*HEADER    PHOTOSYNTHESIS                          02-AUG-06   2DW3              
*TITLE     SOLUTION STRUCTURE OF THE RHODOBACTER SPHAEROIDES PUFX                
*TITLE    2 MEMBRANE PROTEIN                                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INTRINSIC MEMBRANE PROTEIN PUFX;                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES IN DATABASE 2-72;                                 
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RHODOBACTER SPHAEROIDES;                        
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET20B+                                   
*KEYWDS    MEMBRANE PROTEIN, QUINONE EXCHANGE, PHOTOSYNTHESIS, LIGHT-            
*KEYWDS   2 HARVESTING, GXXXG MOTIF, DIMERIZATION                                
*EXPDTA    NMR, 7 STRUCTURES                                                     
*AUTHOR    Z.Y.WANG                                                              
*REVDAT   1   26-JUN-07 2DW3    0                                                


!EDIT_HISTORY
! RSP PufX noe

!A1

!D2

!K3
assign (resid 3 and name HN) (resid 3 and name HB#) 4.0 2.2 1.5     !# 1    64   80%
assign (resid 3 and name HN) (resid 3 and name HA) 4.0 2.2 1.5      !# 2    44   80%

!T4
assign (resid 4 and name HN) (resid 4 and name HB) 4.0 2.2 1.5     !# 4    39  100%
assign (resid 4 and name HN) (resid 4 and name HA) 4.0 2.2 1.5     !# 5    32  100%
assign (resid 4 and name HN) (resid 3 and name HN) 4.0 2.2 1.5     !# 6    43   80%

!I5
assign (resid 5 and name HN) (resid 5 and name HG2#) 4.0 2.2 1.5    !# 7    21   10%
assign (resid 5 and name HN) (resid 5 and name HG1#) 4.0 2.2 1.5    !# 8    29   30%
assign (resid 5 and name HN) (resid 5 and name HB) 4.0 2.2 1.5      !# 9    56  100%
assign (resid 5 and name HN) (resid 5 and name HA) 4.0 2.2 1.5      !# 10   21  100%
assign (resid 5 and name HN) (resid 4 and name HB) 3.0 1.2 1.5      !# 11   90   40%
assign (resid 5 and name HN) (resid 4 and name HA) 4.0 2.2 1.5      !# 12   24   50%
assign (resid 5 and name HN) (resid 6 and name HN) 4.0 2.2 1.5      !# 13   71   80%
assign (resid 5 and name HN) (resid 4 and name HN) 4.0 2.2 1.5      !# 15   35   80%

!F6
assign (resid 6 and name HN) (resid 6 and name HB2) 4.0 2.2 1.5     !# 18   65   80%  r B1-B2
assign (resid 6 and name HN) (resid 6 and name HB1) 4.0 2.2 1.5     !# 19   31   80%  r B2-B1
assign (resid 6 and name HN) (resid 5 and name HA) 4.0 2.2 1.5      !# 20   22   80%
assign (resid 6 and name HN) (resid 4 and name HB) 4.5 2.7 1.5      !# 21   23   40%  L 4-4.5
assign (resid 6 and name HN) (resid 6 and name HA) 4.0 2.2 1.5      !# 22   56  100%
assign (resid 6 and name HN) (resid 5 and name HN) 4.0 2.2 1.5      !# 24  110   80%  L 3-4
assign (resid 6 and name HN) (resid 7 and name HN) 4.0 2.2 1.5      !# 25   52   80%

!N7
assign (resid 7 and name HN) (resid 7 and name HB#) 4.0 2.2 1.5     !# 27   57   80%
assign (resid 7 and name HN) (resid 6 and name HB1) 4.0 2.2 1.5     !# 29   26   60%  r B2-B1
assign (resid 7 and name HN) (resid 6 and name HA) 4.0 2.2 1.5      !# 32   39   60%
assign (resid 7 and name HN) (resid 7 and name HA) 4.0 2.2 1.5      !# 33   40   80%
assign (resid 7 and name HN) (resid 6 and name HN) 4.0 2.2 1.5      !# 34   36   70%
assign (resid 7 and name HN) (resid 8 and name HN) 4.0 2.2 1.5      !# 36   49   70%

!D8
assign (resid 8 and name HN) (resid 8 and name HB#) 4.0 2.2 1.5     !# 37   34   60%
assign (resid 8 and name HN) (resid 8 and name HA) 4.0 2.2 1.5      !# 38   54   50%  r 9-8
assign (resid 8 and name HN) (resid 7 and name HA) 4.0 2.2 1.5      !# 39   43   50%  r 8-7
assign (resid 8 and name HN) (resid 7 and name HN) 4.0 2.2 1.5      !# 40   53   50%
assign (resid 8 and name HN) (resid 9 and name HN) 4.0 2.2 1.5      !# 41        50%

!H9
assign (resid 9 and name HN) (resid 8 and name HB#) 4.0 2.2 1.5     !# 42   26   60% 
assign (resid 9 and name HN) (resid 9 and name HB#) 4.0 2.2 1.5     !# 42   39   60%
assign (resid 9 and name HN) (resid 9 and name HA) 3.0 1.2 1.5      !# 43  278   60%  L 2-3
assign (resid 9 and name HN) (resid 8 and name HA) 4.0 2.2 1.5      !# 44   28   50%
assign (resid 9 and name HN) (resid 8 and name HN) 4.0 2.2 1.5      !# 45        50%
assign (resid 9 and name HN) (resid 10 and name HN) 4.0 2.2 1.5     !# 46        50%

!L10
assign (resid 10 and name HN) (resid 10 and name HB#) 3.0 1.2 1.5   !# 47  110   50%
assign (resid 10 and name HN) (resid 10 and name HA) 4.0 2.2 1.5    !# 48   60   50%
assign (resid 10 and name HN) (resid 9 and name HA) 4.0 2.2 1.5     !# 49   66   40%
assign (resid 10 and name HN) (resid 9 and name HN) 4.0 2.2 1.5     !# 50        40%
assign (resid 10 and name HN) (resid 11 and name HN) 4.0 2.2 1.5    !# 51        40%

!N11
assign (resid 11 and name HN) (resid 11 and name HB#) 4.0 2.2 1.5   !# 52   66   60%
assign (resid 11 and name HN) (resid 11 and name HA) 4.0 2.2 1.5    !# 54   43   60%
assign (resid 11 and name HN) (resid 12 and name HN) 4.0 2.2 1.5    !# 55   49   60%
assign (resid 11 and name HN) (resid 10 and name HN) 3.0 1.2 1.5    !# 56   99   60%
 
