
 1076    HG   LEU 140           HG       LEU 140  14.188   2.527   8.555
 1077   1HD1  LEU 140          1HD1      LEU 140  12.555   3.839   6.395
 1078   2HD1  LEU 140          2HD1      LEU 140  13.178   4.690   7.808
 1079   3HD1  LEU 140          3HD1      LEU 140  12.027   3.368   8.010
 1080   1HD2  LEU 140          1HD2      LEU 140  13.437   1.632   5.776
 1081   2HD2  LEU 140          2HD2      LEU 140  12.780   1.007   7.287
 1082   3HD2  LEU 140          3HD2      LEU 140  14.478   0.748   6.892
 1083    H    ASP 141           H        ASP 141  16.796   3.630  10.314
 1084    HA   ASP 141           HA       ASP 141  18.445   2.618  11.495
 1085   1HB   ASP 141          2HB       ASP 141  16.852   0.698  10.505
 1086   2HB   ASP 141          1HB       ASP 141  18.382   0.197   9.785
 1087    H    GLY 142           H        GLY 142  20.089   4.051  10.768
 1088   1HA   GLY 142          2HA       GLY 142  22.401   4.004  10.385
 1089   2HA   GLY 142          1HA       GLY 142  22.194   2.546   9.431
 1090    H    ARG 143           H        ARG 143  20.606   3.083   7.378
 1091    HA   ARG 143           HA       ARG 143  21.952   5.384   6.115
 1092   1HB   ARG 143          2HB       ARG 143  22.060   3.970   4.059
 1093   2HB   ARG 143          1HB       ARG 143  23.049   3.372   5.384
 1094   1HG   ARG 143          2HG       ARG 143  21.335   1.723   5.930
 1095   2HG   ARG 143          1HG       ARG 143  20.331   2.328   4.612
 1096   1HD   ARG 143          2HD       ARG 143  21.411   0.418   3.764
 1097   2HD   ARG 143          1HD       ARG 143  22.268   1.796   3.075
 1098    HE   ARG 143           HE       ARG 143  23.409   0.751   5.524
 1099   1HH1  ARG 143          1HH1      ARG 143  23.404   0.662   2.019
 1100   2HH1  ARG 143          2HH1      ARG 143  24.998  -0.039   1.911
 1101   1HH2  ARG 143          1HH2      ARG 143  25.485  -0.175   5.389
 1102   2HH2  ARG 143          2HH2      ARG 143  26.175  -0.517   3.832
 1103    HA   PRO 144           HA       PRO 144  17.974   6.718   4.691
 1104   1HB   PRO 144          2HB       PRO 144  19.315   7.413   2.144
 1105   2HB   PRO 144          1HB       PRO 144  18.412   8.444   3.259
 1106   1HG   PRO 144          2HG       PRO 144  21.072   8.597   3.091
 1107   2HG   PRO 144          1HG       PRO 144  20.237   8.766   4.648
 1108   1HD   PRO 144          2HD       PRO 144  21.707   6.409   3.527
 1109   2HD   PRO 144          1HD       PRO 144  21.690   7.043   5.188
 1110    H    MET 145           H        MET 145  16.334   5.666   3.794
 1111    HA   MET 145           HA       MET 145  16.931   3.454   1.987
 1112   1HB   MET 145          2HB       MET 145  14.782   2.585   2.494
 1113   2HB   MET 145          1HB       MET 145  15.461   3.139   4.016
 1114   1HG   MET 145          2HG       MET 145  14.021   4.957   4.139
 1115   2HG   MET 145          1HG       MET 145  13.646   4.898   2.418
 1116   1HE   MET 145          1HE       MET 145  11.303   1.799   2.154
 1117   2HE   MET 145          2HE       MET 145  13.017   1.989   1.777
 1118   3HE   MET 145          3HE       MET 145  11.869   3.251   1.328
 1119    H    ASP 146           H        ASP 146  15.519   3.105   0.135
 1120    HA   ASP 146           HA       ASP 146  15.111   5.683  -1.216
 1121   1HB   ASP 146          2HB       ASP 146  16.671   4.154  -2.314
 1122   2HB   ASP 146          1HB       ASP 146  15.412   2.927  -2.418
 1123    H    ILE 147           H        ILE 147  13.257   6.328  -2.044
 1124    HA   ILE 147           HA       ILE 147  11.026   4.477  -2.311
 1125    HB   ILE 147           HB       ILE 147   9.637   6.546  -1.316
 1126   1HG1  ILE 147          2HG1      ILE 147  12.156   7.358  -0.655
 1127   2HG1  ILE 147          1HG1      ILE 147  10.695   7.858   0.183
 1128   1HG2  ILE 147          1HG2      ILE 147   9.292   5.247   0.678
 1129   2HG2  ILE 147          2HG2      ILE 147  10.801   4.374   0.414
 1130   3HG2  ILE 147          3HG2      ILE 147   9.456   4.163  -0.706
 1131   1HD1  ILE 147          1HD1      ILE 147  12.392   7.210   1.765
 1132   2HD1  ILE 147          2HD1      ILE 147  12.548   5.630   0.995
 1133   3HD1  ILE 147          3HD1      ILE 147  11.052   6.064   1.823
 1134    H    GLN 148           H        GLN 148   9.752   4.967  -4.002
 1135    HA   GLN 148           HA       GLN 148  10.277   7.525  -5.367
 1136   1HB   GLN 148          2HB       GLN 148   9.735   4.805  -6.537
 1137   2HB   GLN 148          1HB       GLN 148   9.522   6.292  -7.463
 1138   1HG   GLN 148          2HG       GLN 148  11.748   6.672  -7.628
 1139   2HG   GLN 148          1HG       GLN 148  12.101   5.945  -6.058
 1140   1HE2  GLN 148          1HE2      GLN 148  12.816   3.904  -5.986
 1141   2HE2  GLN 148          2HE2      GLN 148  12.931   2.843  -7.355
 1142    H    LEU 149           H        LEU 149   8.661   8.811  -5.083
 1143    HA   LEU 149           HA       LEU 149   6.038   7.630  -4.531
 1144   1HB   LEU 149          2HB       LEU 149   6.739  10.393  -3.705
 1145   2HB   LEU 149          1HB       LEU 149   5.827   9.156  -2.843
 1146    HG   LEU 149           HG       LEU 149   8.347   8.052  -2.978
 1147   1HD1  LEU 149          1HD1      LEU 149   8.620  10.923  -3.226
 1148   2HD1  LEU 149          2HD1      LEU 149   9.815   9.641  -3.427
 1149   3HD1  LEU 149          3HD1      LEU 149   9.462  10.273  -1.819
 1150   1HD2  LEU 149          1HD2      LEU 149   6.979   7.931  -1.038
 1151   2HD2  LEU 149          2HD2      LEU 149   7.085   9.673  -0.788
 1152   3HD2  LEU 149          3HD2      LEU 149   8.517   8.663  -0.583
 1153    H    VAL 150           H        VAL 150   4.968   7.649  -6.359
 1154    HA   VAL 150           HA       VAL 150   4.730  10.177  -7.823
 1155    HB   VAL 150           HB       VAL 150   6.209   8.921  -9.192
 1156   1HG1  VAL 150          1HG1      VAL 150   6.318   6.707  -9.243
 1157   2HG1  VAL 150          2HG1      VAL 150   4.649   6.579  -9.800
 1158   3HG1  VAL 150          3HG1      VAL 150   4.998   6.672  -8.074
 1159   1HG2  VAL 150          1HG2      VAL 150   5.064   9.617 -10.956
 1160   2HG2  VAL 150          2HG2      VAL 150   3.551   9.515 -10.056
 1161   3HG2  VAL 150          3HG2      VAL 150   4.152   8.108 -10.932
 1162    H    ALA 151           H        ALA 151   2.662  10.771  -8.128
 1163    HA   ALA 151           HA       ALA 151   0.619   8.705  -7.699
 1164   1HB   ALA 151          1HB       ALA 151   0.842  10.015  -5.684
 1165   2HB   ALA 151          2HB       ALA 151  -0.705  10.367  -6.449
 1166   3HB   ALA 151          3HB       ALA 151   0.634  11.512  -6.590
 1167    H    SER 152           H        SER 152  -0.827  11.689  -8.024
 1168    HA   SER 152           HA       SER 152  -2.174  12.574  -9.594
 1169   1HB   SER 152          2HB       SER 152  -0.321  11.623 -11.759
 1170   2HB   SER 152          1HB       SER 152  -1.215  13.138 -11.646
 1171    HG   SER 152           HG       SER 152   0.400  13.039  -9.555
 1172    H    GLN 153           H        GLN 153  -1.228  10.415 -12.120
 1173    HA   GLN 153           HA       GLN 153  -3.683   8.848 -11.672
 1174   1HB   GLN 153          2HB       GLN 153  -4.087   8.771 -14.001
 1175   2HB   GLN 153          1HB       GLN 153  -3.689  10.445 -13.647
 1176   1HG   GLN 153          2HG       GLN 153  -1.655   8.486 -14.663
 1177   2HG   GLN 153          1HG       GLN 153  -2.678   9.442 -15.735
 1178   1HE2  GLN 153          1HE2      GLN 153  -2.404  11.684 -15.807
 1179   2HE2  GLN 153          2HE2      GLN 153  -0.955  12.439 -15.237
 1180    H    ILE 154           H        ILE 154  -0.347   8.802 -11.916
 1181    HA   ILE 154           HA       ILE 154   1.257   7.314 -12.602
 1182    HB   ILE 154           HB       ILE 154   0.333   5.005 -11.234
 1183   1HG1  ILE 154          2HG1      ILE 154   0.295   6.957  -9.118
 1184   2HG1  ILE 154          1HG1      ILE 154  -0.985   7.316 -10.272
 1185   1HG2  ILE 154          1HG2      ILE 154   2.127   6.812  -9.810
 1186   2HG2  ILE 154          2HG2      ILE 154   2.594   6.514 -11.485
 1187   3HG2  ILE 154          3HG2      ILE 154   2.387   5.160 -10.373
 1188   1HD1  ILE 154          1HD1      ILE 154  -1.705   4.925 -10.064
 1189   2HD1  ILE 154          2HD1      ILE 154  -1.905   5.907  -8.612
 1190   3HD1  ILE 154          3HD1      ILE 154  -0.559   4.775  -8.731
 1191    H    ASP 155           H        ASP 155  -0.185   7.399 -14.726
 1192    HA   ASP 155           HA       ASP 155  -0.847   4.627 -15.463
 1193   1HB   ASP 155          2HB       ASP 155  -2.740   6.203 -15.576
 1194   2HB   ASP 155          1HB       ASP 155  -1.822   7.223 -16.679
 1195    H    LEU 156           H        LEU 156   1.270   7.239 -15.978
 1196    HA   LEU 156           HA       LEU 156   2.030   6.417 -18.654
 1197   1HB   LEU 156          2HB       LEU 156   2.908   8.636 -16.826
 1198   2HB   LEU 156          1HB       LEU 156   3.753   8.281 -18.321
 1199    HG   LEU 156           HG       LEU 156   1.321   8.516 -19.347
 1200   1HD1  LEU 156          1HD1      LEU 156   0.583   8.966 -16.845
 1201   2HD1  LEU 156          2HD1      LEU 156  -0.179   9.792 -18.205
 1202   3HD1  LEU 156          3HD1      LEU 156   1.066  10.611 -17.261
 1203   1HD2  LEU 156          1HD2      LEU 156   1.858  11.052 -19.470
 1204   2HD2  LEU 156          2HD2      LEU 156   2.958   9.888 -20.212
 1205   3HD2  LEU 156          3HD2      LEU 156   3.344  10.590 -18.640
 1206    H    GLU 157           H        GLU 157   4.132   7.274 -15.931
 1207    HA   GLU 157           HA       GLU 157   6.139   6.461 -15.260
 1208   1HB   GLU 157          2HB       GLU 157   4.537   3.987 -15.762
 1209   2HB   GLU 157          1HB       GLU 157   6.248   3.833 -15.384
 1210   1HG   GLU 157          2HG       GLU 157   5.903   5.032 -13.296
 1211   2HG   GLU 157          1HG       GLU 157   4.192   5.219 -13.682
 1212    H    HIS 158           H        HIS 158   6.420   3.623 -17.007
 1213    HA   HIS 158           HA       HIS 158   7.399   4.703 -19.464
 1214   1HB   HIS 158          2HB       HIS 158   9.216   4.808 -17.406
 1215   2HB   HIS 158          1HB       HIS 158   9.583   3.250 -18.139
 1216    HD1  HIS 158           1HD      HIS 158  11.605   5.549 -18.287
 1217    HD2  HIS 158           2HD      HIS 158   8.760   4.756 -21.216
 1218    HE1  HIS 158           1HE      HIS 158  12.510   6.562 -20.409
 1219    HE2  HIS 158           2HE      HIS 158  10.862   5.892 -22.197
  Start of MODEL   14
    1    H    MET   1           H        MET   1 -89.795  25.088 -85.444
    2    HA   MET   1           HA       MET   1 -88.912  25.849 -88.144
    3   1HB   MET   1          2HB       MET   1 -87.298  27.256 -87.179
    4   2HB   MET   1          1HB       MET   1 -88.720  27.479 -86.173
    5   1HG   MET   1          2HG       MET   1 -87.569  25.558 -84.768
    6   2HG   MET   1          1HG       MET   1 -86.124  26.199 -85.545
    7   1HE   MET   1          1HE       MET   1 -87.098  26.351 -82.114
    8   2HE   MET   1          2HE       MET   1 -85.893  27.635 -81.971
    9   3HE   MET   1          3HE       MET   1 -85.575  26.236 -83.003
   10    H    ALA   2           H        ALA   2 -88.935  23.284 -86.190
   11    HA   ALA   2           HA       ALA   2 -87.889  21.287 -86.123
   12   1HB   ALA   2          1HB       ALA   2 -86.094  21.150 -88.188
   13   2HB   ALA   2          2HB       ALA   2 -87.278  22.314 -88.781
   14   3HB   ALA   2          3HB       ALA   2 -87.798  20.707 -88.274
   15    H    ASP   3           H        ASP   3 -86.919  23.053 -84.401
   16    HA   ASP   3           HA       ASP   3 -84.093  22.305 -84.283
   17   1HB   ASP   3          2HB       ASP   3 -84.149  24.565 -85.267
   18   2HB   ASP   3          1HB       ASP   3 -85.081  25.135 -83.889
   19    H    LYS   4           H        LYS   4 -86.121  24.535 -82.439
   20    HA   LYS   4           HA       LYS   4 -86.780  24.621 -80.275
   21   1HB   LYS   4          2HB       LYS   4 -87.746  22.350 -81.137
   22   2HB   LYS   4          1HB       LYS   4 -86.547  21.645 -80.059
   23   1HG   LYS   4          2HG       LYS   4 -87.907  21.930 -78.342
   24   2HG   LYS   4          1HG       LYS   4 -87.923  23.672 -78.629
   25   1HD   LYS   4          2HD       LYS   4 -89.580  22.528 -80.585
   26   2HD   LYS   4          1HD       LYS   4 -89.999  21.743 -79.059