!T12
assign (resid 12 and name HN) (resid 12 and name HG2#) 4.0 2.2 1.5  !# 57   62  100%
assign (resid 12 and name HN) (resid 11 and name HB#) 4.0 2.2 1.5   !# 58   55   80%
assign (resid 12 and name HN) (resid 12 and name HB) 3.0 1.2 1.5    !# 59   84  100%  r A-B
assign (resid 12 and name HN) (resid 12 and name HA) 4.0 2.2 1.5    !# 60   69   50%  r 9-12A
assign (resid 12 and name HN) (resid 12 and name HG1) 4.0 2.2 1.5   !# 61  102   80%  r 11-12
assign (resid 12 and name HN) (resid 13 and name HN) 4.0 2.2 1.5    !# 62   99   80%  L 3-4
assign (resid 12 and name HN) (resid 11 and name HN) 4.0 2.2 1.5    !# 64   73   80%

!N13
assign (resid 13 and name HN) (resid 13 and name HB2) 4.0 2.2 1.5   !# 65   63   80%  r 1-2
assign (resid 13 and name HN) (resid 13 and name HB1) 4.0 2.2 1.5   !# 66   56   80%  r 2-1
assign (resid 13 and name HN) (resid 12 and name HB) 3.0 1.2 1.5    !# 67  103   70%  r A-B
assign (resid 13 and name HN) (resid 12 and name HA) 4.0 2.2 1.5    !# 68   30   10%  r 9-12A
assign (resid 13 and name HN) (resid 13 and name HA) 4.0 2.2 1.5    !# 69   57   80%
assign (resid 13 and name HN) (resid 12 and name HN) 4.0 2.2 1.5    !# 70   75   60%
assign (resid 13 and name HN) (resid 16 and name HN) 4.5 2.7 1.5    !# 71   60   50%  L 4-4.5

!P14

!K15
assign (resid 15 and name HN) (resid 15 and name HG#) 4.0 2.2 1.5   !# 72   24   60%
assign (resid 15 and name HN) (resid 14 and name HG#) 4.0 2.2 1.5   !# 73   39   40%
assign (resid 15 and name HN) (resid 15 and name HB#) 3.0 1.2 1.5   !# 74   94   60%
assign (resid 15 and name HN) (resid 14 and name HB#) 4.0 2.2 1.5   !# 75   30   40%
assign (resid 15 and name HN) (resid 14 and name HD#) 4.0 2.2 1.5   !# 76   35   40%
assign (resid 15 and name HN) (resid 15 and name HA) 3.0 1.2 1.5    !# 77   88   60%
assign (resid 15 and name HN) (resid 14 and name HA) 4.0 2.2 1.5    !# 78   58   40%
assign (resid 15 and name HN) (resid 16 and name HN) 4.0 2.2 1.5    !# 79   70   60%
assign (resid 15 and name HN) (resid 18 and name HN) 4.0 2.2 1.5    !# 80   38   50%

!T16
assign (resid 16 and name HN) (resid 16 and name HG2#) 4.0 2.2 1.5  !# 81   38   100%
assign (resid 16 and name HN) (resid 15 and name HB#) 4.0 2.2 1.5   !# 82   50    80%
assign (resid 16 and name HN) (resid 13 and name HB1) 4.0 2.2 1.5   !# 84   38    80%  wL 4-4.5  r #-1
assign (resid 16 and name HN) (resid 16 and name HA) 4.0 2.2 1.5    !# 85   85   100%  L 3-4  r B-A
assign (resid 16 and name HN) (resid 15 and name HA) 4.0 2.2 1.5    !# 86   30    20%
assign (resid 16 and name HN) (resid 16 and name HB) 4.0 2.2 1.5    !# 87   77   100%  r A-B
assign (resid 16 and name HN) (resid 16 and name HG1) 4.0 2.2 1.5   !# 88   51    70%  L 4-4.5  r 17-16
assign (resid 16 and name HN) (resid 18 and name HN) 4.0 2.2 1.5    !# 89   43    70%  wL 4-4.5
assign (resid 16 and name HN) (resid 15 and name HN) 4.0 2.2 1.5    !# 90   82    80%  L 3-4
assign (resid 16 and name HN) (resid 17 and name HN) 4.0 2.2 1.5    !# 91         50%

!N17
assign (resid 17 and name HN) (resid 16 and name HG2#) 4.0 2.2 1.5  !# 92   43    80%
assign (resid 17 and name HN) (resid 18 and name HB#) 4.0 2.2 1.5   !# 93   36    70%  wr 18-20-18  L 4-4.5
assign (resid 17 and name HN) (resid 17 and name HB#) 3.0 1.2 1.5   !# 95  135   100%
assign (resid 17 and name HN) (resid 16 and name HA) 4.0 2.2 1.5    !# 96   24    60%  r B-A
assign (resid 17 and name HN) (resid 16 and name HB) 4.0 2.2 1.5    !# 98  101    80%  r A-B
assign (resid 17 and name HN) (resid 17 and name HA) 3.0 1.2 1.5    !# 99  168   100%
assign (resid 17 and name HN) (resid 16 and name HN) 4.0 2.2 1.5    !# 100  52    80%
assign (resid 17 and name HN) (resid 18 and name HN) 4.0 2.2 1.5    !# 101 116    80%  L 3-4
assign (resid 17 and name HN) (resid 15 and name HN) 4.0 2.2 1.5    !# 102  53    70%  wL 4-4.5

!L18
assign (resid 18 and name HN) (resid 18 and name HD2#) 4.0 2.2 1.5  !# 104  32    40%  
assign (resid 18 and name HN) (resid 18 and name HD1#) 4.0 2.2 1.5  !# 105  67    60%  
assign (resid 18 and name HN) (resid 18 and name HB#) 3.0 1.2 1.5   !# 108 309   100%  LENGTH CHECK
assign (resid 18 and name HN) (resid 17 and name HB#) 4.0 2.2 1.5   !# 110  38    50%
!assign (resid 18 and name HN) (resid 21 and name HB#) 4.5 2.7 1.5   # 111  87    60%  wL 4-4.5 del
assign (resid 18 and name HN) (resid 15 and name HA) 4.0 2.2 1.5    !# 112  49    60%  L 4-4.5 r 19-15
assign (resid 18 and name HN) (resid 18 and name HA) 3.0 1.2 1.5    !# 113 173   100%
assign (resid 18 and name HN) (resid 17 and name HA) 4.0 2.2 1.5    !# 114 101    80%  L 3-4
assign (resid 18 and name HN) (resid 17 and name HN) 3.0 1.2 1.5    !# 115 117    80%
assign (resid 18 and name HN) (resid 21 and name HN) 4.0 2.2 1.5    !# 116  70    50%  L 4-4.5
assign (resid 18 and name HN) (resid 19 and name HN) 4.0 2.2 1.5    !# 118        50%