   27   1HE   LYS   4          2HE       LYS   4 -90.944  23.603 -78.241
   28   2HE   LYS   4          1HE       LYS   4 -89.629  24.627 -78.819
   29   1HZ   LYS   4          1HZ       LYS   4 -90.827  24.013 -81.115
   30   2HZ   LYS   4          2HZ       LYS   4 -91.214  25.385 -80.192
   31   3HZ   LYS   4          3HZ       LYS   4 -92.163  23.988 -80.067
   32    H    MET   5           H        MET   5 -83.866  24.711 -80.799
   33    HA   MET   5           HA       MET   5 -83.057  24.171 -78.054
   34   1HB   MET   5          2HB       MET   5 -82.540  22.100 -79.363
   35   2HB   MET   5          1HB       MET   5 -81.438  23.057 -80.343
   36   1HG   MET   5          2HG       MET   5 -80.488  21.682 -78.397
   37   2HG   MET   5          1HG       MET   5 -79.932  23.339 -78.617
   38   1HE   MET   5          1HE       MET   5 -79.803  24.978 -76.529
   39   2HE   MET   5          2HE       MET   5 -78.937  23.451 -76.365
   40   3HE   MET   5          3HE       MET   5 -79.866  24.087 -75.008
   41    H    ASP   6           H        ASP   6 -81.741  25.154 -81.219
   42    HA   ASP   6           HA       ASP   6 -79.940  27.006 -79.853
   43   1HB   ASP   6          2HB       ASP   6 -80.149  26.230 -82.771
   44   2HB   ASP   6          1HB       ASP   6 -78.948  27.329 -82.107
   45    H    MET   7           H        MET   7 -82.411  26.982 -82.375
   46    HA   MET   7           HA       MET   7 -83.618  28.595 -83.403
   47   1HB   MET   7          2HB       MET   7 -84.221  28.921 -80.881
   48   2HB   MET   7          1HB       MET   7 -83.291  30.406 -81.037
   49   1HG   MET   7          2HG       MET   7 -84.839  30.713 -83.161
   50   2HG   MET   7          1HG       MET   7 -85.901  29.662 -82.226
   51   1HE   MET   7          1HE       MET   7 -87.294  30.146 -80.756
   52   2HE   MET   7          2HE       MET   7 -88.001  31.682 -81.254
   53   3HE   MET   7          3HE       MET   7 -87.384  31.487 -79.614
   54    H    SER   8           H        SER   8 -81.907  31.025 -81.542
   55    HA   SER   8           HA       SER   8 -81.049  32.334 -83.945
   56   1HB   SER   8          2HB       SER   8 -79.815  33.502 -81.677
   57   2HB   SER   8          1HB       SER   8 -81.220  34.093 -82.567
   58    HG   SER   8           HG       SER   8 -81.081  32.645 -80.177
   59    H    LEU   9           H        LEU   9 -79.786  30.349 -84.578
   60    HA   LEU   9           HA       LEU   9 -77.453  29.550 -83.224
   61   1HB   LEU   9          2HB       LEU   9 -78.814  28.832 -85.576
   62   2HB   LEU   9          1HB       LEU   9 -77.192  29.262 -86.081
   63    HG   LEU   9           HG       LEU   9 -78.046  27.065 -84.216
   64   1HD1  LEU   9          1HD1      LEU   9 -76.783  27.296 -86.886
   65   2HD1  LEU   9          2HD1      LEU   9 -77.959  26.128 -86.281
   66   3HD1  LEU   9          3HD1      LEU   9 -76.258  25.973 -85.844
   67   1HD2  LEU   9          1HD2      LEU   9 -75.166  27.745 -84.658
   68   2HD2  LEU   9          2HD2      LEU   9 -75.903  26.758 -83.394
   69   3HD2  LEU   9          3HD2      LEU   9 -76.074  28.513 -83.355
   70    H    ASP  10           H        ASP  10 -78.076  32.098 -85.535
   71    HA   ASP  10           HA       ASP  10 -75.401  32.680 -86.212
   72   1HB   ASP  10          2HB       ASP  10 -76.234  34.757 -87.117
   73   2HB   ASP  10          1HB       ASP  10 -77.382  33.479 -87.492
   74    H    ASP  11           H        ASP  11 -77.504  33.845 -83.635
   75    HA   ASP  11           HA       ASP  11 -75.638  35.721 -82.584
   76   1HB   ASP  11          2HB       ASP  11 -78.062  35.843 -82.119
   77   2HB   ASP  11          1HB       ASP  11 -77.953  34.345 -81.200
   78    H    ILE  12           H        ILE  12 -76.325  32.325 -81.987
   79    HA   ILE  12           HA       ILE  12 -74.611  31.964 -79.772
   80    HB   ILE  12           HB       ILE  12 -75.259  29.956 -81.925
   81   1HG1  ILE  12          2HG1      ILE  12 -76.651  30.383 -79.269
   82   2HG1  ILE  12          1HG1      ILE  12 -77.256  31.001 -80.803
   83   1HG2  ILE  12          1HG2      ILE  12 -74.259  28.365 -80.667
   84   2HG2  ILE  12          2HG2      ILE  12 -74.788  29.085 -79.148
   85   3HG2  ILE  12          3HG2      ILE  12 -73.371  29.733 -79.983
   86   1HD1  ILE  12          1HD1      ILE  12 -76.817  28.309 -81.273
   87   2HD1  ILE  12          2HD1      ILE  12 -78.369  29.099 -80.994
   88   3HD1  ILE  12          3HD1      ILE  12 -77.494  28.374 -79.646
   89    H    ILE  13           H        ILE  13 -74.096  31.548 -83.253
   90    HA   ILE  13           HA       ILE  13 -71.432  30.882 -83.342
   91    HB   ILE  13           HB       ILE  13 -72.991  32.751 -85.120
   92   1HG1  ILE  13          2HG1      ILE  13 -71.939  30.017 -85.801
   93   2HG1  ILE  13          1HG1      ILE  13 -73.442  30.206 -84.904
   94   1HG2  ILE  13          1HG2      ILE  13 -71.236  32.851 -86.675
   95   2HG2  ILE  13          2HG2      ILE  13 -70.326  31.578 -85.860
   96   3HG2  ILE  13          3HG2      ILE  13 -70.473  33.172 -85.118
   97   1HD1  ILE  13          1HD1      ILE  13 -74.550  31.121 -86.695
   98   2HD1  ILE  13          2HD1      ILE  13 -73.481  29.961 -87.485
   99   3HD1  ILE  13          3HD1      ILE  13 -73.066  31.675 -87.468
  100    H    LYS  14           H        LYS  14 -72.772  34.169 -83.125
  101    HA   LYS  14           HA       LYS  14 -70.360  35.560 -82.808
  102   1HB   LYS  14          2HB       LYS  14 -73.023  36.209 -81.537
  103   2HB   LYS  14          1HB       LYS  14 -71.703  37.336 -81.819
  104   1HG   LYS  14          2HG       LYS  14 -73.162  35.887 -84.016
  105   2HG   LYS  14          1HG       LYS  14 -73.594  37.498 -83.438
  106   1HD   LYS  14          2HD       LYS  14 -71.449  38.366 -84.095
  107   2HD   LYS  14          1HD       LYS  14 -70.880  36.749 -84.518
  108   1HE   LYS  14          2HE       LYS  14 -71.480  37.404 -86.599
  109   2HE   LYS  14          1HE       LYS  14 -73.070  36.866 -86.059
  110   1HZ   LYS  14          1HZ       LYS  14 -72.035  39.646 -86.130
  111   2HZ   LYS  14          2HZ       LYS  14 -73.477  39.211 -85.350
  112   3HZ   LYS  14          3HZ       LYS  14 -73.321  39.000 -87.028
  113    H    LEU  15           H        LEU  15 -72.549  34.194 -80.380
  114    HA   LEU  15           HA       LEU  15 -71.112  34.914 -78.089
  115   1HB   LEU  15          2HB       LEU  15 -73.421  33.433 -78.698
  116   2HB   LEU  15          1HB       LEU  15 -72.395  32.350 -77.779
  117    HG   LEU  15           HG       LEU  15 -72.263  34.028 -75.973
  118   1HD1  LEU  15          1HD1      LEU  15 -74.505  35.566 -77.143
  119   2HD1  LEU  15          2HD1      LEU  15 -72.887  35.882 -77.769
  120   3HD1  LEU  15          3HD1      LEU  15 -73.221  36.082 -76.050
  121   1HD2  LEU  15          1HD2      LEU  15 -73.887  32.371 -75.642
  122   2HD2  LEU  15          2HD2      LEU  15 -74.952  33.045 -76.877
  123   3HD2  LEU  15          3HD2      LEU  15 -74.729  33.891 -75.345
  124    H    ASN  16           H        ASN  16 -70.660  32.332 -80.364
  125    HA   ASN  16           HA       ASN  16 -68.885  30.803 -78.725
  126   1HB   ASN  16          2HB       ASN  16 -69.884  30.661 -81.511
  127   2HB   ASN  16          1HB       ASN  16 -68.323  29.907 -81.200
  128   1HD2  ASN  16          1HD2      ASN  16 -71.630  30.074 -79.996
  129   2HD2  ASN  16          2HD2      ASN  16 -71.699  28.428 -79.453
  130    H    ARG  17           H        ARG  17 -68.609  33.379 -81.044
  131    HA   ARG  17           HA       ARG  17 -65.830  33.195 -81.558
  132   1HB   ARG  17          2HB       ARG  17 -67.855  35.400 -81.825
  133   2HB   ARG  17          1HB       ARG  17 -66.152  35.698 -82.135
  134   1HG   ARG  17          2HG       ARG  17 -66.174  34.580 -84.088
  135   2HG   ARG  17          1HG       ARG  17 -67.324  33.370 -83.509
  136   1HD   ARG  17          2HD       ARG  17 -69.054  34.476 -84.377
  137   2HD   ARG  17          1HD       ARG  17 -68.520  36.001 -83.672
  138    HE   ARG  17           HE       ARG  17 -67.567  34.928 -86.254
  139   1HH1  ARG  17          1HH1      ARG  17 -68.368  37.614 -84.139
  140   2HH1  ARG  17          2HH1      ARG  17 -68.025  38.826 -85.344
  141   1HH2  ARG  17          1HH2      ARG  17 -67.118  36.521 -87.833
  142   2HH2  ARG  17          2HH2      ARG  17 -67.310  38.203 -87.441
  143    H    ASN  18           H        ASN  18 -67.748  34.952 -79.164
  144    HA   ASN  18           HA       ASN  18 -65.330  36.039 -77.956
  145   1HB   ASN  18          2HB       ASN  18 -66.746  37.341 -76.555
  146   2HB   ASN  18          1HB       ASN  18 -67.469  37.372 -78.158
  147   1HD2  ASN  18          1HD2      ASN  18 -67.830  36.387 -74.879
  148   2HD2  ASN  18          2HD2      ASN  18 -69.462  35.819 -75.006
  149    H    GLN  19           H        GLN  19 -66.556  33.107 -77.935
  150    HA   GLN  19           HA       GLN  19 -66.564  32.592 -75.077
  151   1HB   GLN  19          2HB       GLN  19 -67.551  31.268 -77.439
  152   2HB   GLN  19          1HB       GLN  19 -66.558  30.160 -76.502
  153   1HG   GLN  19          2HG       GLN  19 -68.577  31.760 -75.045
  154   2HG   GLN  19          1HG       GLN  19 -69.152  30.454 -76.081
  155   1HE2  GLN  19          1HE2      GLN  19 -69.800  30.050 -73.660
  156   2HE2  GLN  19          2HE2      GLN  19 -68.772  28.933 -72.828
  157    H    ARG  20           H        ARG  20 -65.172  30.967 -74.131
  158    HA   ARG  20           HA       ARG  20 -62.450  31.166 -74.984
  159   1HB   ARG  20          2HB       ARG  20 -61.945  29.719 -73.095
  160   2HB   ARG  20          1HB       ARG  20 -63.073  30.976 -72.606
  161   1HG   ARG  20          2HG       ARG  20 -64.914  29.282 -72.953
  162   2HG   ARG  20          1HG       ARG  20 -63.642  28.069 -73.103
  163   1HD   ARG  20          2HD       ARG  20 -62.870  29.281 -70.831
  164   2HD   ARG  20          1HD       ARG  20 -64.615  29.528 -70.731
  165    HE   ARG  20           HE       ARG  20 -63.381  26.861 -71.072
  166   1HH1  ARG  20          1HH1      ARG  20 -65.723  28.999 -69.565
  167   2HH1  ARG  20          2HH1      ARG  20 -66.493  27.721 -68.673
  168   1HH2  ARG  20          1HH2      ARG  20 -64.368  25.201 -69.891
  169   2HH2  ARG  20          2HH2      ARG  20 -65.706  25.556 -68.837
  170    H    ARG  21           H        ARG  21 -65.017  28.850 -75.324
  171    HA   ARG  21           HA       ARG  21 -65.323  27.023 -76.611
  172   1HB   ARG  21          2HB       ARG  21 -62.932  28.237 -77.931
  173   2HB   ARG  21          1HB       ARG  21 -63.435  26.619 -78.398
  174   1HG   ARG  21          2HG       ARG  21 -65.627  27.450 -79.017
  175   2HG   ARG  21          1HG       ARG  21 -65.180  29.072 -78.486
  176   1HD   ARG  21          2HD       ARG  21 -65.039  28.535 -80.995
  177   2HD   ARG  21          1HD       ARG  21 -63.679  29.368 -80.243
  178    HE   ARG  21           HE       ARG  21 -62.678  27.029 -80.083
  179   1HH1  ARG  21          1HH1      ARG  21 -64.799  28.076 -82.674
  180   2HH1  ARG  21          2HH1      ARG  21 -64.192  26.900 -83.806
  181   1HH2  ARG  21          1HH2      ARG  21 -61.884  25.504 -81.556
  182   2HH2  ARG  21          2HH2      ARG  21 -62.556  25.407 -83.158
  183    H    VAL  22           H        VAL  22 -61.795  26.973 -76.503
  184    HA   VAL  22           HA       VAL  22 -61.878  24.586 -74.798
  185    HB   VAL  22           HB       VAL  22 -60.278  24.772 -77.365
  186   1HG1  VAL  22          1HG1      VAL  22 -59.197  22.836 -76.826
  187   2HG1  VAL  22          2HG1      VAL  22 -60.503  22.266 -75.785
  188   3HG1  VAL  22          3HG1      VAL  22 -59.401  23.518 -75.212
  189   1HG2  VAL  22          1HG2      VAL  22 -61.842  23.572 -78.430
  190   2HG2  VAL  22          2HG2      VAL  22 -62.920  24.100 -77.137
  191   3HG2  VAL  22          3HG2      VAL  22 -62.124  22.529 -77.036
  192    H    ASN  23           H        ASN  23 -60.614  24.990 -73.095
  193    HA   ASN  23           HA       ASN  23 -58.114  26.466 -73.535
  194   1HB   ASN  23          2HB       ASN  23 -59.927  27.923 -72.483
  195   2HB   ASN  23          1HB       ASN  23 -59.793  26.889 -71.066
  196   1HD2  ASN  23          1HD2      ASN  23 -59.047  28.519 -69.768
  197   2HD2  ASN  23          2HD2      ASN  23 -57.470  29.204 -69.946