!R19
assign (resid 19 and name HN) (resid 18 and name HD1#) 4.0 2.2 1.5  !# 119  40    20%  r D#-D1#
assign (resid 19 and name HN) (resid 18 and name HB#) 3.0 1.2 1.5   !# 120 115    60%
assign (resid 19 and name HN) (resid 19 and name HB#) 3.0 1.2 1.5   !# 121 188   100%
assign (resid 19 and name HN) (resid 19 and name HA) 3.0 1.2 1.5    !# 124 165   100%
assign (resid 19 and name HN) (resid 18 and name HA) 4.0 2.2 1.5    !# 125  37    40%  r 16-18
assign (resid 19 and name HN) (resid 17 and name HN) 4.0 2.2 1.5    !# 127  48    50%
assign (resid 19 and name HN) (resid 21 and name HN) 4.0 2.2 1.5    !# 128  40    50%
assign (resid 19 and name HN) (resid 18 and name HN) 4.0 2.2 1.5    !# 130        50%
assign (resid 19 and name HN) (resid 20 and name HN) 4.0 2.2 1.5    !# 131        50%

!L20
assign (resid 20 and name HN) (resid 20 and name HD2#) 4.0 2.2 1.5  !# 132  24    40%  L 4-4.5
assign (resid 20 and name HN) (resid 20 and name HD1#) 4.0 2.2 1.5  !# 133  70    40%
assign (resid 20 and name HN) (resid 20 and name HB#) 3.0 1.2 1.5   !# 134  95    60%
assign (resid 20 and name HN) (resid 19 and name HA)  3.0 1.2 1.5   !# 136 116    60%
assign (resid 20 and name HN) (resid 19 and name HB#) 3.0 1.2 1.5   !# 136 116    60%
assign (resid 20 and name HN) (resid 20 and name HA) 3.0 1.2 1.5    !# 138 118    60%
assign (resid 20 and name HN) (resid 17 and name HA) 4.0 2.2 1.5    !# 139  51    30%
assign (resid 20 and name HN) (resid 22 and name HN) 4.0 2.2 1.5    !# 140        30%
assign (resid 20 and name HN) (resid 21 and name HN) 4.0 2.2 1.5    !# 141        30%
assign (resid 20 and name HN) (resid 19 and name HN) 4.0 2.2 1.5    !# 143        50%

!W21
assign (resid 21 and name HN) (resid 20 and name HD2#) 4.0 2.2 1.5  !# 144  38    50%  r #-2#
assign (resid 21 and name HN) (resid 20 and name HB#) 4.0 2.2 1.5   !# 146  55    60%
assign (resid 21 and name HN) (resid 21 and name HB2) 4.0 2.2 1.5   !# 150 180    30%  L 4-4.5
assign (resid 21 and name HN) (resid 21 and name HB1) 3.0 1.2 1.5   !# 151 156    80%
assign (resid 21 and name HN) (resid 21 and name HA) 3.0 1.2 1.5    !# 152 170    80%
assign (resid 21 and name HN) (resid 17 and name HA) 4.0 2.2 1.5    !# 153  18    10%
assign (resid 21 and name HN) (resid 20 and name HN) 4.0 2.2 1.5    !# 154 108    60%  L 3-4
assign (resid 21 and name HN) (resid 24 and name HN) 4.0 2.2 1.5    !# 155  78    50%  L 4-4.5
assign (resid 21 and name HN) (resid 22 and name HN) 4.0 2.2 1.5    !# 156 104    50%  L 3-4

!V22
assign (resid 22 and name HN) (resid 18 and name HD2#) 4.0 2.2 1.5  !# 157  26    20%  r 20-18D2  L 4-4.5
assign (resid 22 and name HN) (resid 22 and name HG2#) 4.0 2.2 1.5  !# 158  92   100%  w L 4.5-4 L 3-4.5
assign (resid 22 and name HN) (resid 22 and name HG1#) 3.0 1.2 1.5  !# 159 204   100%  w L 4-3 L 2-3
assign (resid 22 and name HN) (resid 25 and name HB2) 4.0 2.2 1.5   !# 160  37    80%  L 4-4.5  r 23-25
assign (resid 22 and name HN) (resid 18 and name HB#) 4.0 2.2 1.5   !# 161  25    20%  L 4-4.5
assign (resid 22 and name HN) (resid 25 and name HB1) 4.0 2.2 1.5   !# 162  40    20%  w r #-1 L 4-4.5
assign (resid 22 and name HN) (resid 22 and name HB) 3.0 1.2 1.5    !# 163 164   100%
assign (resid 22 and name HN) (resid 22 and name HA) 3.0 1.2 1.5    !# 166 191   100%
assign (resid 22 and name HN) (resid 21 and name HB1) 4.0 2.2 1.5   !# 167  62    60%  r #-1
assign (resid 22 and name HN) (resid 19 and name HA) 4.0 2.2 1.5    !# 168  46    60%
assign (resid 22 and name HN) (resid 21 and name HA) 4.0 2.2 1.5    !# 169  51    80%
assign (resid 22 and name HN) (resid 21 and name HD#) 4.0 2.2 1.5   !# 170  30    40%  w E->D L 4-4.5
assign (resid 22 and name HN) (resid 23 and name HN) 3.0 1.2 1.5    !# 171  94    60%  w L4-3 L 3-4
assign (resid 22 and name HN) (resid 21 and name HN) 3.0 1.2 1.5    !# 172  94    60%  w L4-3 L 3-4

!A23
assign (resid 23 and name HN) (resid 22 and name HG2#) 4.0 2.2 1.5  !# 174  82    50%
assign (resid 23 and name HN) (resid 22 and name HG1#) 4.0 2.2 1.5  !# 175  57    50%
assign (resid 23 and name HN) (resid 23 and name HB#) 3.0 1.2 1.5   !# 176 204    90%  L 2-3
assign (resid 23 and name HN) (resid 22 and name HB) 3.0 1.2 1.5    !# 177  93    70%
assign (resid 23 and name HN) (resid 24 and name HB#) 4.0 2.2 1.5   !# 178  25    30%  w r19D->24B 
assign (resid 23 and name HN) (resid 22 and name HA) 4.0 2.2 1.5    !# 179  39    70%
assign (resid 23 and name HN) (resid 23 and name HA) 2.0 0.2 1.5    !# 180 241   100%
assign (resid 23 and name HN) (resid 24 and name HN) 4.0 2.2 1.5    !# 182 171    80%  L 3-4
assign (resid 23 and name HN) (resid 22 and name HN) 4.0 2.2 1.5    !# 183        50%

!F24
assign (resid 24 and name HN) (resid 23 and name HB#) 3.0 1.2 1.5   !# 186 175    80%
assign (resid 24 and name HN) (resid 25 and name HB#) 4.0 2.2 1.5   !# 187  36    40%  L 4-4.5
assign (resid 24 and name HN) (resid 22 and name HB) 4.0 2.2 1.5    !# 189  27    20%  L 4-4.5
assign (resid 24 and name HN) (resid 24 and name HB2) 4.0 2.2 1.5   !# 190 166   100%  L 3-4
assign (resid 24 and name HN) (resid 24 and name HB1) 3.0 1.2 1.5   !# 191 264   100%  L 2-3
assign (resid 24 and name HN) (resid 23 and name HA) 4.0 2.2 1.5    !# 193  88    90%  L 3-4
assign (resid 24 and name HN) (resid 24 and name HA) 2.0 0.2 1.5    !# 194 217   100%
assign (resid 24 and name HN) (resid 24 and name HD#) 4.0 2.2 1.5   !# 195  24    10%
assign (resid 24 and name HN) (resid 25 and name HN) 4.0 2.2 1.5    !# 196 165    70%  L 3-4
assign (resid 24 and name HN) (resid 21 and name HN) 4.0 2.2 1.5    !# 197  61    60%
assign (resid 24 and name HN) (resid 23 and name HN) 4.0 2.2 1.5    !# 198        50%

!Q25
assign (resid 25 and name HN) (resid 25 and name HB2) 3.0 1.2 1.5   !# 201  98    30%  w r23->r25B2 L 4-4.5
assign (resid 25 and name HN) (resid 28 and name HB#) 4.0 2.2 1.5   !# 202  38    10%  r 18-28 
assign (resid 25 and name HN) (resid 25 and name HB1) 2.0 0.2 1.5   !# 203 250   100%  r B2-B1
assign (resid 25 and name HN) (resid 24 and name HB2) 4.0 2.2 1.5   !# 205  49    70%
assign (resid 25 and name HN) (resid 24 and name HB1) 4.0 2.2 1.5   !# 206  37    70%
assign (resid 25 and name HN) (resid 22 and name HA) 4.0 2.2 1.5    !# 207  47    50%
assign (resid 25 and name HN) (resid 25 and name HA) 3.0 1.2 1.5    !# 208 141   100%
assign (resid 25 and name HN) (resid 23 and name HA) 4.0 2.2 1.5    !# 209  18    10%  L 4-4.5
assign (resid 25 and name HN) (resid 24 and name HA) 4.0 2.2 1.5    !# 210  51    70%
assign (resid 25 and name HN) (resid 26 and name HN) 4.0 2.2 1.5    !# 211 118    80%  L 3-4
assign (resid 25 and name HN) (resid 24 and name HN) 4.0 2.2 1.5    !# 212        50%

!M26
assign (resid 26 and name HN) (resid 22 and name HG2#) 4.0 2.2 1.5  !# 213  38    10%  L 4-4.5
assign (resid 26 and name HN) (resid 25 and name HB2) 4.0 2.2 1.5   !# 215  61    50%  L 4-4.5  r 23-25
assign (resid 26 and name HN) (resid 28 and name HB#) 4.0 2.2 1.5   !# 216  21    10%  L 4-4.5
assign (resid 26 and name HN) (resid 26 and name HG2) 3.0 1.2 1.5   !# 217 131   100%
assign (resid 26 and name HN) (resid 26 and name HG1) 3.0 1.2 1.5   !# 218 110   100%
assign (resid 26 and name HN) (resid 26 and name HB2) 4.0 2.2 1.5   !# 219  50   100%
assign (resid 26 and name HN) (resid 26 and name HB1) 4.0 2.2 1.5   !# 220  72   100%
assign (resid 26 and name HN) (resid 25 and name HA) 4.0 2.2 1.5    !# 221  60    60%
assign (resid 26 and name HN) (resid 26 and name HA) 3.0 1.2 1.5    !# 222 180   100%
assign (resid 26 and name HN) (resid 25 and name HN) 4.0 2.2 1.5    !# 223 112    80%  L 3-4
assign (resid 26 and name HN) (resid 27 and name HN) 4.0 2.2 1.5    !# 224 111    80%  L 3-4

!M27
!assign (resid 27 and name HN) (resid 28 and name HD#) 4.5 2.7 1.5   # 225  22    10%  L 4-4.5  delete
assign (resid 27 and name HN) (resid 30 and name HB#) 4.0 2.2 1.5   !# 226  55    60%
assign (resid 27 and name HN) (resid 28 and name HB#) 4.0 2.2 1.5   !# 227  34    30%  L 4-4.5
assign (resid 27 and name HN) (resid 27 and name HG2) 3.0 1.2 1.5   !# 228 132   100%
assign (resid 27 and name HN) (resid 27 and name HG1) 3.0 1.2 1.5   !# 229 145   100%
assign (resid 27 and name HN) (resid 27 and name HB2) 4.0 2.2 1.5   !# 230  35   100%
assign (resid 27 and name HN) (resid 27 and name HB1) 4.0 2.2 1.5   !# 231  59   100%
assign (resid 27 and name HN) (resid 28 and name HA) 4.0 2.2 1.5    !# 232  40    60%  L 4-4.5
assign (resid 27 and name HN) (resid 27 and name HA) 3.0 1.2 1.5    !# 233 188   100%
assign (resid 27 and name HN) (resid 24 and name HA) 4.0 2.2 1.5    !# 234  46    50%
assign (resid 27 and name HN) (resid 28 and name HN) 4.0 2.2 1.5    !# 235 119    60%  L 3-4
assign (resid 27 and name HN) (resid 26 and name HN) 4.0 2.2 1.5    !# 236 116    60%  L 3-4

!K28
assign (resid 28 and name HN) (resid 28 and name HG#) 4.0 2.2 1.5   !# 237  39    50%
assign (resid 28 and name HN) (resid 28 and name HD#) 4.0 2.2 1.5   !# 238  69    50%
assign (resid 28 and name HN) (resid 30 and name HB#) 4.0 2.2 1.5   !# 239  57    60%  L 4-4.5
assign (resid 28 and name HN) (resid 28 and name HB#) 3.0 1.2 1.5   !# 240 197   100%
assign (resid 28 and name HN) (resid 27 and name HG2) 4.0 2.2 1.5   !# 241  57    60%
assign (resid 28 and name HN) (resid 27 and name HG1) 4.0 2.2 1.5   !# 242  53    60%
assign (resid 28 and name HN) (resid 28 and name HA) 4.0 2.2 1.5    !# 243 218   100%
assign (resid 28 and name HN) (resid 27 and name HA) 4.0 2.2 1.5    !# 244  51    70%
assign (resid 28 and name HN) (resid 24 and name HA) 4.0 2.2 1.5    !# 245  30    40%
assign (resid 28 and name HN) (resid 27 and name HN) 4.0 2.2 1.5    !# 246 252/2  80%  L 3-4
assign (resid 28 and name HN) (resid 29 and name HN) 4.0 2.2 1.5    !# 247 252/2  80%  L 3-4
assign (resid 28 and name HN) (resid 26 and name HN) 4.0 2.2 1.5    !# 248  52    80%