  198    H    ARG  24           H        ARG  24 -57.063  24.484 -73.521
  199    HA   ARG  24           HA       ARG  24 -56.700  23.376 -70.825
  200   1HB   ARG  24          2HB       ARG  24 -56.269  21.143 -71.986
  201   2HB   ARG  24          1HB       ARG  24 -57.943  21.669 -71.881
  202   1HG   ARG  24          2HG       ARG  24 -58.074  22.139 -74.141
  203   2HG   ARG  24          1HG       ARG  24 -56.323  22.291 -74.311
  204   1HD   ARG  24          2HD       ARG  24 -56.097  19.871 -73.944
  205   2HD   ARG  24          1HD       ARG  24 -57.851  19.735 -73.821
  206    HE   ARG  24           HE       ARG  24 -58.016  19.914 -76.103
  207   1HH1  ARG  24          1HH1      ARG  24 -54.733  20.686 -75.101
  208   2HH1  ARG  24          2HH1      ARG  24 -54.131  20.786 -76.738
  209   1HH2  ARG  24          1HH2      ARG  24 -57.203  20.021 -78.238
  210   2HH2  ARG  24          2HH2      ARG  24 -55.525  20.389 -78.505
  211    H    GLY  25           H        GLY  25 -54.677  23.641 -70.192
  212   1HA   GLY  25          2HA       GLY  25 -52.642  24.249 -72.191
  213   2HA   GLY  25          1HA       GLY  25 -52.483  24.448 -70.450
  214    H    GLY  26           H        GLY  26 -51.653  22.820 -69.230
  215   1HA   GLY  26          2HA       GLY  26 -51.064  20.579 -68.767
  216   2HA   GLY  26          1HA       GLY  26 -51.256  20.197 -70.472
  217    H    GLY  27           H        GLY  27 -49.664  22.142 -71.631
  218   1HA   GLY  27          2HA       GLY  27 -47.439  22.871 -71.812
  219   2HA   GLY  27          1HA       GLY  27 -47.027  21.888 -70.412
  220    HA   PRO  28           HA       PRO  28 -46.778  19.508 -74.726
  221   1HB   PRO  28          2HB       PRO  28 -44.571  21.312 -75.550
  222   2HB   PRO  28          1HB       PRO  28 -45.860  20.594 -76.524
  223   1HG   PRO  28          2HG       PRO  28 -45.907  23.186 -75.899
  224   2HG   PRO  28          1HG       PRO  28 -47.398  22.225 -75.928
  225   1HD   PRO  28          2HD       PRO  28 -45.764  23.119 -73.583
  226   2HD   PRO  28          1HD       PRO  28 -47.532  23.061 -73.765
  227    H    ARG  29           H        ARG  29 -45.613  17.763 -74.404
  228    HA   ARG  29           HA       ARG  29 -43.940  16.332 -73.859
  229   1HB   ARG  29          2HB       ARG  29 -42.518  18.632 -74.555
  230   2HB   ARG  29          1HB       ARG  29 -41.861  18.152 -72.996
  231   1HG   ARG  29          2HG       ARG  29 -40.540  16.817 -74.201
  232   2HG   ARG  29          1HG       ARG  29 -41.957  15.769 -74.299
  233   1HD   ARG  29          2HD       ARG  29 -42.344  16.269 -76.471
  234   2HD   ARG  29          1HD       ARG  29 -41.801  17.938 -76.292
  235    HE   ARG  29           HE       ARG  29 -39.835  15.752 -76.307
  236   1HH1  ARG  29          1HH1      ARG  29 -41.208  18.589 -77.814
  237   2HH1  ARG  29          2HH1      ARG  29 -39.849  18.848 -78.867
  238   1HH2  ARG  29          1HH2      ARG  29 -38.072  16.045 -77.689
  239   2HH2  ARG  29          2HH2      ARG  29 -38.063  17.371 -78.820
  240    H    ARG  30           H        ARG  30 -44.238  19.143 -71.753
  241    HA   ARG  30           HA       ARG  30 -44.287  19.403 -69.503
  242   1HB   ARG  30          2HB       ARG  30 -46.093  17.532 -69.968
  243   2HB   ARG  30          1HB       ARG  30 -44.954  16.521 -69.091
  244   1HG   ARG  30          2HG       ARG  30 -45.101  18.657 -67.442
  245   2HG   ARG  30          1HG       ARG  30 -46.728  18.650 -68.126
  246   1HD   ARG  30          2HD       ARG  30 -45.484  16.135 -67.076
  247   2HD   ARG  30          1HD       ARG  30 -46.271  17.278 -65.988
  248    HE   ARG  30           HE       ARG  30 -48.294  16.973 -67.422
  249   1HH1  ARG  30          1HH1      ARG  30 -45.824  14.486 -67.258
  250   2HH1  ARG  30          2HH1      ARG  30 -46.918  13.202 -67.691
  251   1HH2  ARG  30          1HH2      ARG  30 -49.729  15.275 -67.957
  252   2HH2  ARG  30          2HH2      ARG  30 -49.135  13.645 -68.061
  253    H    ASN  31           H        ASN  31 -41.811  18.907 -70.588
  254    HA   ASN  31           HA       ASN  31 -40.429  16.898 -69.069
  255   1HB   ASN  31          2HB       ASN  31 -39.657  17.474 -71.316
  256   2HB   ASN  31          1HB       ASN  31 -39.368  19.135 -70.810
  257   1HD2  ASN  31          1HD2      ASN  31 -38.501  15.819 -69.887
  258   2HD2  ASN  31          2HD2      ASN  31 -36.848  16.184 -69.499
  259    H    ARG  32           H        ARG  32 -40.355  17.216 -66.952
  260    HA   ARG  32           HA       ARG  32 -39.229  19.753 -65.979
  261   1HB   ARG  32          2HB       ARG  32 -40.720  19.292 -63.896
  262   2HB   ARG  32          1HB       ARG  32 -41.442  20.036 -65.315
  263   1HG   ARG  32          2HG       ARG  32 -42.079  17.629 -65.981
  264   2HG   ARG  32          1HG       ARG  32 -41.746  17.241 -64.294
  265   1HD   ARG  32          2HD       ARG  32 -44.158  18.004 -65.188
  266   2HD   ARG  32          1HD       ARG  32 -43.593  18.306 -63.548
  267    HE   ARG  32           HE       ARG  32 -43.378  20.311 -65.708
  268   1HH1  ARG  32          1HH1      ARG  32 -44.225  19.403 -62.423
  269   2HH1  ARG  32          2HH1      ARG  32 -44.551  21.041 -61.925
  270   1HH2  ARG  32          1HH2      ARG  32 -43.802  22.458 -65.048
  271   2HH2  ARG  32          2HH2      ARG  32 -44.339  22.765 -63.423
  272    HA   PRO  33           HA       PRO  33 -36.278  17.187 -63.932
  273   1HB   PRO  33          2HB       PRO  33 -36.313  19.154 -61.727
  274   2HB   PRO  33          1HB       PRO  33 -34.975  18.656 -62.767
  275   1HG   PRO  33          2HG       PRO  33 -36.128  21.060 -63.027
  276   2HG   PRO  33          1HG       PRO  33 -35.538  20.154 -64.433
  277   1HD   PRO  33          2HD       PRO  33 -38.337  20.496 -63.433
  278   2HD   PRO  33          1HD       PRO  33 -37.729  20.480 -65.103
  279    H    ALA  34           H        ALA  34 -38.754  18.650 -61.837
  280    HA   ALA  34           HA       ALA  34 -39.924  17.879 -60.053
  281   1HB   ALA  34          1HB       ALA  34 -40.153  15.173 -60.259
  282   2HB   ALA  34          2HB       ALA  34 -39.787  15.625 -61.924
  283   3HB   ALA  34          3HB       ALA  34 -41.175  16.338 -61.102
  284    H    ILE  35           H        ILE  35 -37.442  18.417 -59.387
  285    HA   ILE  35           HA       ILE  35 -36.044  18.206 -57.600
  286    HB   ILE  35           HB       ILE  35 -37.659  15.714 -57.121
  287   1HG1  ILE  35          2HG1      ILE  35 -37.586  17.180 -54.810
  288   2HG1  ILE  35          1HG1      ILE  35 -37.468  18.442 -56.032
  289   1HG2  ILE  35          1HG2      ILE  35 -35.593  14.883 -56.456
  290   2HG2  ILE  35          2HG2      ILE  35 -36.260  15.546 -54.962
  291   3HG2  ILE  35          3HG2      ILE  35 -35.043  16.452 -55.863
  292   1HD1  ILE  35          1HD1      ILE  35 -39.672  16.464 -55.589
  293   2HD1  ILE  35          2HD1      ILE  35 -39.498  17.337 -57.111
  294   3HD1  ILE  35          3HD1      ILE  35 -39.749  18.226 -55.607
  295    H    ALA  36           H        ALA  36 -36.541  15.339 -59.555
  296    HA   ALA  36           HA       ALA  36 -35.175  14.045 -60.805
  297   1HB   ALA  36          1HB       ALA  36 -34.084  15.446 -62.128
  298   2HB   ALA  36          2HB       ALA  36 -32.737  15.375 -60.990
  299   3HB   ALA  36          3HB       ALA  36 -33.949  16.650 -60.847
  300    H    ARG  37           H        ARG  37 -32.581  15.498 -58.874
  301    HA   ARG  37           HA       ARG  37 -31.767  12.762 -58.180
  302   1HB   ARG  37          2HB       ARG  37 -30.016  15.208 -58.059
  303   2HB   ARG  37          1HB       ARG  37 -29.525  13.520 -58.120
  304   1HG   ARG  37          2HG       ARG  37 -29.856  13.356 -60.375
  305   2HG   ARG  37          1HG       ARG  37 -31.092  14.615 -60.393
  306   1HD   ARG  37          2HD       ARG  37 -28.327  15.401 -59.659
  307   2HD   ARG  37          1HD       ARG  37 -28.648  15.009 -61.347
  308    HE   ARG  37           HE       ARG  37 -30.591  16.722 -60.947
  309   1HH1  ARG  37          1HH1      ARG  37 -27.273  16.895 -59.859
  310   2HH1  ARG  37          2HH1      ARG  37 -27.243  18.634 -59.803
  311   1HH2  ARG  37          1HH2      ARG  37 -30.569  19.004 -60.872
  312   2HH2  ARG  37          2HH2      ARG  37 -29.121  19.841 -60.396
  313    H    GLY  38           H        GLY  38 -32.621  15.859 -56.853
  314   1HA   GLY  38          2HA       GLY  38 -33.131  16.455 -54.687
  315   2HA   GLY  38          1HA       GLY  38 -32.979  14.758 -54.248
  316    H    GLY  39           H        GLY  39 -30.503  16.748 -55.752
  317   1HA   GLY  39          2HA       GLY  39 -28.779  16.200 -53.432
  318   2HA   GLY  39          1HA       GLY  39 -28.224  16.626 -55.046
  319    H    ARG  40           H        ARG  40 -30.709  18.626 -54.562
  320    HA   ARG  40           HA       ARG  40 -29.070  20.896 -54.090
  321   1HB   ARG  40          2HB       ARG  40 -31.326  22.095 -53.897
  322   2HB   ARG  40          1HB       ARG  40 -30.948  21.329 -55.431
  323   1HG   ARG  40          2HG       ARG  40 -32.314  19.357 -54.646
  324   2HG   ARG  40          1HG       ARG  40 -32.844  20.373 -53.305
  325   1HD   ARG  40          2HD       ARG  40 -33.060  21.641 -55.935
  326   2HD   ARG  40          1HD       ARG  40 -34.068  20.206 -55.741
  327    HE   ARG  40           HE       ARG  40 -34.841  21.391 -53.605
  328   1HH1  ARG  40          1HH1      ARG  40 -33.896  23.041 -56.557
  329   2HH1  ARG  40          2HH1      ARG  40 -34.927  24.414 -56.269
  330   1HH2  ARG  40          1HH2      ARG  40 -36.151  23.218 -53.196
  331   2HH2  ARG  40          2HH2      ARG  40 -36.209  24.517 -54.353
  332    H    ASN  41           H        ASN  41 -28.254  21.467 -52.233
  333    HA   ASN  41           HA       ASN  41 -27.923  21.827 -50.023
  334   1HB   ASN  41          2HB       ASN  41 -30.432  22.711 -50.347
  335   2HB   ASN  41          1HB       ASN  41 -30.761  21.366 -49.260
  336   1HD2  ASN  41          1HD2      ASN  41 -30.867  21.969 -47.229
  337   2HD2  ASN  41          2HD2      ASN  41 -29.931  23.219 -46.480
  338    H    ARG  42           H        ARG  42 -26.846  19.760 -50.237
  339    HA   ARG  42           HA       ARG  42 -27.814  17.844 -48.320
  340   1HB   ARG  42          2HB       ARG  42 -29.015  16.807 -49.983
  341   2HB   ARG  42          1HB       ARG  42 -27.912  17.320 -51.250
  342   1HG   ARG  42          2HG       ARG  42 -26.596  15.496 -51.028
  343   2HG   ARG  42          1HG       ARG  42 -26.835  15.402 -49.282
  344   1HD   ARG  42          2HD       ARG  42 -29.025  14.741 -51.225
  345   2HD   ARG  42          1HD       ARG  42 -27.836  13.541 -50.718
  346    HE   ARG  42           HE       ARG  42 -28.621  14.039 -48.385
  347   1HH1  ARG  42          1HH1      ARG  42 -30.709  14.613 -51.145
  348   2HH1  ARG  42          2HH1      ARG  42 -32.172  14.328 -50.253
  349   1HH2  ARG  42          1HH2      ARG  42 -30.548  13.687 -47.210
  350   2HH2  ARG  42          2HH2      ARG  42 -32.084  13.829 -48.013
  351    HA   PRO  43           HA       PRO  43 -23.344  16.640 -49.705
  352   1HB   PRO  43          2HB       PRO  43 -22.498  18.744 -51.567
  353   2HB   PRO  43          1HB       PRO  43 -22.381  16.989 -51.729
  354   1HG   PRO  43          2HG       PRO  43 -24.100  18.435 -53.200
  355   2HG   PRO  43          1HG       PRO  43 -24.491  16.799 -52.637
  356   1HD   PRO  43          2HD       PRO  43 -25.356  19.445 -51.524
  357   2HD   PRO  43          1HD       PRO  43 -26.306  17.967 -51.784
  358    H    ALA  44           H        ALA  44 -24.491  19.741 -48.970
  359    HA   ALA  44           HA       ALA  44 -21.937  20.704 -47.953
  360   1HB   ALA  44          1HB       ALA  44 -22.795  22.756 -48.156
  361   2HB   ALA  44          2HB       ALA  44 -24.277  22.309 -47.310
  362   3HB   ALA  44          3HB       ALA  44 -24.117  21.988 -49.035
  363    HA   PRO  45           HA       PRO  45 -22.774  18.620 -43.989
  364   1HB   PRO  45          2HB       PRO  45 -20.401  20.398 -43.535
  365   2HB   PRO  45          1HB       PRO  45 -20.679  18.740 -42.971
  366   1HG   PRO  45          2HG       PRO  45 -19.105  19.135 -45.030
  367   2HG   PRO  45          1HG       PRO  45 -20.321  17.843 -45.113