!G29
assign (resid 29 and name HN) (resid 28 and name HD#) 4.0 2.2 1.5   !# 249  23    20%
assign (resid 29 and name HN) (resid 30 and name HB#) 4.0 2.2 1.5   !# 250  40    50%  L 4-4.5
assign (resid 29 and name HN) (resid 28 and name HB#) 4.0 2.2 1.5   !# 251  72    50%
assign (resid 29 and name HN) (resid 29 and name HA#) 3.0 1.2 1.5   !# 253 233   100%  L 2-3
assign (resid 29 and name HN) (resid 26 and name HA) 4.0 2.2 1.5    !# 254  53    40%  r 27-26
assign (resid 29 and name HN) (resid 28 and name HN) 4.0 2.2 1.5    !# 255 105    80%  L 3-4
assign (resid 29 and name HN) (resid 30 and name HN) 4.0 2.2 1.5    !# 256        50%

!A30
assign (resid 30 and name HN) (resid 30 and name HB#) 3.0 1.2 1.5   !# 258 362   100%
assign (resid 30 and name HN) (resid 29 and name HA#) 4.0 2.2 1.5   !# 259 135   100%  L 3-4
assign (resid 30 and name HN) (resid 30 and name HA) 3.0 1.2 1.5    !# 260 186   100%
assign (resid 30 and name HN) (resid 26 and name HN) 4.0 2.2 1.5    !# 261  55    50%  L 4-4.5
assign (resid 30 and name HN) (resid 29 and name HN) 4.0 2.2 1.5    !# 262        50%
assign (resid 30 and name HN) (resid 31 and name HN) 4.0 2.2 1.5    !# 263        50%

!G31
assign (resid 31 and name HN) (resid 30 and name HB#) 4.0 2.2 1.5   !# 264 116   100%
assign (resid 31 and name HN) (resid 31 and name HA#) 3.0 1.2 1.5   !# 265 223   100%
assign (resid 31 and name HN) (resid 27 and name HA) 4.0 2.2 1.5    !# 266  32    10%
assign (resid 31 and name HN) (resid 30 and name HA) 4.0 2.2 1.5    !# 267  31    60%
assign (resid 31 and name HN) (resid 30 and name HN) 4.0 2.2 1.5    !# 268        50%
assign (resid 31 and name HN) (resid 32 and name HN) 4.0 2.2 1.5    !# 269        50%

!W32
assign (resid 32 and name HN) (resid 32 and name HB2) 2.0 0.2 1.5   !# 270 214   100%
assign (resid 32 and name HN) (resid 32 and name HB1) 3.0 1.2 1.5   !# 271 160   100%
assign (resid 32 and name HN) (resid 31 and name HA#) 3.0 1.2 1.5   !# 272 167    90%
assign (resid 32 and name HN) (resid 32 and name HA) 2.0 0.2 1.5    !# 273 217   100%
assign (resid 32 and name HN) (resid 28 and name HN) 4.0 2.2 1.5    !# 274  65    60%  L 4-4.5
assign (resid 32 and name HN) (resid 31 and name HN) 4.0 2.2 1.5    !# 275        50%
assign (resid 32 and name HN) (resid 33 and name HN) 4.0 2.2 1.5    !# 276        50%

!A33
assign (resid 33 and name HN) (resid 36 and name HG2#) 4.0 2.2 1.5  !# 277  31    60%  L 4-4.5
assign (resid 33 and name HN) (resid 33 and name HB#) 3.0 1.2 1.5   !# 279 410   100%  L 2-3
assign (resid 33 and name HN) (resid 36 and name HB) 4.0 2.2 1.5    !# 280  32    60%  L 4-4.5
assign (resid 33 and name HN) (resid 32 and name HB2) 4.0 2.2 1.5   !# 282  76    90%
assign (resid 33 and name HN) (resid 32 and name HB1) 3.0 1.2 1.5   !# 283 109    90%
assign (resid 33 and name HN) (resid 33 and name HA) 2.0 0.2 1.5    !# 284 277   100%
assign (resid 33 and name HN) (resid 30 and name HA) 4.0 2.2 1.5    !# 285  48    60%  r 37-30
assign (resid 33 and name HN) (resid 32 and name HA) 4.0 2.2 1.5    !# 286  40    90%
assign (resid 33 and name HN) (resid 32 and name HZ#) 4.0 2.2 1.5   !# 287  23    20%  L 4-4.5
assign (resid 33 and name HN) (resid 32 and name HE#) 4.0 2.2 1.5   !# 288  26    20%
assign (resid 33 and name HN) (resid 35 and name HN) 4.0 2.2 1.5    !# 289  39    50%
assign (resid 33 and name HN) (resid 32 and name HN) 4.0 2.2 1.5    !# 290 136    80%  L 3-4
assign (resid 33 and name HN) (resid 34 and name HN) 4.0 2.2 1.5    !# 291        50%

!G34
assign (resid 34 and name HN) (resid 33 and name HB#) 3.0 1.2 1.5   !# 293 166    90%
assign (resid 34 and name HN) (resid 37 and name HB#) 4.0 2.2 1.5   !# 294  47    50%
assign (resid 34 and name HN) (resid 34 and name HA#) 3.0 1.2 1.5   !# 295 442   100%  L 2-3
assign (resid 34 and name HN) (resid 31 and name HA#) 4.0 2.2 1.5   !# 296        90%  r 34-31  L 3-4
assign (resid 34 and name HN) (resid 30 and name HA) 4.0 2.2 1.5    !# 297  37    50%  r 37-30
assign (resid 34 and name HN) (resid 35 and name HN) 4.0 2.2 1.5    !# 300  86    80%  L 3-4
assign (resid 34 and name HN) (resid 38 and name HN) 4.0 2.2 1.5    !# 301  50    60%  L 4-4.5
assign (resid 34 and name HN) (resid 33 and name HN) 4.0 2.2 1.5    !# 302        60%

!G35
assign (resid 35 and name HN) (resid 33 and name HB#) 4.0 2.2 1.5   !# 304  23    30%  L 4-4.5
assign (resid 35 and name HN) (resid 36 and name HB) 4.0 2.2 1.5    !# 305  20    50%  L 4-4.5
assign (resid 35 and name HN) (resid 38 and name HB#) 4.0 2.2 1.5   !# 306  38    40%
assign (resid 35 and name HN) (resid 32 and name HB1) 4.0 2.2 1.5   !# 308  27    10%  L 4-4.5
assign (resid 35 and name HN) (resid 35 and name HA#) 3.0 1.2 1.5   !# 309 396   100%  L 2-3
assign (resid 35 and name HN) (resid 34 and name HA#) 4.0 2.2 1.5   !# 310        90%  L 3-4
assign (resid 35 and name HN) (resid 32 and name HA) 4.0 2.2 1.5    !# 311  31    20%
assign (resid 35 and name HN) (resid 32 and name HN) 4.0 2.2 1.5    !# 312  95    70%  L 3-4
assign (resid 35 and name HN) (resid 34 and name HN) 4.0 2.2 1.5    !# 313  99    90%  L 3-4
assign (resid 35 and name HN) (resid 38 and name HN) 4.0 2.2 1.5    !# 314  47    50%
assign (resid 35 and name HN) (resid 36 and name HN) 4.0 2.2 1.5    !# 315        50%

!V36
assign (resid 36 and name HN) (resid 36 and name HG2#) 3.0 1.2 1.5  !# 316 254   100%  L 2-3
assign (resid 36 and name HN) (resid 36 and name HG1#) 4.0 2.2 1.5  !# 317  95   100%  L 3-4
assign (resid 36 and name HN) (resid 36 and name HB) 3.0 1.2 1.5    !# 318 179   100%
assign (resid 36 and name HN) (resid 36 and name HA) 3.0 1.2 1.5    !# 319 174   100%
assign (resid 36 and name HN) (resid 35 and name HA#) 3.0 1.2 1.5   !# 320 153    80%
assign (resid 36 and name HN) (resid 32 and name HA) 4.0 2.2 1.5    !# 321  18    10%
assign (resid 36 and name HN) (resid 37 and name HN) 4.0 2.2 1.5    !# 322 152    70%  L 3-4
assign (resid 36 and name HN) (resid 35 and name HN) 4.0 2.2 1.5    !# 323        70%

!F37
assign (resid 37 and name HN) (resid 36 and name HG2#) 4.0 2.2 1.5  !# 324  74    80%
assign (resid 37 and name HN) (resid 36 and name HG1#) 4.0 2.2 1.5  !# 325  65    80%
assign (resid 37 and name HN) (resid 33 and name HB#) 4.0 2.2 1.5   !# 326  44    50%
assign (resid 37 and name HN) (resid 36 and name HB) 3.0 1.2 1.5    !# 327 110    60%
assign (resid 37 and name HN) (resid 37 and name HB#) 2.0 0.2 1.5   !# 328 372   100%  wL 3-2 L 2-3
assign (resid 37 and name HN) (resid 36 and name HA) 4.0 2.2 1.5    !# 330  49    70%
assign (resid 37 and name HN) (resid 34 and name HA#) 4.0 2.2 1.5   !# 331 116    60%   LENGTH CHECK
assign (resid 37 and name HN) (resid 37 and name HA) 3.0 1.2 1.5    !# 332 164   100%
assign (resid 37 and name HN) (resid 38 and name HA) 4.0 2.2 1.5    !# 333        90%  L 4-4.5
assign (resid 37 and name HN) (resid 37 and name HD1) 4.0 2.2 1.5   !# 334  20    20%  w HD#->HD1 L 4-4.5
assign (resid 37 and name HN) (resid 36 and name HN) 4.0 2.2 1.5    !# 335  90    80%  L 3-4
assign (resid 37 and name HN) (resid 38 and name HN) 4.0 2.2 1.5    !# 336 106    80%  L 3-4

!F38
assign (resid 38 and name HN) (resid 41 and name HD2#) 4.0 2.2 1.5  !# 337  25    20%  r 36-41  L 4-4.5
assign (resid 38 and name HN) (resid 41 and name HB#) 4.0 2.2 1.5   !# 339  26    30%  L 4-4.5
assign (resid 38 and name HN) (resid 38 and name HB#) 3.0 1.2 1.5   !# 340 450   100%  L 2-3
assign (resid 38 and name HN) (resid 37 and name HB#) 4.0 2.2 1.5   !# 341        90%
assign (resid 38 and name HN) (resid 34 and name HA#) 4.0 2.2 1.5   !# 343 102    50%  r 35-34  L 3-4
assign (resid 38 and name HN) (resid 38 and name HA) 3.0 1.2 1.5    !# 344 179   100%
assign (resid 38 and name HN) (resid 37 and name HD#) 4.0 2.2 1.5   !# 345  21    10%  L 4-4.5
assign (resid 38 and name HN) (resid 38 and name HD#) 4.0 2.2 1.5   !# 346  19    10%  L 4-4.5
assign (resid 38 and name HN) (resid 40 and name HN) 4.0 2.2 1.5    !# 348  19    20%  
assign (resid 38 and name HN) (resid 37 and name HN) 4.0 2.2 1.5    !# 349  72    80%
assign (resid 38 and name HN) (resid 39 and name HN) 4.0 2.2 1.5    !# 350        50%

!G39
assign (resid 39 and name HN) (resid 42 and name HD#) 4.0 2.2 1.5   !# 351  33    20%  w added r36-42 L4-4.5 
assign (resid 39 and name HN) (resid 42 and name HB#) 4.0 2.2 1.5   !# 352  24    20%  L 4-4.5
assign (resid 39 and name HN) (resid 38 and name HB#) 3.0 1.2 1.5   !# 354 126    80%
assign (resid 39 and name HN) (resid 39 and name HA2) 3.0 1.2 1.5   !# 355 229   100%  L 2-3
assign (resid 39 and name HN) (resid 39 and name HA1) 2.0 0.2 1.5   !# 356 268   100%
assign (resid 39 and name HN) (resid 38 and name HA) 4.0 2.2 1.5    !# 357  31    80%
assign (resid 39 and name HN) (resid 41 and name HN) 4.0 2.2 1.5    !# 358  23    40%  
assign (resid 39 and name HN) (resid 40 and name HN) 3.0 1.2 1.5    !# 359  93    80%  w L4->3 L 3-4
assign (resid 39 and name HN) (resid 37 and name HN) 4.0 2.2 1.5    !# 361  19    20%  w L4.5->4 L 4-4.5
assign (resid 39 and name HN) (resid 38 and name HN) 4.0 2.2 1.5    !# 362        50%