  368   1HD   PRO  45          2HD       PRO  45 -20.352  20.560 -46.365
  369   2HD   PRO  45          1HD       PRO  45 -20.900  19.007 -47.029
  370    H    TYR  46           H        TYR  46 -21.277  21.780 -43.476
  371    HA   TYR  46           HA       TYR  46 -23.521  22.512 -41.737
  372   1HB   TYR  46          2HB       TYR  46 -20.789  22.664 -41.356
  373   2HB   TYR  46          1HB       TYR  46 -21.211  24.314 -41.796
  374    HD1  TYR  46           1HD      TYR  46 -20.910  22.050 -39.139
  375    HD2  TYR  46           2HD      TYR  46 -23.308  25.289 -40.504
  376    HE1  TYR  46           1HE      TYR  46 -21.647  22.469 -36.832
  377    HE2  TYR  46           2HE      TYR  46 -24.052  25.716 -38.201
  378    HH   TYR  46           HH       TYR  46 -23.122  25.286 -35.859
  379    H    SER  47           H        SER  47 -21.373  23.976 -44.145
  380    HA   SER  47           HA       SER  47 -23.660  25.504 -45.167
  381   1HB   SER  47          2HB       SER  47 -21.059  26.911 -45.213
  382   2HB   SER  47          1HB       SER  47 -22.678  27.540 -44.902
  383    HG   SER  47           HG       SER  47 -20.755  26.758 -43.145
  384    H    ARG  48           H        ARG  48 -20.476  24.116 -45.680
  385    HA   ARG  48           HA       ARG  48 -21.029  23.971 -48.548
  386   1HB   ARG  48          2HB       ARG  48 -19.111  25.727 -47.348
  387   2HB   ARG  48          1HB       ARG  48 -18.258  24.500 -48.275
  388   1HG   ARG  48          2HG       ARG  48 -20.307  25.263 -49.953
  389   2HG   ARG  48          1HG       ARG  48 -19.813  26.770 -49.181
  390   1HD   ARG  48          2HD       ARG  48 -17.409  25.602 -49.760
  391   2HD   ARG  48          1HD       ARG  48 -18.405  25.097 -51.125
  392    HE   ARG  48           HE       ARG  48 -17.576  27.807 -50.451
  393   1HH1  ARG  48          1HH1      ARG  48 -19.577  25.715 -52.440
  394   2HH1  ARG  48          2HH1      ARG  48 -19.881  26.938 -53.636
  395   1HH2  ARG  48          1HH2      ARG  48 -17.979  29.418 -52.030
  396   2HH2  ARG  48          2HH2      ARG  48 -18.967  29.038 -53.413
  397    HA   PRO  49           HA       PRO  49 -19.667  19.729 -48.402
  398   1HB   PRO  49          2HB       PRO  49 -18.120  20.673 -50.787
  399   2HB   PRO  49          1HB       PRO  49 -19.076  19.200 -50.582
  400   1HG   PRO  49          2HG       PRO  49 -20.050  21.306 -51.908
  401   2HG   PRO  49          1HG       PRO  49 -21.085  20.299 -50.880
  402   1HD   PRO  49          2HD       PRO  49 -20.098  23.048 -50.432
  403   2HD   PRO  49          1HD       PRO  49 -21.524  22.235 -49.762
  404    H    LYS  50           H        LYS  50 -17.925  18.576 -47.723
  405    HA   LYS  50           HA       LYS  50 -15.547  20.178 -47.048
  406   1HB   LYS  50          2HB       LYS  50 -17.043  18.067 -45.538
  407   2HB   LYS  50          1HB       LYS  50 -15.332  18.324 -45.221
  408   1HG   LYS  50          2HG       LYS  50 -16.534  20.863 -45.200
  409   2HG   LYS  50          1HG       LYS  50 -17.586  19.793 -44.272
  410   1HD   LYS  50          2HD       LYS  50 -16.183  20.210 -42.574
  411   2HD   LYS  50          1HD       LYS  50 -15.114  19.061 -43.380
  412   1HE   LYS  50          2HE       LYS  50 -13.808  20.986 -42.931
  413   2HE   LYS  50          1HE       LYS  50 -14.167  21.021 -44.657
  414   1HZ   LYS  50          1HZ       LYS  50 -15.981  22.425 -42.837
  415   2HZ   LYS  50          2HZ       LYS  50 -15.547  22.798 -44.433
  416   3HZ   LYS  50          3HZ       LYS  50 -14.476  23.132 -43.162
  417    HA   PRO  51           HA       PRO  51 -13.554  17.047 -49.660
  418   1HB   PRO  51          2HB       PRO  51 -11.325  18.935 -49.594
  419   2HB   PRO  51          1HB       PRO  51 -12.256  18.366 -50.981
  420   1HG   PRO  51          2HG       PRO  51 -12.417  20.907 -50.064
  421   2HG   PRO  51          1HG       PRO  51 -13.784  20.076 -50.826
  422   1HD   PRO  51          2HD       PRO  51 -13.227  20.537 -47.917
  423   2HD   PRO  51          1HD       PRO  51 -14.762  20.662 -48.804
  424    H    LEU  52           H        LEU  52 -12.698  18.647 -46.750
  425    HA   LEU  52           HA       LEU  52 -11.148  16.333 -45.881
  426   1HB   LEU  52          2HB       LEU  52  -9.725  18.151 -44.626
  427   2HB   LEU  52          1HB       LEU  52  -9.351  17.693 -46.277
  428    HG   LEU  52           HG       LEU  52 -11.212  19.812 -46.421
  429   1HD1  LEU  52          1HD1      LEU  52  -8.911  20.379 -44.554
  430   2HD1  LEU  52          2HD1      LEU  52 -10.626  20.405 -44.142
  431   3HD1  LEU  52          3HD1      LEU  52  -9.972  21.594 -45.269
  432   1HD2  LEU  52          1HD2      LEU  52  -9.505  20.870 -47.689
  433   2HD2  LEU  52          2HD2      LEU  52  -9.374  19.140 -48.000
  434   3HD2  LEU  52          3HD2      LEU  52  -8.241  19.926 -46.900
  435    HA   PRO  53           HA       PRO  53 -14.464  17.898 -42.958
  436   1HB   PRO  53          2HB       PRO  53 -15.828  15.576 -42.714
  437   2HB   PRO  53          1HB       PRO  53 -16.128  16.723 -44.025
  438   1HG   PRO  53          2HG       PRO  53 -14.532  14.196 -44.044
  439   2HG   PRO  53          1HG       PRO  53 -15.649  14.825 -45.268
  440   1HD   PRO  53          2HD       PRO  53 -12.940  15.045 -45.465
  441   2HD   PRO  53          1HD       PRO  53 -14.061  16.218 -46.181
  442    H    ASP  54           H        ASP  54 -12.246  15.270 -42.993
  443    HA   ASP  54           HA       ASP  54 -11.229  14.007 -41.406
  444   1HB   ASP  54          2HB       ASP  54 -11.272  16.739 -40.474
  445   2HB   ASP  54          1HB       ASP  54 -11.294  15.622 -39.111
  446    H    LYS  55           H        LYS  55 -13.604  13.051 -41.667
  447    HA   LYS  55           HA       LYS  55 -14.709  12.784 -38.951
  448   1HB   LYS  55          2HB       LYS  55 -16.053  13.674 -41.147
  449   2HB   LYS  55          1HB       LYS  55 -16.394  11.950 -41.225
  450   1HG   LYS  55          2HG       LYS  55 -18.152  12.684 -39.963
  451   2HG   LYS  55          1HG       LYS  55 -16.995  12.260 -38.699
  452   1HD   LYS  55          2HD       LYS  55 -16.331  14.858 -39.252
  453   2HD   LYS  55          1HD       LYS  55 -18.084  14.867 -39.459
  454   1HE   LYS  55          2HE       LYS  55 -16.755  13.668 -37.043
  455   2HE   LYS  55          1HE       LYS  55 -17.180  15.378 -37.129
  456   1HZ   LYS  55          1HZ       LYS  55 -18.917  13.035 -36.922
  457   2HZ   LYS  55          2HZ       LYS  55 -19.491  14.348 -37.826
  458   3HZ   LYS  55          3HZ       LYS  55 -19.066  14.562 -36.199
  459    H    TRP  56           H        TRP  56 -12.692  11.266 -39.126
  460    HA   TRP  56           HA       TRP  56 -13.660   8.616 -39.974
  461   1HB   TRP  56          2HB       TRP  56 -11.069   9.947 -40.229
  462   2HB   TRP  56          1HB       TRP  56 -10.951   8.336 -39.524
  463    HD1  TRP  56           HD       TRP  56 -11.994  10.123 -42.738
  464    HE1  TRP  56           1HE      TRP  56 -12.096   8.391 -44.644
  465    HE3  TRP  56           3HE      TRP  56 -11.283   5.878 -39.995
  466    HZ2  TRP  56           2HZ      TRP  56 -11.896   5.584 -44.933
  467    HZ3  TRP  56           3HZ      TRP  56 -11.251   3.709 -41.156
  468    HH2  TRP  56           HH       TRP  56 -11.553   3.567 -43.575
  469    H    GLN  57           H        GLN  57 -11.907  10.387 -37.466
  470    HA   GLN  57           HA       GLN  57 -12.770   8.414 -35.500
  471   1HB   GLN  57          2HB       GLN  57 -10.073   8.628 -36.542
  472   2HB   GLN  57          1HB       GLN  57 -10.114   8.908 -34.807
  473   1HG   GLN  57          2HG       GLN  57 -11.748   6.688 -35.246
  474   2HG   GLN  57          1HG       GLN  57 -10.330   6.451 -36.267
  475   1HE2  GLN  57          1HE2      GLN  57  -9.942   4.654 -34.825
  476   2HE2  GLN  57          2HE2      GLN  57  -9.097   4.940 -33.333
  477    H    HIS  58           H        HIS  58 -11.580   9.207 -33.291
  478    HA   HIS  58           HA       HIS  58 -11.462  12.082 -33.087
  479   1HB   HIS  58          2HB       HIS  58 -13.948  10.983 -32.770
  480   2HB   HIS  58          1HB       HIS  58 -13.351  10.992 -31.114
  481    HD1  HIS  58           1HD      HIS  58 -11.837  13.800 -32.747
  482    HD2  HIS  58           2HD      HIS  58 -15.591  13.002 -31.129
  483    HE1  HIS  58           1HE      HIS  58 -12.895  16.045 -32.337
  484    HE2  HIS  58           2HE      HIS  58 -15.097  15.541 -31.218
  485    H    ASP  59           H        ASP  59  -9.412  10.517 -32.741
  486    HA   ASP  59           HA       ASP  59  -7.744   9.860 -31.340
  487   1HB   ASP  59          2HB       ASP  59  -9.103  11.753 -29.412
  488   2HB   ASP  59          1HB       ASP  59  -7.450  11.162 -29.286
  489    H    LEU  60           H        LEU  60  -9.483   7.926 -31.449
  490    HA   LEU  60           HA       LEU  60 -10.876   7.241 -29.089
  491   1HB   LEU  60          2HB       LEU  60 -10.168   5.992 -31.639
  492   2HB   LEU  60          1HB       LEU  60 -10.395   4.858 -30.322
  493    HG   LEU  60           HG       LEU  60 -12.658   5.704 -29.949
  494   1HD1  LEU  60          1HD1      LEU  60 -13.622   7.456 -31.091
  495   2HD1  LEU  60          2HD1      LEU  60 -12.488   7.342 -32.437
  496   3HD1  LEU  60          3HD1      LEU  60 -11.964   8.030 -30.900
  497   1HD2  LEU  60          1HD2      LEU  60 -13.649   4.979 -32.125
  498   2HD2  LEU  60          2HD2      LEU  60 -12.465   3.860 -31.451
  499   3HD2  LEU  60          3HD2      LEU  60 -12.015   4.922 -32.786
  500    H    PHE  61           H        PHE  61  -7.874   5.934 -30.454
  501    HA   PHE  61           HA       PHE  61  -7.228   4.388 -28.159
  502   1HB   PHE  61          2HB       PHE  61  -6.378   4.381 -30.726
  503   2HB   PHE  61          1HB       PHE  61  -5.022   5.196 -29.953
  504    HD1  PHE  61           1HD      PHE  61  -3.273   3.761 -29.631
  505    HD2  PHE  61           2HD      PHE  61  -7.232   2.352 -28.974
  506    HE1  PHE  61           1HE      PHE  61  -2.378   1.587 -28.912
  507    HE2  PHE  61           2HE      PHE  61  -6.344   0.178 -28.252
  508    HZ   PHE  61           HZ       PHE  61  -3.912  -0.208 -28.218
  509    H    ASP  62           H        ASP  62  -7.221   7.652 -28.492
  510    HA   ASP  62           HA       ASP  62  -6.352   9.388 -27.321
  511   1HB   ASP  62          2HB       ASP  62  -6.867   7.772 -25.405
  512   2HB   ASP  62          1HB       ASP  62  -5.160   7.365 -25.418
  513    H    SER  63           H        SER  63  -3.750   7.622 -25.993
  514    HA   SER  63           HA       SER  63  -1.924   8.302 -28.168
  515   1HB   SER  63          2HB       SER  63  -0.315   9.188 -26.347
  516   2HB   SER  63          1HB       SER  63  -1.639  10.244 -26.846
  517    HG   SER  63           HG       SER  63  -2.798   9.592 -25.001
  518    H    GLY  64           H        GLY  64  -1.070   7.516 -24.868
  519   1HA   GLY  64          2HA       GLY  64  -0.376   4.772 -25.730
  520   2HA   GLY  64          1HA       GLY  64   0.577   5.696 -24.573
  521    H    CYS  65           H        CYS  65  -2.569   4.204 -25.107
  522    HA   CYS  65           HA       CYS  65  -3.431   4.576 -22.397
  523   1HB   CYS  65          2HB       CYS  65  -5.161   2.752 -23.362
  524   2HB   CYS  65          1HB       CYS  65  -5.291   4.475 -23.705
  525    HG   CYS  65           HG       CYS  65  -4.905   4.355 -26.261
  526    H    GLY  66           H        GLY  66  -4.088   2.739 -21.012
  527   1HA   GLY  66          2HA       GLY  66  -3.806   0.310 -20.617
  528   2HA   GLY  66          1HA       GLY  66  -2.188   0.484 -21.286
  529    H    GLY  67           H        GLY  67  -3.298   3.068 -19.340
  530   1HA   GLY  67          2HA       GLY  67  -1.629   2.070 -17.115
  531   2HA   GLY  67          1HA       GLY  67  -1.588   3.741 -17.659
  532    H    GLY  68           H        GLY  68  -4.511   1.823 -17.405
  533   1HA   GLY  68          2HA       GLY  68  -5.651   3.817 -15.632
  534   2HA   GLY  68          1HA       GLY  68  -6.492   2.449 -16.351
  535    H    GLU  69           H        GLU  69  -7.395   2.399 -14.123
  536    HA   GLU  69           HA       GLU  69  -7.636   1.416 -12.096
  537   1HB   GLU  69          2HB       GLU  69  -5.928  -0.383 -13.609
  538   2HB   GLU  69          1HB       GLU  69  -5.600  -0.478 -11.884
  539   1HG   GLU  69          2HG       GLU  69  -8.250  -0.891 -13.243
  540   2HG   GLU  69          1HG       GLU  69  -7.239  -2.122 -12.493
  541    H    GLY  70           H        GLY  70  -5.950   0.445 -10.199
  542   1HA   GLY  70          2HA       GLY  70  -4.583   2.843  -9.336
  543   2HA   GLY  70          1HA       GLY  70  -4.761   1.352  -8.422
  544    H    VAL  71           H        VAL  71  -3.361   1.818 -11.638
  545    HA   VAL  71           HA       VAL  71  -0.874   0.676 -10.634
  546    HB   VAL  71           HB       VAL  71  -1.367   1.009 -13.557
  547   1HG1  VAL  71          1HG1      VAL  71   0.445  -0.260 -13.722
  548   2HG1  VAL  71          2HG1      VAL  71  -0.266  -1.500 -12.688
  549   3HG1  VAL  71          3HG1      VAL  71   0.617  -0.152 -11.971
  550   1HG2  VAL  71          1HG2      VAL  71  -3.440   0.024 -12.762
  551   2HG2  VAL  71          2HG2      VAL  71  -2.536  -1.204 -11.873
  552   3HG2  VAL  71          3HG2      VAL  71  -2.488  -1.177 -13.637
  553    H    GLU  72           H        GLU  72  -1.723   2.922 -13.209
  554    HA   GLU  72           HA       GLU  72   0.538   4.606 -12.417
  555   1HB   GLU  72          2HB       GLU  72  -1.192   4.750 -14.897
  556   2HB   GLU  72          1HB       GLU  72   0.201   5.768 -14.565
  557   1HG   GLU  72          2HG       GLU  72   0.088   2.903 -15.360
  558   2HG   GLU  72          1HG       GLU  72   1.104   4.205 -15.974
  559    H    THR  73           H        THR  73  -2.929   4.576 -12.829
  560    HA   THR  73           HA       THR  73  -3.319   7.256 -11.911
  561    HB   THR  73           HB       THR  73  -5.409   5.097 -11.850
  562    HG1  THR  73           1HG      THR  73  -5.573   6.281 -14.181
  563   1HG2  THR  73          1HG2      THR  73  -6.762   6.813 -11.455
  564   2HG2  THR  73          2HG2      THR  73  -6.260   7.570 -12.967
  565   3HG2  THR  73          3HG2      THR  73  -5.378   7.908 -11.477
  566    H    GLY  74           H        GLY  74  -2.948   7.829  -9.869
  567   1HA   GLY  74          2HA       GLY  74  -4.093   7.491  -7.621
  568   2HA   GLY  74          1HA       GLY  74  -3.450   5.857  -7.737
  569    H    ALA  75           H        ALA  75  -2.362   6.360  -5.710
  570    HA   ALA  75           HA       ALA  75  -0.070   8.175  -6.062
  571   1HB   ALA  75          1HB       ALA  75  -1.347   7.119  -3.543
  572   2HB   ALA  75          2HB       ALA  75  -1.442   8.765  -4.173
  573   3HB   ALA  75          3HB       ALA  75   0.099   8.130  -3.593
  574    H    LYS  76           H        LYS  76   1.639   7.106  -6.800
  575    HA   LYS  76           HA       LYS  76   1.981   4.301  -6.028
  576   1HB   LYS  76          2HB       LYS  76   2.129   4.236  -8.289
  577   2HB   LYS  76          1HB       LYS  76   2.598   5.923  -8.410
  578   1HG   LYS  76          2HG       LYS  76   4.784   5.438  -8.490
  579   2HG   LYS  76          1HG       LYS  76   4.654   4.175  -7.267
  580   1HD   LYS  76          2HD       LYS  76   5.323   3.227  -9.401
  581   2HD   LYS  76          1HD       LYS  76   3.715   2.657  -8.950
  582   1HE   LYS  76          2HE       LYS  76   2.768   4.465 -10.407
  583   2HE   LYS  76          1HE       LYS  76   4.409   4.788 -10.965
  584   1HZ   LYS  76          1HZ       LYS  76   3.159   2.109 -11.155
  585   2HZ   LYS  76          2HZ       LYS  76   4.556   2.670 -11.937
  586   3HZ   LYS  76          3HZ       LYS  76   3.033   3.266 -12.394
  587    H    LEU  77           H        LEU  77   3.497   3.672  -4.703
  588    HA   LEU  77           HA       LEU  77   5.880   5.363  -4.312
  589   1HB   LEU  77          2HB       LEU  77   4.399   5.380  -2.354
  590   2HB   LEU  77          1HB       LEU  77   4.415   3.632  -2.310
  591    HG   LEU  77           HG       LEU  77   5.862   4.982  -0.636
  592   1HD1  LEU  77          1HD1      LEU  77   7.716   3.196  -0.923
  593   2HD1  LEU  77          2HD1      LEU  77   6.619   2.534  -2.135
  594   3HD1  LEU  77          3HD1      LEU  77   6.078   2.723  -0.466
  595   1HD2  LEU  77          1HD2      LEU  77   6.946   6.339  -2.448
  596   2HD2  LEU  77          2HD2      LEU  77   7.806   4.876  -2.928
  597   3HD2  LEU  77          3HD2      LEU  77   8.058   5.560  -1.323
  598    H    LEU  78           H        LEU  78   7.712   4.393  -4.881
  599    HA   LEU  78           HA       LEU  78   7.801   1.444  -4.883
  600   1HB   LEU  78          2HB       LEU  78   9.548   3.302  -6.494
  601   2HB   LEU  78          1HB       LEU  78   9.446   1.557  -6.633
  602    HG   LEU  78           HG       LEU  78   6.931   3.046  -7.097
  603   1HD1  LEU  78          1HD1      LEU  78   8.851   2.930  -9.368
  604   2HD1  LEU  78          2HD1      LEU  78   8.972   4.261  -8.218
  605   3HD1  LEU  78          3HD1      LEU  78   7.471   3.997  -9.106
  606   1HD2  LEU  78          1HD2      LEU  78   8.084   0.992  -8.911
  607   2HD2  LEU  78          2HD2      LEU  78   6.411   1.261  -8.422
  608   3HD2  LEU  78          3HD2      LEU  78   7.542   0.489  -7.309
  609    H    VAL  79           H        VAL  79   8.940   0.651  -3.235
  610    HA   VAL  79           HA       VAL  79  11.076   2.309  -2.055
  611    HB   VAL  79           HB       VAL  79  10.661   0.109  -0.374
  612   1HG1  VAL  79          1HG1      VAL  79   9.365   2.738   0.160
  613   2HG1  VAL  79          2HG1      VAL  79  11.119   2.637   0.016
  614   3HG1  VAL  79          3HG1      VAL  79  10.280   1.690   1.245
  615   1HG2  VAL  79          1HG2      VAL  79   8.200   0.461   0.161
  616   2HG2  VAL  79          2HG2      VAL  79   8.587  -0.500  -1.267
  617   3HG2  VAL  79          3HG2      VAL  79   8.074   1.177  -1.446
  618    H    SER  80           H        SER  80  13.088   1.754  -2.562
  619    HA   SER  80           HA       SER  80  13.693  -1.120  -2.843
  620   1HB   SER  80          2HB       SER  80  15.747   0.500  -4.020
  621   2HB   SER  80          1HB       SER  80  14.699  -0.683  -4.802
  622    HG   SER  80           HG       SER  80  14.656   1.984  -5.017
  623    H    ASN  81           H        ASN  81  15.012  -1.914  -1.305
  624    HA   ASN  81           HA       ASN  81  17.156  -0.452  -0.170
  625   1HB   ASN  81          2HB       ASN  81  15.191   0.686   0.927
  626   2HB   ASN  81          1HB       ASN  81  14.824  -0.849   1.712
  627   1HD2  ASN  81          1HD2      ASN  81  17.690   1.190   1.147
  628   2HD2  ASN  81          2HD2      ASN  81  18.263   1.102   2.775
  629    H    LEU  82           H        LEU  82  14.756  -2.878   0.825
  630    HA   LEU  82           HA       LEU  82  14.922  -5.062   1.407
  631   1HB   LEU  82          2HB       LEU  82  16.665  -5.016  -0.540
  632   2HB   LEU  82          1HB       LEU  82  17.844  -5.127   0.749
  633    HG   LEU  82           HG       LEU  82  16.923  -7.275  -0.489
  634   1HD1  LEU  82          1HD1      LEU  82  17.730  -8.565   1.280
  635   2HD1  LEU  82          2HD1      LEU  82  17.208  -7.395   2.493
  636   3HD1  LEU  82          3HD1      LEU  82  18.575  -7.025   1.441
  637   1HD2  LEU  82          1HD2      LEU  82  14.947  -6.913   1.762
  638   2HD2  LEU  82          2HD2      LEU  82  15.139  -8.360   0.772
  639   3HD2  LEU  82          3HD2      LEU  82  14.573  -6.859   0.039
  640    H    ASP  83           H        ASP  83  18.002  -3.478   2.261
  641    HA   ASP  83           HA       ASP  83  19.161  -3.315   4.199
  642   1HB   ASP  83          2HB       ASP  83  17.100  -2.162   4.957
  643   2HB   ASP  83          1HB       ASP  83  16.459  -3.702   5.517
  644    H    PHE  84           H        PHE  84  17.348  -5.137   6.363
  645    HA   PHE  84           HA       PHE  84  19.219  -7.339   6.201
  646   1HB   PHE  84          2HB       PHE  84  18.480  -7.954   8.327
  647   2HB   PHE  84          1HB       PHE  84  18.282  -6.207   8.349
  648    HD1  PHE  84           1HD      PHE  84  15.903  -5.375   7.551
  649    HD2  PHE  84           2HD      PHE  84  16.739  -9.258   9.076
  650    HE1  PHE  84           1HE      PHE  84  13.536  -5.642   8.160
  651    HE2  PHE  84           2HE      PHE  84  14.375  -9.532   9.687
  652    HZ   PHE  84           HZ       PHE  84  12.765  -7.750   9.205
  653    H    GLY  85           H        GLY  85  16.229  -6.564   4.896
  654   1HA   GLY  85          2HA       GLY  85  15.408  -8.196   3.214
  655   2HA   GLY  85          1HA       GLY  85  15.568  -9.411   4.477
  656    H    VAL  86           H        VAL  86  14.072  -6.188   4.126
  657    HA   VAL  86           HA       VAL  86  11.940  -6.789   5.907
  658    HB   VAL  86           HB       VAL  86  10.829  -4.776   4.660
  659   1HG1  VAL  86          1HG1      VAL  86  12.642  -3.265   5.876
  660   2HG1  VAL  86          2HG1      VAL  86  13.115  -4.829   6.543
  661   3HG1  VAL  86          3HG1      VAL  86  11.470  -4.234   6.768
  662   1HG2  VAL  86          1HG2      VAL  86  12.211  -3.377   3.382
  663   2HG2  VAL  86          2HG2      VAL  86  12.515  -4.996   2.751
  664   3HG2  VAL  86          3HG2      VAL  86  13.673  -4.247   3.850
  665    H    SER  87           H        SER  87  10.482  -8.283   5.531
  666    HA   SER  87           HA       SER  87   9.891  -9.337   3.004
  667   1HB   SER  87          2HB       SER  87   7.809  -9.868   4.905
  668   2HB   SER  87          1HB       SER  87   9.063 -10.955   4.309
  669    HG   SER  87           HG       SER  87  10.350 -10.437   5.985
  670    H    ASP  88           H        ASP  88   7.564  -9.601   2.321
  671    HA   ASP  88           HA       ASP  88   6.557  -7.157   1.393
  672   1HB   ASP  88          2HB       ASP  88   4.776  -8.374   0.421
  673   2HB   ASP  88          1HB       ASP  88   6.148  -9.475   0.418
  674    H    ALA  89           H        ALA  89   5.676  -9.101   4.178
  675    HA   ALA  89           HA       ALA  89   3.459  -7.474   4.936
  676   1HB   ALA  89          1HB       ALA  89   4.155  -9.958   5.576
  677   2HB   ALA  89          2HB       ALA  89   3.128  -8.968   6.613
  678   3HB   ALA  89          3HB       ALA  89   4.848  -9.124   6.967
  679    H    ASP  90           H        ASP  90   6.907  -7.461   5.692
  680    HA   ASP  90           HA       ASP  90   6.761  -5.853   8.006
  681   1HB   ASP  90          2HB       ASP  90   8.746  -7.241   6.791
  682   2HB   ASP  90          1HB       ASP  90   9.171  -5.603   6.310
  683    H    ILE  91           H        ILE  91   8.006  -4.917   4.807
  684    HA   ILE  91           HA       ILE  91   7.978  -2.201   5.117
  685    HB   ILE  91           HB       ILE  91   8.910  -3.442   3.163
  686   1HG1  ILE  91          2HG1      ILE  91   8.112  -1.622   1.464
  687   2HG1  ILE  91          1HG1      ILE  91   7.269  -0.954   2.858
  688   1HG2  ILE  91          1HG2      ILE  91   6.032  -3.760   2.557
  689   2HG2  ILE  91          2HG2      ILE  91   7.384  -4.848   2.251
  690   3HG2  ILE  91          3HG2      ILE  91   7.119  -3.456   1.202
  691   1HD1  ILE  91          1HD1      ILE  91   9.244  -0.470   3.973
  692   2HD1  ILE  91          2HD1      ILE  91   9.607  -0.074   2.294
  693   3HD1  ILE  91          3HD1      ILE  91  10.187  -1.587   2.988
  694    H    GLN  92           H        GLN  92   5.227  -4.262   4.386
  695    HA   GLN  92           HA       GLN  92   3.416  -2.191   3.716
  696   1HB   GLN  92          2HB       GLN  92   3.061  -4.619   3.220
  697   2HB   GLN  92          1HB       GLN  92   2.770  -4.883   4.934
  698   1HG   GLN  92          2HG       GLN  92   1.127  -2.756   3.816
  699   2HG   GLN  92          1HG       GLN  92   0.869  -4.319   3.040
  700   1HE2  GLN  92          1HE2      GLN  92   0.627  -2.500   5.978
  701   2HE2  GLN  92          2HE2      GLN  92  -0.350  -3.633   6.851
  702    H    GLU  93           H        GLU  93   4.034  -3.944   6.742
  703    HA   GLU  93           HA       GLU  93   2.190  -2.609   8.346
  704   1HB   GLU  93          2HB       GLU  93   4.601  -4.233   8.792
  705   2HB   GLU  93          1HB       GLU  93   4.213  -3.124  10.101
  706   1HG   GLU  93          2HG       GLU  93   2.140  -4.940   8.938
  707   2HG   GLU  93          1HG       GLU  93   3.255  -5.493  10.186
  708    H    LEU  94           H        LEU  94   5.537  -1.748   7.569