!T40
assign (resid 40 and name HN) (resid 36 and name HG2#) 4.0 2.2 1.5  !# 363  28    30%  w added L4-4.5 del
assign (resid 40 and name HN) (resid 36 and name HG1#) 4.0 2.2 1.5  !# 364  51    30%  L 4-4.5
assign (resid 40 and name HN) (resid 40 and name HG2#) 4.0 2.2 1.5  !# 365  88   100%  L 3-4
assign (resid 40 and name HN) (resid 41 and name HB#) 4.0 2.2 1.5   !# 366  31    30%  r 42-41 L 4-4.5
assign (resid 40 and name HN) (resid 43 and name HB#) 4.0 2.2 1.5   !# 367  63    50%  L 4-4.5
assign (resid 40 and name HN) (resid 36 and name HB) 4.0 2.2 1.5    !# 368  28    20%  w added r 44-36 L 4-4.5  delete
assign (resid 40 and name HN) (resid 37 and name HB#) 4.0 2.2 1.5   !# 369  27    40%  r 38-37 L 4-4.5
assign (resid 40 and name HN) (resid 39 and name HA#) 3.0 1.2 1.5   !# 370  91    80%  w HA1->HA# r #-1
assign (resid 40 and name HN) (resid 40 and name HA) 3.0 1.2 1.5    !# 371 235   100%  L 2-3
assign (resid 40 and name HN) (resid 40 and name HB) 3.0 1.2 1.5    !# 372 143    80%  w L4->3 r 41-37 L 3-4  r 37-40B
assign (resid 40 and name HN) (resid 40 and name HG1) 3.0 1.2 1.5   !# 373 243   100%  L 2-3  40A-40G1
assign (resid 40 and name HN) (resid 41 and name HN) 3.0 1.2 1.5    !# 374  74    80%  w L4->3
assign (resid 40 and name HN) (resid 37 and name HN) 4.0 2.2 1.5    !# 376  43    50%  w L4->4.5
assign (resid 40 and name HN) (resid 39 and name HN) 3.0 1.2 1.5    !# 377 107    80%  w L4->3 L 3-4

!L41
assign (resid 41 and name HN) (resid 41 and name HD#) 4.0 2.2 1.5   !# 378  96   100%  L 3-4
assign (resid 41 and name HN) (resid 40 and name HG2#) 4.0 2.2 1.5  !# 380  81    80%  L 3-4  r G#-G2#
assign (resid 41 and name HN) (resid 41 and name HB#) 3.0 1.2 1.5   !# 381 150   100%  w L3->2 L 2-3
assign (resid 41 and name HN) (resid 41 and name HA) 3.0 1.2 1.5    !#     220    60%  add
assign (resid 41 and name HN) (resid 37 and name HA) 3.0 1.2 1.5    !# 383  84    60%  w L4->3 r 38-37 L 3-4
assign (resid 41 and name HN) (resid 40 and name HB) 3.0 1.2 1.5    !# 384 149   100%  r 41-40
assign (resid 41 and name HN) (resid 43 and name HN) 4.0 2.2 1.5    !# 386 201    50%  L 3-4
assign (resid 41 and name HN) (resid 42 and name HN) 3.0 1.2 1.5    !# 387 185    80%  w L4->3 L 3-4
assign (resid 41 and name HN) (resid 39 and name HN) 4.0 2.2 1.5    !# 388  62    60%
assign (resid 41 and name HN) (resid 40 and name HN) 4.0 2.2 1.5    !# 389        50%

!L42
assign (resid 42 and name HN) (resid 42 and name HD#) 3.0 1.2 1.5   !# 390 139    80%  w L4->3 L 3-4
assign (resid 42 and name HN) (resid 42 and name HB#) 2.0 0.2 1.5   !# 391        80%  w L3->2
assign (resid 42 and name HN) (resid 38 and name HB#) 4.0 2.2 1.5   !# 393  36    50%  r 46-38  L 4-4.5
assign (resid 42 and name HN) (resid 39 and name HA#) 4.0 2.2 1.5   !# 394  57    50%  w HA1->HA# r #-1
assign (resid 42 and name HN) (resid 42 and name HA) 2.0 0.2 1.5    !# 395 214    80%  w L3->2 L 2-3
assign (resid 42 and name HN) (resid 41 and name HN) 3.0 1.2 1.5    !# 396 102    60%  w L4->3 L 3-4
assign (resid 42 and name HN) (resid 43 and name HN) 3.0 1.2 1.5    !# 397 118    60%  w L4->3 L 3-4
assign (resid 42 and name HN) (resid 44 and name HN) 4.0 2.2 1.5    !# 398  88    40%

!L43
assign (resid 43 and name HN) (resid 43 and name HD#) 4.0 2.2 1.5   !# 399  96   100%  L 3-4
assign (resid 43 and name HN) (resid 40 and name HG#) 4.0 2.2 1.5   !# 400  40    70%  L 4-4.5
assign (resid 43 and name HN) (resid 42 and name HB#) 3.0 1.2 1.5   !# 401  84    80%  w L4->3 L 3-4
assign (resid 43 and name HN) (resid 43 and name HB#) 2.0 0.2 1.5   !# 402 374   100%  w L3->2 L 2-3
assign (resid 43 and name HN) (resid 46 and name HB#) 4.0 2.2 1.5   !# 403  48    70%  L 4-4.5
assign (resid 43 and name HN) (resid 39 and name HA1) 4.0 2.2 1.5   !# 404  48    70%  
assign (resid 43 and name HN) (resid 39 and name HA2) 3.0 1.2 1.5   !# 405 111    70%  w L4.5->3 L 3-4.5
assign (resid 43 and name HN) (resid 43 and name HA) 2.0 0.2 1.5    !# 406 205   100%
assign (resid 43 and name HN) (resid 41 and name HN) 4.0 2.2 1.5    !# 408  51    70%
assign (resid 43 and name HN) (resid 42 and name HN) 4.0 2.2 1.5    !# 409 219    90%  L 3-4
assign (resid 43 and name HN) (resid 44 and name HN) 4.0 2.2 1.5    !# 410 161    90%  L 3-4
assign (resid 43 and name HN) (resid 46 and name HN) 4.0 2.2 1.5    !# 411  42    70%  L 4-4.5

!I44
assign (resid 44 and name HN) (resid 44 and name HD#) 4.0 2.2 1.5   !# 412  32    90%
assign (resid 44 and name HN) (resid 43 and name HD#) 4.0 2.2 1.5   !# 413 110    90%  L 3-4
assign (resid 44 and name HN) (resid 44 and name HG2#) 3.0 1.2 1.5  !# 414 131    90%
assign (resid 44 and name HN) (resid 44 and name HG1#) 4.0 2.2 1.5  !# 415 119    90%  L 3-4
assign (resid 44 and name HN) (resid 43 and name HB#) 4.0 2.2 1.5   !# 417 214    90%  L 3-4
assign (resid 44 and name HN) (resid 44 and name HB) 3.0 1.2 1.5    !# 418 212    90%  L 2-3
assign (resid 44 and name HN) (resid 47 and name HB) 4.0 2.2 1.5    !# 419  51    50%  r 48-47  L 4-4.5
assign (resid 44 and name HN) (resid 44 and name HA) 3.0 1.2 1.5    !# 420 236    90%  L 2-3
assign (resid 44 and name HN) (resid 40 and name HA) 4.0 2.2 1.5    !# 421 107    50%  r B-A  L 4-4.5
assign (resid 44 and name HN) (resid 43 and name HA) 4.0 2.2 1.5    !# 422  53    90%
assign (resid 44 and name HN) (resid 43 and name HN) 4.0 2.2 1.5    !# 423 102    90%  L 3-4
assign (resid 44 and name HN) (resid 45 and name HN) 4.0 2.2 1.5    !# 424        50%