  709    HA   LEU  94           HA       LEU  94   5.715   0.480   9.288
  710   1HB   LEU  94          2HB       LEU  94   7.119   0.194   6.636
  711   2HB   LEU  94          1HB       LEU  94   7.638   1.136   8.021
  712    HG   LEU  94           HG       LEU  94   7.374  -1.843   8.234
  713   1HD1  LEU  94          1HD1      LEU  94   9.917  -1.769   7.756
  714   2HD1  LEU  94          2HD1      LEU  94   9.540  -0.275   6.897
  715   3HD1  LEU  94          3HD1      LEU  94   8.786  -1.792   6.403
  716   1HD2  LEU  94          1HD2      LEU  94   9.143  -1.516   9.915
  717   2HD2  LEU  94          2HD2      LEU  94   7.682  -0.601  10.289
  718   3HD2  LEU  94          3HD2      LEU  94   9.089   0.220   9.611
  719    H    PHE  95           H        PHE  95   5.303   0.481   5.776
  720    HA   PHE  95           HA       PHE  95   4.485   3.096   5.537
  721   1HB   PHE  95          2HB       PHE  95   4.604   0.836   3.818
  722   2HB   PHE  95          1HB       PHE  95   3.086   1.692   3.530
  723    HD1  PHE  95           1HD      PHE  95   3.049   3.696   2.353
  724    HD2  PHE  95           2HD      PHE  95   6.750   2.166   3.776
  725    HE1  PHE  95           1HE      PHE  95   4.247   5.433   1.094
  726    HE2  PHE  95           2HE      PHE  95   7.957   3.904   2.521
  727    HZ   PHE  95           HZ       PHE  95   6.696   5.532   1.169
  728    H    ALA  96           H        ALA  96   2.418   0.389   6.496
  729    HA   ALA  96           HA       ALA  96  -0.021   1.859   6.385
  730   1HB   ALA  96          1HB       ALA  96   0.284  -0.669   6.660
  731   2HB   ALA  96          2HB       ALA  96  -0.987   0.103   7.610
  732   3HB   ALA  96          3HB       ALA  96   0.547  -0.324   8.369
  733    H    GLU  97           H        GLU  97   2.406   1.374   8.764
  734    HA   GLU  97           HA       GLU  97   1.382   2.978  10.859
  735   1HB   GLU  97          2HB       GLU  97   3.575   1.501  10.707
  736   2HB   GLU  97          1HB       GLU  97   4.315   3.039  10.288
  737   1HG   GLU  97          2HG       GLU  97   2.632   3.350  12.586
  738   2HG   GLU  97          1HG       GLU  97   3.777   2.033  12.837
  739    H    PHE  98           H        PHE  98   3.250   3.769   7.987
  740    HA   PHE  98           HA       PHE  98   3.322   6.566   8.353
  741   1HB   PHE  98          2HB       PHE  98   3.986   4.661   6.230
  742   2HB   PHE  98          1HB       PHE  98   3.463   6.233   5.634
  743    HD1  PHE  98           1HD      PHE  98   4.547   8.231   7.214
  744    HD2  PHE  98           2HD      PHE  98   6.246   4.417   6.358
  745    HE1  PHE  98           1HE      PHE  98   6.787   9.132   7.636
  746    HE2  PHE  98           2HE      PHE  98   8.491   5.321   6.795
  747    HZ   PHE  98           HZ       PHE  98   8.751   7.691   7.463
  748    H    GLY  99           H        GLY  99   0.600   4.746   7.896
  749   1HA   GLY  99          2HA       GLY  99  -1.369   6.354   7.828
  750   2HA   GLY  99          1HA       GLY  99  -0.690   6.877   6.300
  751    H    THR 100           H        THR 100  -2.610   6.440   5.258
  752    HA   THR 100           HA       THR 100  -3.963   3.935   5.476
  753    HB   THR 100           HB       THR 100  -4.930   5.251   3.208
  754    HG1  THR 100           1HG      THR 100  -3.876   7.152   3.539
  755   1HG2  THR 100          1HG2      THR 100  -6.860   5.578   4.489
  756   2HG2  THR 100          2HG2      THR 100  -5.945   5.788   5.983
  757   3HG2  THR 100          3HG2      THR 100  -6.089   4.189   5.253
  758    H    LEU 101           H        LEU 101  -3.013   2.161   4.635
  759    HA   LEU 101           HA       LEU 101  -1.590   2.414   2.092
  760   1HB   LEU 101          2HB       LEU 101  -1.291   0.763   4.462
  761   2HB   LEU 101          1HB       LEU 101  -1.242  -0.180   2.983
  762    HG   LEU 101           HG       LEU 101   0.629   1.965   3.910
  763   1HD1  LEU 101          1HD1      LEU 101   0.687  -0.892   3.421
  764   2HD1  LEU 101          2HD1      LEU 101   1.784   0.119   4.358
  765   3HD1  LEU 101          3HD1      LEU 101   2.003  -0.039   2.613
  766   1HD2  LEU 101          1HD2      LEU 101   0.524   2.854   1.840
  767   2HD2  LEU 101          2HD2      LEU 101  -0.203   1.408   1.137
  768   3HD2  LEU 101          3HD2      LEU 101   1.538   1.472   1.423
  769    H    LYS 102           H        LYS 102  -3.354   2.518   0.762
  770    HA   LYS 102           HA       LYS 102  -5.397   0.649   0.462
  771   1HB   LYS 102          2HB       LYS 102  -4.443   2.815  -1.033
  772   2HB   LYS 102          1HB       LYS 102  -4.393   1.445  -2.133
  773   1HG   LYS 102          2HG       LYS 102  -6.855   1.787  -0.539
  774   2HG   LYS 102          1HG       LYS 102  -6.547   2.971  -1.808
  775   1HD   LYS 102          2HD       LYS 102  -6.328   1.170  -3.443
  776   2HD   LYS 102          1HD       LYS 102  -6.614  -0.023  -2.174
  777   1HE   LYS 102          2HE       LYS 102  -8.529   2.034  -3.251
  778   2HE   LYS 102          1HE       LYS 102  -8.672   0.278  -3.326
  779   1HZ   LYS 102          1HZ       LYS 102  -8.646   0.452  -0.765
  780   2HZ   LYS 102          2HZ       LYS 102 -10.074   0.828  -1.602
  781   3HZ   LYS 102          3HZ       LYS 102  -9.076   2.077  -1.025
  782    H    LYS 103           H        LYS 103  -2.248   0.641  -1.246
  783    HA   LYS 103           HA       LYS 103  -2.222  -2.273  -0.935
  784   1HB   LYS 103          2HB       LYS 103  -0.893  -1.462  -3.377
  785   2HB   LYS 103          1HB       LYS 103  -2.057  -2.747  -3.114
  786   1HG   LYS 103          2HG       LYS 103  -3.524  -0.376  -3.010
  787   2HG   LYS 103          1HG       LYS 103  -2.401  -0.195  -4.361
  788   1HD   LYS 103          2HD       LYS 103  -3.829  -1.423  -5.564
  789   2HD   LYS 103          1HD       LYS 103  -3.332  -2.802  -4.582
  790   1HE   LYS 103          2HE       LYS 103  -5.509  -0.936  -3.700
  791   2HE   LYS 103          1HE       LYS 103  -5.836  -2.302  -4.767
  792   1HZ   LYS 103          1HZ       LYS 103  -4.619  -3.648  -2.949
  793   2HZ   LYS 103          2HZ       LYS 103  -6.225  -3.172  -2.687
  794   3HZ   LYS 103          3HZ       LYS 103  -4.957  -2.317  -1.953
  795    H    ALA 104           H        ALA 104  -0.223  -3.171  -0.607
  796    HA   ALA 104           HA       ALA 104   2.194  -1.837  -1.280
  797   1HB   ALA 104          1HB       ALA 104   1.190  -1.275   1.322
  798   2HB   ALA 104          2HB       ALA 104   2.706  -0.754   0.583
  799   3HB   ALA 104          3HB       ALA 104   2.634  -2.276   1.475
  800    H    ALA 105           H        ALA 105   3.430  -3.415  -1.927
  801    HA   ALA 105           HA       ALA 105   3.634  -5.877  -0.389
  802   1HB   ALA 105          1HB       ALA 105   3.024  -7.334  -2.133
  803   2HB   ALA 105          2HB       ALA 105   3.032  -6.037  -3.327
  804   3HB   ALA 105          3HB       ALA 105   1.760  -6.107  -2.108
  805    H    VAL 106           H        VAL 106   5.367  -7.294  -1.409
  806    HA   VAL 106           HA       VAL 106   7.531  -5.538  -2.334
  807    HB   VAL 106           HB       VAL 106   7.547  -8.194  -0.898
  808   1HG1  VAL 106          1HG1      VAL 106   9.884  -8.431  -1.212
  809   2HG1  VAL 106          2HG1      VAL 106  10.009  -6.854  -1.993
  810   3HG1  VAL 106          3HG1      VAL 106   9.190  -8.183  -2.814
  811   1HG2  VAL 106          1HG2      VAL 106   8.920  -5.589  -0.277
  812   2HG2  VAL 106          2HG2      VAL 106   8.822  -7.017   0.757
  813   3HG2  VAL 106          3HG2      VAL 106   7.364  -6.092   0.385
  814    H    ASP 107           H        ASP 107   8.425  -5.894  -4.330
  815    HA   ASP 107           HA       ASP 107   6.736  -7.656  -5.957
  816   1HB   ASP 107          2HB       ASP 107   6.782  -5.056  -6.253
  817   2HB   ASP 107          1HB       ASP 107   8.297  -5.369  -7.098
  818    H    TYR 108           H        TYR 108   7.775  -9.450  -6.255
  819    HA   TYR 108           HA       TYR 108  10.607  -9.658  -6.378
  820   1HB   TYR 108          2HB       TYR 108   8.655 -11.736  -7.369
  821   2HB   TYR 108          1HB       TYR 108  10.267 -11.987  -6.702
  822    HD1  TYR 108           1HD      TYR 108  10.491 -10.869  -4.224
  823    HD2  TYR 108           2HD      TYR 108   6.911 -12.349  -5.984
  824    HE1  TYR 108           1HE      TYR 108   9.522 -11.164  -1.987
  825    HE2  TYR 108           2HE      TYR 108   5.933 -12.652  -3.748
  826    HH   TYR 108           HH       TYR 108   6.279 -12.558  -1.548
  827    H    ASP 109           H        ASP 109  11.893 -10.206  -8.185
  828    HA   ASP 109           HA       ASP 109  10.834  -8.975 -10.634
  829   1HB   ASP 109          2HB       ASP 109  13.054  -8.184 -11.089
  830   2HB   ASP 109          1HB       ASP 109  12.686  -7.773  -9.412
  831    H    ARG 110           H        ARG 110  12.559  -9.650 -12.482
  832    HA   ARG 110           HA       ARG 110  11.767 -12.310 -13.070
  833   1HB   ARG 110          2HB       ARG 110  13.838 -10.829 -14.654
  834   2HB   ARG 110          1HB       ARG 110  12.621 -11.963 -15.216
  835   1HG   ARG 110          2HG       ARG 110  11.633  -9.450 -14.004
  836   2HG   ARG 110          1HG       ARG 110  12.433  -9.326 -15.567
  837   1HD   ARG 110          2HD       ARG 110  10.796 -10.490 -16.648
  838   2HD   ARG 110          1HD       ARG 110  10.382 -11.443 -15.223
  839    HE   ARG 110           HE       ARG 110   8.865  -9.829 -14.596
  840   1HH1  ARG 110          1HH1      ARG 110  10.885  -8.575 -17.183
  841   2HH1  ARG 110          2HH1      ARG 110   9.920  -7.145 -17.404
  842   1HH2  ARG 110          1HH2      ARG 110   7.613  -7.946 -14.881
  843   2HH2  ARG 110          2HH2      ARG 110   8.064  -6.782 -16.096
  844    H    SER 111           H        SER 111  14.650 -11.010 -11.608
  845    HA   SER 111           HA       SER 111  16.067 -13.529 -12.203
  846   1HB   SER 111          2HB       SER 111  17.744 -11.202 -11.585
  847   2HB   SER 111          1HB       SER 111  17.886 -12.386 -12.884
  848    HG   SER 111           HG       SER 111  16.459 -11.241 -14.109
  849    H    GLY 112           H        GLY 112  15.205 -11.242  -9.751
  850   1HA   GLY 112          2HA       GLY 112  17.132 -12.375  -7.851
  851   2HA   GLY 112          1HA       GLY 112  16.169 -10.927  -7.601
  852    H    ARG 113           H        ARG 113  13.651 -11.696  -7.964
  853    HA   ARG 113           HA       ARG 113  11.861 -12.653  -6.932
  854   1HB   ARG 113          2HB       ARG 113  13.717 -14.870  -7.300
  855   2HB   ARG 113          1HB       ARG 113  12.679 -15.096  -5.899
  856   1HG   ARG 113          2HG       ARG 113  11.190 -15.909  -7.332
  857   2HG   ARG 113          1HG       ARG 113  10.923 -14.232  -7.818
  858   1HD   ARG 113          2HD       ARG 113  13.215 -15.119  -9.190
  859   2HD   ARG 113          1HD       ARG 113  12.017 -16.406  -9.327
  860    HE   ARG 113           HE       ARG 113  11.355 -13.622 -10.027
  861   1HH1  ARG 113          1HH1      ARG 113  11.511 -17.025 -10.811
  862   2HH1  ARG 113          2HH1      ARG 113  10.735 -16.837 -12.357
  863   1HH2  ARG 113          1HH2      ARG 113  10.276 -13.369 -12.026
  864   2HH2  ARG 113          2HH2      ARG 113  10.024 -14.755 -13.048
  865    H    SER 114           H        SER 114  12.368 -10.917  -5.443
  866    HA   SER 114           HA       SER 114  12.052 -10.868  -2.914
  867   1HB   SER 114          2HB       SER 114  14.636 -12.305  -3.249
  868   2HB   SER 114          1HB       SER 114  14.608 -11.042  -2.017
  869    HG   SER 114           HG       SER 114  13.055 -13.392  -2.196
  870    H    LEU 115           H        LEU 115  15.038 -10.340  -4.635
  871    HA   LEU 115           HA       LEU 115  16.454  -8.603  -4.903
  872   1HB   LEU 115          2HB       LEU 115  15.768  -7.734  -6.785
  873   2HB   LEU 115          1HB       LEU 115  14.271  -8.590  -6.499
  874    HG   LEU 115           HG       LEU 115  14.599  -5.785  -5.499
  875   1HD1  LEU 115          1HD1      LEU 115  13.777  -6.599  -8.285
  876   2HD1  LEU 115          2HD1      LEU 115  15.290  -5.793  -7.860
  877   3HD1  LEU 115          3HD1      LEU 115  13.752  -4.962  -7.623
  878   1HD2  LEU 115          1HD2      LEU 115  12.623  -7.505  -5.098
  879   2HD2  LEU 115          2HD2      LEU 115  12.125  -6.927  -6.689
  880   3HD2  LEU 115          3HD2      LEU 115  12.319  -5.787  -5.355
  881    H    GLY 116           H        GLY 116  13.623  -7.244  -3.202
  882   1HA   GLY 116          2HA       GLY 116  13.961  -5.841  -1.279
  883   2HA   GLY 116          1HA       GLY 116  15.473  -5.298  -1.993
  884    H    THR 117           H        THR 117  12.090  -5.475  -3.054
  885    HA   THR 117           HA       THR 117  11.943  -2.601  -3.291
  886    HB   THR 117           HB       THR 117  11.454  -4.256  -5.778
  887    HG1  THR 117           1HG      THR 117  13.777  -3.264  -4.764
  888   1HG2  THR 117          1HG2      THR 117  11.702  -1.265  -5.479
  889   2HG2  THR 117          2HG2      THR 117  10.161  -2.121  -5.472
  890   3HG2  THR 117          3HG2      THR 117  11.188  -2.166  -6.905
  891    H    ALA 118           H        ALA 118   9.838  -1.855  -3.266
  892    HA   ALA 118           HA       ALA 118   7.685  -3.838  -3.251
  893   1HB   ALA 118          1HB       ALA 118   6.726  -2.727  -1.190
  894   2HB   ALA 118          2HB       ALA 118   8.292  -1.937  -0.983
  895   3HB   ALA 118          3HB       ALA 118   8.177  -3.696  -0.920
  896    H    ASP 119           H        ASP 119   5.728  -3.050  -3.908
  897    HA   ASP 119           HA       ASP 119   5.682  -0.230  -4.765
  898   1HB   ASP 119          2HB       ASP 119   5.540  -1.843  -6.646
  899   2HB   ASP 119          1HB       ASP 119   4.118  -2.567  -5.905
  900    H    VAL 120           H        VAL 120   4.534   0.944  -3.409
  901    HA   VAL 120           HA       VAL 120   2.086  -0.253  -2.306
  902    HB   VAL 120           HB       VAL 120   2.459   0.589  -0.274
  903   1HG1  VAL 120          1HG1      VAL 120   5.040   0.425  -1.535
  904   2HG1  VAL 120          2HG1      VAL 120   4.549  -0.027   0.097
  905   3HG1  VAL 120          3HG1      VAL 120   5.035   1.636  -0.249
  906   1HG2  VAL 120          1HG2      VAL 120   3.532   2.977  -0.034
  907   2HG2  VAL 120          2HG2      VAL 120   1.838   2.768  -0.482
  908   3HG2  VAL 120          3HG2      VAL 120   3.044   3.112  -1.723
  909    H    HIS 121           H        HIS 121   0.191   0.769  -2.609
  910    HA   HIS 121           HA       HIS 121   0.254   3.314  -4.089
  911   1HB   HIS 121          2HB       HIS 121  -0.962   0.713  -4.754
  912   2HB   HIS 121          1HB       HIS 121  -2.036   2.097  -4.944
  913    HD1  HIS 121           1HD      HIS 121   1.162   0.632  -6.304
  914    HD2  HIS 121           2HD      HIS 121  -1.437   3.801  -7.047
  915    HE1  HIS 121           1HE      HIS 121   1.805   1.521  -8.556
  916    HE2  HIS 121           2HE      HIS 121   0.077   3.270  -9.085
  917    H    PHE 122           H        PHE 122  -0.719   4.849  -2.837
  918    HA   PHE 122           HA       PHE 122  -2.931   3.979  -1.134
  919   1HB   PHE 122          2HB       PHE 122  -2.234   6.792  -0.902
  920   2HB   PHE 122          1HB       PHE 122  -2.331   5.555   0.340
  921    HD1  PHE 122           1HD      PHE 122  -0.415   4.762   1.361
  922    HD2  PHE 122           2HD      PHE 122  -0.084   6.910  -2.293
  923    HE1  PHE 122           1HE      PHE 122   2.023   4.856   1.636
  924    HE2  PHE 122           2HE      PHE 122   2.354   7.000  -2.029
  925    HZ   PHE 122           HZ       PHE 122   3.413   5.977  -0.059
  926    H    GLU 123           H        GLU 123  -4.856   5.313  -1.033
  927    HA   GLU 123           HA       GLU 123  -5.793   5.949  -3.683
  928   1HB   GLU 123          2HB       GLU 123  -7.821   6.696  -1.987
  929   2HB   GLU 123          1HB       GLU 123  -7.631   5.105  -2.708
  930   1HG   GLU 123          2HG       GLU 123  -6.395   4.375  -0.709
  931   2HG   GLU 123          1HG       GLU 123  -6.668   5.959   0.014
  932    H    ARG 124           H        ARG 124  -4.387   7.666  -1.108
  933    HA   ARG 124           HA       ARG 124  -5.492  10.222  -2.048
  934   1HB   ARG 124          2HB       ARG 124  -4.914   9.182   0.537
  935   2HB   ARG 124          1HB       ARG 124  -3.800  10.507   0.246
  936   1HG   ARG 124          2HG       ARG 124  -5.388  11.965   0.720
  937   2HG   ARG 124          1HG       ARG 124  -6.390  11.324  -0.584
  938   1HD   ARG 124          2HD       ARG 124  -6.290   9.741   1.910
  939   2HD   ARG 124          1HD       ARG 124  -7.126  11.292   1.996
  940    HE   ARG 124           HE       ARG 124  -8.562  10.504   0.178
  941   1HH1  ARG 124          1HH1      ARG 124  -6.758   8.126   2.021
  942   2HH1  ARG 124          2HH1      ARG 124  -7.796   6.809   1.567
  943   1HH2  ARG 124          1HH2      ARG 124  -9.925   8.753  -0.413
  944   2HH2  ARG 124          2HH2      ARG 124  -9.573   7.156   0.200
  945    H    ARG 125           H        ARG 125  -4.216  11.515  -3.283
  946    HA   ARG 125           HA       ARG 125  -1.515  10.777  -3.838
  947   1HB   ARG 125          2HB       ARG 125  -1.420  12.742  -5.242
  948   2HB   ARG 125          1HB       ARG 125  -2.955  11.930  -5.497
  949   1HG   ARG 125          2HG       ARG 125  -4.019  13.818  -5.076
  950   2HG   ARG 125          1HG       ARG 125  -3.335  13.846  -3.451
  951   1HD   ARG 125          2HD       ARG 125  -1.222  14.751  -4.819
  952   2HD   ARG 125          1HD       ARG 125  -2.509  15.305  -5.892
  953    HE   ARG 125           HE       ARG 125  -2.145  16.097  -3.081
  954   1HH1  ARG 125          1HH1      ARG 125  -3.582  16.625  -6.235
  955   2HH1  ARG 125          2HH1      ARG 125  -4.317  18.132  -5.778
  956   1HH2  ARG 125          1HH2      ARG 125  -3.112  18.059  -2.481
  957   2HH2  ARG 125          2HH2      ARG 125  -4.072  18.942  -3.636
  958    H    ALA 126           H        ALA 126  -3.075  12.844  -1.545
  959    HA   ALA 126           HA       ALA 126  -0.813  14.372  -0.769
  960   1HB   ALA 126          1HB       ALA 126  -2.744  15.290   0.050
  961   2HB   ALA 126          2HB       ALA 126  -2.175  14.420   1.475
  962   3HB   ALA 126          3HB       ALA 126  -3.443  13.724   0.466
  963    H    ASP 127           H        ASP 127  -1.977  11.186   0.042
  964    HA   ASP 127           HA       ASP 127  -0.308  10.635   2.238
  965   1HB   ASP 127          2HB       ASP 127  -1.948   9.081   0.372
  966   2HB   ASP 127          1HB       ASP 127  -0.525   8.210   0.927
  967    H    ALA 128           H        ALA 128   0.220  10.559  -1.213
  968    HA   ALA 128           HA       ALA 128   2.871   9.408  -0.988
  969   1HB   ALA 128          1HB       ALA 128   2.257  10.680  -3.526
  970   2HB   ALA 128          2HB       ALA 128   1.002   9.548  -3.024
  971   3HB   ALA 128          3HB       ALA 128   2.672   9.001  -3.175
  972    H    LEU 129           H        LEU 129   1.363  12.504  -1.621
  973    HA   LEU 129           HA       LEU 129   3.599  14.111  -2.013
  974   1HB   LEU 129          2HB       LEU 129   1.419  15.035  -2.313
  975   2HB   LEU 129          1HB       LEU 129   0.968  14.676  -0.658
  976    HG   LEU 129           HG       LEU 129   3.256  16.416  -0.676
  977   1HD1  LEU 129          1HD1      LEU 129   2.813  17.556  -2.567
  978   2HD1  LEU 129          2HD1      LEU 129   1.584  18.332  -1.568
  979   3HD1  LEU 129          3HD1      LEU 129   1.141  17.001  -2.638
  980   1HD2  LEU 129          1HD2      LEU 129   1.916  16.308   1.244
  981   2HD2  LEU 129          2HD2      LEU 129   0.428  16.537   0.325
  982   3HD2  LEU 129          3HD2      LEU 129   1.549  17.880   0.533
  983    H    LYS 130           H        LYS 130   2.056  13.108   1.010
  984    HA   LYS 130           HA       LYS 130   3.867  14.426   2.744
  985   1HB   LYS 130          2HB       LYS 130   1.965  13.844   3.883
  986   2HB   LYS 130          1HB       LYS 130   1.757  12.349   2.987
  987   1HG   LYS 130          2HG       LYS 130   4.103  12.238   4.667
  988   2HG   LYS 130          1HG       LYS 130   2.657  12.632   5.600
  989   1HD   LYS 130          2HD       LYS 130   2.879  10.311   3.683
  990   2HD   LYS 130          1HD       LYS 130   3.099  10.190   5.430
  991   1HE   LYS 130          2HE       LYS 130   0.629  11.543   4.701
  992   2HE   LYS 130          1HE       LYS 130   0.721   9.905   4.053
  993   1HZ   LYS 130          1HZ       LYS 130   0.731   8.986   6.121
  994   2HZ   LYS 130          2HZ       LYS 130  -0.196  10.367   6.445
  995   3HZ   LYS 130          3HZ       LYS 130   1.447  10.331   6.861
  996    H    ALA 131           H        ALA 131   3.748  11.196   1.359
  997    HA   ALA 131           HA       ALA 131   5.940  10.134   2.793
  998   1HB   ALA 131          1HB       ALA 131   5.838   8.260   1.365
  999   2HB   ALA 131          2HB       ALA 131   5.105   9.200   0.062
 1000   3HB   ALA 131          3HB       ALA 131   4.175   8.835   1.515
 1001    H    MET 132           H        MET 132   5.754  11.884  -0.279
 1002    HA   MET 132           HA       MET 132   8.569  11.494  -0.779
 1003   1HB   MET 132          2HB       MET 132   8.265  12.581  -2.820
 1004   2HB   MET 132          1HB       MET 132   6.749  11.734  -2.562
 1005   1HG   MET 132          2HG       MET 132   5.659  13.765  -1.907
 1006   2HG   MET 132          1HG       MET 132   7.188  14.646  -1.954
 1007   1HE   MET 132          1HE       MET 132   4.306  13.196  -3.470
 1008   2HE   MET 132          2HE       MET 132   4.892  12.546  -5.000
 1009   3HE   MET 132          3HE       MET 132   4.109  14.126  -4.955
 1010    H    LYS 133           H        LYS 133   6.668  13.679   0.992
 1011    HA   LYS 133           HA       LYS 133   8.685  15.766   1.010
 1012   1HB   LYS 133          2HB       LYS 133   5.934  15.488   1.926
 1013   2HB   LYS 133          1HB       LYS 133   6.959  16.238   3.141
 1014   1HG   LYS 133          2HG       LYS 133   5.863  17.880   1.687
 1015   2HG   LYS 133          1HG       LYS 133   7.623  17.960   1.590
 1016   1HD   LYS 133          2HD       LYS 133   7.628  17.439  -0.586
 1017   2HD   LYS 133          1HD       LYS 133   6.452  16.143  -0.366
 1018   1HE   LYS 133          2HE       LYS 133   5.005  17.454  -1.442
 1019   2HE   LYS 133          1HE       LYS 133   4.966  18.434   0.022
 1020   1HZ   LYS 133          1HZ       LYS 133   5.487  19.552  -2.220
 1021   2HZ   LYS 133          2HZ       LYS 133   7.040  18.901  -2.021
 1022   3HZ   LYS 133          3HZ       LYS 133   6.417  19.974  -0.863
 1023    H    GLN 134           H        GLN 134   7.392  13.338   3.239
 1024    HA   GLN 134           HA       GLN 134   9.397  13.998   5.229
 1025   1HB   GLN 134          2HB       GLN 134   6.906  12.439   5.149
 1026   2HB   GLN 134          1HB       GLN 134   8.157  11.764   6.184
 1027   1HG   GLN 134          2HG       GLN 134   7.427  13.148   7.753
 1028   2HG   GLN 134          1HG       GLN 134   8.172  14.447   6.823
 1029   1HE2  GLN 134          1HE2      GLN 134   6.476  14.589   4.673
 1030   2HE2  GLN 134          2HE2      GLN 134   4.911  15.114   5.194
 1031    H    TYR 135           H        TYR 135   8.453  10.976   3.556
 1032    HA   TYR 135           HA       TYR 135  10.726   9.600   4.626
 1033   1HB   TYR 135          2HB       TYR 135   8.308   8.770   3.825
 1034   2HB   TYR 135          1HB       TYR 135   9.216   8.426   2.357
 1035    HD1  TYR 135           1HD      TYR 135  11.600   8.098   4.783
 1036    HD2  TYR 135           2HD      TYR 135   8.072   6.152   3.425
 1037    HE1  TYR 135           1HE      TYR 135  12.387   5.993   5.777
 1038    HE2  TYR 135           2HE      TYR 135   8.839   4.042   4.426
 1039    HH   TYR 135           HH       TYR 135  12.065   3.659   5.639
 1040    H    LYS 136           H        LYS 136   9.830  10.708   1.368
 1041    HA   LYS 136           HA       LYS 136  11.952   9.438   0.054
 1042   1HB   LYS 136          2HB       LYS 136   9.974  10.267  -1.117
 1043   2HB   LYS 136          1HB       LYS 136  10.471  11.923  -0.787
 1044   1HG   LYS 136          2HG       LYS 136  12.656  11.240  -1.991
 1045   2HG   LYS 136          1HG       LYS 136  11.672   9.925  -2.644
 1046   1HD   LYS 136          2HD       LYS 136  10.005  11.714  -3.333
 1047   2HD   LYS 136          1HD       LYS 136  11.276  12.886  -2.975
 1048   1HE   LYS 136          2HE       LYS 136  12.258  10.710  -4.605
 1049   2HE   LYS 136          1HE       LYS 136  10.883  11.516  -5.363
 1050   1HZ   LYS 136          1HZ       LYS 136  12.010  13.612  -5.181
 1051   2HZ   LYS 136          2HZ       LYS 136  13.032  12.505  -5.963
 1052   3HZ   LYS 136          3HZ       LYS 136  13.301  12.905  -4.336
 1053    H    GLY 137           H        GLY 137  14.027   9.739   0.353
 1054   1HA   GLY 137          2HA       GLY 137  15.871  11.164  -0.336
 1055   2HA   GLY 137          1HA       GLY 137  15.012  12.515   0.391
 1056    H    VAL 138           H        VAL 138  14.557   9.984   2.450
 1057    HA   VAL 138           HA       VAL 138  16.549  11.102   4.231
 1058    HB   VAL 138           HB       VAL 138  15.498   9.900   6.019
 1059   1HG1  VAL 138          1HG1      VAL 138  13.035  10.743   4.706
 1060   2HG1  VAL 138          2HG1      VAL 138  14.347  11.920   4.612
 1061   3HG1  VAL 138          3HG1      VAL 138  13.799  11.333   6.182
 1062   1HG2  VAL 138          1HG2      VAL 138  14.968   7.888   4.452
 1063   2HG2  VAL 138          2HG2      VAL 138  13.434   8.725   4.219
 1064   3HG2  VAL 138          3HG2      VAL 138  13.930   8.228   5.837
 1065    HA   PRO 139           HA       PRO 139  19.007   7.356   4.365
 1066   1HB   PRO 139          2HB       PRO 139  21.177   8.502   5.436
 1067   2HB   PRO 139          1HB       PRO 139  20.756   8.760   3.739
 1068   1HG   PRO 139          2HG       PRO 139  20.578  10.622   6.017
 1069   2HG   PRO 139          1HG       PRO 139  20.674  10.972   4.285
 1070   1HD   PRO 139          2HD       PRO 139  18.328  10.876   5.979
 1071   2HD   PRO 139          1HD       PRO 139  18.438  11.336   4.267
 1072    H    LEU 140           H        LEU 140  20.491   6.629   6.362
 1073    HA   LEU 140           HA       LEU 140  19.722   7.511   8.956
 1074   1HB   LEU 140          2HB       LEU 140  17.816   5.944   7.968
 1075   2HB   LEU 140          1HB       LEU 140  18.917   4.678   8.474
 1076    HG   LEU 140           HG       LEU 140  18.801   6.240  10.718
 1077   1HD1  LEU 140          1HD1      LEU 140  16.811   7.247  11.013
 1078   2HD1  LEU 140          2HD1      LEU 140  15.934   6.015  10.105
 1079   3HD1  LEU 140          3HD1      LEU 140  16.795   7.295   9.250
 1080   1HD2  LEU 140          1HD2      LEU 140  17.998   3.657   9.861
 1081   2HD2  LEU 140          2HD2      LEU 140  16.718   4.322  10.876
 1082   3HD2  LEU 140          3HD2      LEU 140  18.365   4.209  11.495
 1083    H    ASP 141           H        ASP 141  21.971   7.666   8.961
 1084    HA   ASP 141           HA       ASP 141  24.058   7.040   9.638
 1085   1HB   ASP 141          2HB       ASP 141  22.396   5.812  11.358
 1086   2HB   ASP 141          1HB       ASP 141  23.181   4.399  10.662
 1087    H    GLY 142           H        GLY 142  24.654   6.828   7.396
 1088   1HA   GLY 142          2HA       GLY 142  25.771   5.726   5.712
 1089   2HA   GLY 142          1HA       GLY 142  25.962   4.387   6.830
 1090    H    ARG 143           H        ARG 143  22.778   4.903   6.680
 1091    HA   ARG 143           HA       ARG 143  22.431   3.139   4.326
 1092   1HB   ARG 143          2HB       ARG 143  22.156   1.901   6.477
 1093   2HB   ARG 143          1HB       ARG 143  20.797   2.949   6.860
 1094   1HG   ARG 143          2HG       ARG 143  19.405   1.778   5.580
 1095   2HG   ARG 143          1HG       ARG 143  20.551   1.716   4.240
 1096   1HD   ARG 143          2HD       ARG 143  20.917   0.010   6.678
 1097   2HD   ARG 143          1HD       ARG 143  19.850  -0.493   5.367
 1098    HE   ARG 143           HE       ARG 143  22.427   0.266   4.401
 1099   1HH1  ARG 143          1HH1      ARG 143  20.666  -2.346   5.956
 1100   2HH1  ARG 143          2HH1      ARG 143  21.761  -3.581   5.388
 1101   1HH2  ARG 143          1HH2      ARG 143  23.835  -1.346   3.633
 1102   2HH2  ARG 143          2HH2      ARG 143  23.563  -3.011   4.064
 1103    HA   PRO 144           HA       PRO 144  19.406   6.378   3.386
 1104   1HB   PRO 144          2HB       PRO 144  20.026   5.951   0.629
 1105   2HB   PRO 144          1HB       PRO 144  20.470   7.336   1.625
 1106   1HG   PRO 144          2HG       PRO 144  22.250   5.490   0.570
 1107   2HG   PRO 144          1HG       PRO 144  22.586   6.573   1.932
 1108   1HD   PRO 144          2HD       PRO 144  21.815   3.686   1.944
 1109   2HD   PRO 144          1HD       PRO 144  22.939   4.564   3.008
 1110    H    MET 145           H        MET 145  17.351   6.120   2.030
 1111    HA   MET 145           HA       MET 145  16.978   3.339   1.221
 1112   1HB   MET 145          2HB       MET 145  14.587   3.495   2.054
 1113   2HB   MET 145          1HB       MET 145  15.829   3.266   3.275
 1114   1HG   MET 145          2HG       MET 145  15.635   5.975   3.210
 1115   2HG   MET 145          1HG       MET 145  13.975   5.489   2.854
 1116   1HE   MET 145          1HE       MET 145  16.952   5.356   4.907
 1117   2HE   MET 145          2HE       MET 145  16.631   4.116   6.120
 1118   3HE   MET 145          3HE       MET 145  16.280   5.809   6.473
 1119    H    ASP 146           H        ASP 146  15.311   3.089  -0.397
 1120    HA   ASP 146           HA       ASP 146  15.190   5.535  -2.026
 1121   1HB   ASP 146          2HB       ASP 146  16.376   3.384  -2.848
 1122   2HB   ASP 146          1HB       ASP 146  14.742   2.779  -3.121
 1123    H    ILE 147           H        ILE 147  13.335   6.521  -1.934
 1124    HA   ILE 147           HA       ILE 147  10.858   4.930  -2.046
 1125    HB   ILE 147           HB       ILE 147  10.046   7.230  -0.831
 1126   1HG1  ILE 147          2HG1      ILE 147  12.786   7.388  -0.581
 1127   2HG1  ILE 147          1HG1      ILE 147  11.619   8.232   0.426
 1128   1HG2  ILE 147          1HG2      ILE 147   9.364   5.866   0.827
 1129   2HG2  ILE 147          2HG2      ILE 147  10.953   5.121   1.023
 1130   3HG2  ILE 147          3HG2      ILE 147   9.894   4.613  -0.295
 1131   1HD1  ILE 147          1HD1      ILE 147  12.826   5.554   1.070
 1132   2HD1  ILE 147          2HD1      ILE 147  11.760   6.509   2.102
 1133   3HD1  ILE 147          3HD1      ILE 147  13.376   7.101   1.712
 1134    H    GLN 148           H        GLN 148  10.163   5.265  -4.108
 1135    HA   GLN 148           HA       GLN 148  10.354   7.993  -5.178
 1136   1HB   GLN 148          2HB       GLN 148  10.891   5.482  -6.317
 1137   2HB   GLN 148          1HB       GLN 148   9.404   6.037  -7.075
 1138   1HG   GLN 148          2HG       GLN 148  10.784   8.275  -7.309
 1139   2HG   GLN 148          1HG       GLN 148  12.144   7.158  -7.217
 1140   1HE2  GLN 148          1HE2      GLN 148  12.119   5.344  -8.739
 1141   2HE2  GLN 148          2HE2      GLN 148  11.449   5.596 -10.318
 1142    H    LEU 149           H        LEU 149   8.596   9.176  -4.894
 1143    HA   LEU 149           HA       LEU 149   5.979   7.856  -4.754
 1144   1HB   LEU 149          2HB       LEU 149   7.110  10.417  -3.702
 1145   2HB   LEU 149          1HB       LEU 149   5.390  10.325  -4.011
 1146    HG   LEU 149           HG       LEU 149   5.620   9.866  -1.735
 1147   1HD1  LEU 149          1HD1      LEU 149   4.998   7.630  -3.494
 1148   2HD1  LEU 149          2HD1      LEU 149   4.113   8.272  -2.110
 1149   3HD1  LEU 149          3HD1      LEU 149   5.447   7.144  -1.859
 1150   1HD2  LEU 149          1HD2      LEU 149   7.767   9.483  -1.159
 1151   2HD2  LEU 149          2HD2      LEU 149   8.086   8.484  -2.579
 1152   3HD2  LEU 149          3HD2      LEU 149   7.236   7.802  -1.192
 1153    H    VAL 150           H        VAL 150   5.120   7.747  -6.811
 1154    HA   VAL 150           HA       VAL 150   5.193  10.224  -8.390
 1155    HB   VAL 150           HB       VAL 150   4.155   7.581  -9.392
 1156   1HG1  VAL 150          1HG1      VAL 150   3.982   9.978 -10.519
 1157   2HG1  VAL 150          2HG1      VAL 150   4.231   8.514 -11.469
 1158   3HG1  VAL 150          3HG1      VAL 150   5.600   9.553 -11.075
 1159   1HG2  VAL 150          1HG2      VAL 150   6.180   6.673  -9.620
 1160   2HG2  VAL 150          2HG2      VAL 150   6.753   7.902  -8.493
 1161   3HG2  VAL 150          3HG2      VAL 150   6.871   8.177 -10.232
 1162    H    ALA 151           H        ALA 151   3.580  11.456  -7.692
 1163    HA   ALA 151           HA       ALA 151   0.902  10.946  -8.300
 1164   1HB   ALA 151          1HB       ALA 151  -0.040  10.811  -5.992
 1165   2HB   ALA 151          2HB       ALA 151   1.595  10.535  -5.391
 1166   3HB   ALA 151          3HB       ALA 151   0.847   9.369  -6.485
 1167    H    SER 152           H        SER 152   2.744  12.998  -8.640
 1168    HA   SER 152           HA       SER 152   2.415  15.047  -6.666
 1169   1HB   SER 152          2HB       SER 152   3.321  16.097  -9.167
 1170   2HB   SER 152          1HB       SER 152   4.254  15.809  -7.696
 1171    HG   SER 152           HG       SER 152   5.229  14.420  -8.985
 1172    H    GLN 153           H        GLN 153   1.238  14.518  -9.974
 1173    HA   GLN 153           HA       GLN 153  -1.110  16.145  -9.316
 1174   1HB   GLN 153          2HB       GLN 153   0.952  16.852 -11.207
 1175   2HB   GLN 153          1HB       GLN 153  -0.586  16.620 -12.028
 1176   1HG   GLN 153          2HG       GLN 153  -1.327  18.111  -9.875
 1177   2HG   GLN 153          1HG       GLN 153   0.282  18.745 -10.223
 1178   1HE2  GLN 153          1HE2      GLN 153  -2.820  19.331 -10.752
 1179   2HE2  GLN 153          2HE2      GLN 153  -2.746  20.073 -12.318
 1180    H    ILE 154           H        ILE 154  -2.005  14.005  -9.084
 1181    HA   ILE 154           HA       ILE 154  -2.146  12.286 -11.395
 1182    HB   ILE 154           HB       ILE 154  -3.731  10.941  -9.938
 1183   1HG1  ILE 154          2HG1      ILE 154  -2.693  12.316  -7.538
 1184   2HG1  ILE 154          1HG1      ILE 154  -3.917  13.207  -8.439
 1185   1HG2  ILE 154          1HG2      ILE 154  -1.166  10.737 -10.221
 1186   2HG2  ILE 154          2HG2      ILE 154  -1.964   9.855  -8.917
 1187   3HG2  ILE 154          3HG2      ILE 154  -1.106  11.357  -8.571
 1188   1HD1  ILE 154          1HD1      ILE 154  -4.257  10.377  -7.481
 1189   2HD1  ILE 154          2HD1      ILE 154  -5.487  11.424  -8.191
 1190   3HD1  ILE 154          3HD1      ILE 154  -4.815  11.803  -6.605
 1191    H    ASP 155           H        ASP 155  -3.119  14.714 -12.043
 1192    HA   ASP 155           HA       ASP 155  -6.008  14.230 -12.374
 1193   1HB   ASP 155          2HB       ASP 155  -4.702  16.521 -11.447
 1194   2HB   ASP 155          1HB       ASP 155  -5.099  16.894 -13.122
 1195    H    LEU 156           H        LEU 156  -2.962  14.418 -13.818
 1196    HA   LEU 156           HA       LEU 156  -4.015  14.805 -16.517
 1197   1HB   LEU 156          2HB       LEU 156  -1.129  14.386 -15.793
 1198   2HB   LEU 156          1HB       LEU 156  -1.793  15.179 -17.207
 1199    HG   LEU 156           HG       LEU 156  -2.135  16.330 -14.450
 1200   1HD1  LEU 156          1HD1      LEU 156   0.324  15.904 -15.466
 1201   2HD1  LEU 156          2HD1      LEU 156  -0.097  17.277 -14.442
 1202   3HD1  LEU 156          3HD1      LEU 156  -0.057  17.464 -16.195
 1203   1HD2  LEU 156          1HD2      LEU 156  -2.945  18.176 -15.487
 1204   2HD2  LEU 156          2HD2      LEU 156  -3.385  16.987 -16.713
 1205   3HD2  LEU 156          3HD2      LEU 156  -1.926  17.958 -16.911
 1206    H    GLU 157           H        GLU 157  -2.423  12.467 -14.464
 1207    HA   GLU 157           HA       GLU 157  -2.159  10.226 -14.554
 1208   1HB   GLU 157          2HB       GLU 157  -4.580  10.690 -16.227
 1209   2HB   GLU 157          1HB       GLU 157  -3.877   9.077 -16.198
 1210   1HG   GLU 157          2HG       GLU 157  -4.790   8.651 -14.232
 1211   2HG   GLU 157          1HG       GLU 157  -4.075  10.106 -13.534
 1212    H    HIS 158           H        HIS 158  -0.716  11.975 -16.525
 1213    HA   HIS 158           HA       HIS 158   0.588   9.918 -17.978
 1214   1HB   HIS 158          2HB       HIS 158  -1.691  10.816 -19.252
 1215   2HB   HIS 158          1HB       HIS 158  -0.433  11.822 -19.964
 1216    HD1  HIS 158           1HD      HIS 158  -1.627  10.067 -21.942
 1217    HD2  HIS 158           2HD      HIS 158   1.379   8.684 -19.420
 1218    HE1  HIS 158           1HE      HIS 158  -0.632   8.064 -23.102
 1219    HE2  HIS 158           2HE      HIS 158   1.091   7.162 -21.490