!G45
assign (resid 45 and name HN) (resid 44 and name HD#) 4.0 2.2 1.5   !# 426  53    30%  w r43->44 L 4-4.5
assign (resid 45 and name HN) (resid 44 and name HG2#) 4.0 2.2 1.5  !# 427  62    70%
assign (resid 45 and name HN) (resid 44 and name HG1#) 4.0 2.2 1.5  !# 428  28    70%  L 4-4.5
assign (resid 45 and name HN) (resid 42 and name HB#) 4.0 2.2 1.5   !# 429  40    50%  w r41->42 r 42-41  L 4-4.5
assign (resid 45 and name HN) (resid 41 and name HB#) 4.0 2.2 1.5   !# 430  46    30%  w r43->41 L 4-4.5
assign (resid 45 and name HN) (resid 44 and name HB) 3.0 1.2 1.5    !# 431  96    70%  w L4->3 L 3-4
assign (resid 45 and name HN) (resid 48 and name HD#) 4.0 2.2 1.5   !# 432  43    80%  w r46B->48D L 4-4.5
assign (resid 45 and name HN) (resid 45 and name HA#) 3.0 1.2 1.5   !# 433 238   100%  L 2-3
assign (resid 45 and name HN) (resid 43 and name HN) 4.0 2.2 1.5    !# 434  23    50%
assign (resid 45 and name HN) (resid 42 and name HN) 4.0 2.2 1.5    !# 435  23    50%  L 4-4.5
assign (resid 45 and name HN) (resid 46 and name HN) 4.0 2.2 1.5    !# 436 131    80%
assign (resid 45 and name HN) (resid 44 and name HN) 4.0 2.2 1.5    !# 437        50%

!F46
assign (resid 46 and name HN) (resid 42 and name HD1#) 4.0 2.2 1.5  !# 438  47    50%  r 49-42 D-D1  L 4-4.5
assign (resid 46 and name HN) (resid 42 and name HB#) 4.0 2.2 1.5   !# 439  24    20%  L 4-4.5
assign (resid 46 and name HN) (resid 43 and name HB#) 4.0 2.2 1.5   !# 440  29    30%  w added L 4-4.5
assign (resid 46 and name HN) (resid 46 and name HB#) 3.0 1.2 1.5   !# 443 429   100%
assign (resid 46 and name HN) (resid 47 and name HB#) 4.0 2.2 1.5   !# 444        90%  L 4-4.5
assign (resid 46 and name HN) (resid 45 and name HA#) 4.0 2.2 1.5   !# 445 108    90%  L 3-4
assign (resid 46 and name HN) (resid 43 and name HA) 4.0 2.2 1.5    !# 446  92    60%  L 4-4.5
assign (resid 46 and name HN) (resid 46 and name HA) 3.0 1.2 1.5    !# 447 122   100%
assign (resid 46 and name HN) (resid 46 and name HD#) 4.0 2.2 1.5   !# 448  22    20%  L 4-4.5
assign (resid 46 and name HN) (resid 43 and name HN) 4.0 2.2 1.5    !# 449  28    50%  L 4-4.5
assign (resid 46 and name HN) (resid 45 and name HN) 4.0 2.2 1.5    !# 451 181    90%  L 3-4
assign (resid 46 and name HN) (resid 47 and name HN) 4.0 2.2 1.5    !# 452        50%

!F47
assign (resid 47 and name HN) (resid 50 and name HG2#) 4.0 2.2 1.5  !# 453  28    50%  L 4-4.5
assign (resid 47 and name HN) (resid 43 and name HD#) 4.0 2.2 1.5   !# 454  58    40%  r 49-43  L 4-4.5
assign (resid 47 and name HN) (resid 43 and name HB#) 4.0 2.2 1.5   !# 457  29    70%  w r48->43 L 4-4.5
assign (resid 47 and name HN) (resid 50 and name HB) 4.0 2.2 1.5    !# 458  47    50%  L 4-4.5
assign (resid 47 and name HN) (resid 47 and name HB#) 3.0 1.2 1.5   !# 460 429   100%
assign (resid 47 and name HN) (resid 46 and name HB#) 4.0 2.2 1.5   !# 461        90%
assign (resid 47 and name HN) (resid 45 and name HA#) 4.0 2.2 1.5   !# 462  77    40%  L 4-4.5
assign (resid 47 and name HN) (resid 47 and name HA) 3.0 1.2 1.5    !# 463 224   100%
assign (resid 47 and name HN) (resid 46 and name HA) 4.0 2.2 1.5    !# 464  58    90%
assign (resid 47 and name HN) (resid 46 and name HD#) 4.0 2.2 1.5   !# 465  29    20%  L 4-4.5
assign (resid 47 and name HN) (resid 47 and name HD#) 4.0 2.2 1.5   !# 466  40    30%  L 4-4.5
assign (resid 47 and name HN) (resid 48 and name HN) 4.0 2.2 1.5    !# 467 168    90%  L 3-4
assign (resid 47 and name HN) (resid 46 and name HN) 4.0 2.2 1.5    !# 468 118    90%  L 3-4

!R48
assign (resid 48 and name HN) (resid 44 and name HD#) 4.0 2.2 1.5   !# 469  61    80%  r49-44  L 4-4.5
assign (resid 48 and name HN) (resid 48 and name HG#) 4.0 2.2 1.5   !# 472  66    90%
assign (resid 48 and name HN) (resid 48 and name HB#) 3.0 1.2 1.5   !# 473 245   100%
assign (resid 48 and name HN) (resid 48 and name HD#) 4.0 2.2 1.5   !# 474  94    90%
assign (resid 48 and name HN) (resid 45 and name HA#) 4.0 2.2 1.5   !# 475 105    60%  L 4-4.5
assign (resid 48 and name HN) (resid 48 and name HA) 3.0 1.2 1.5    !# 476 211   100%  L 2-3
assign (resid 48 and name HN) (resid 47 and name HA) 4.0 2.2 1.5    !# 477  52    80%
assign (resid 48 and name HN) (resid 49 and name HN) 4.0 2.2 1.5    !# 478 100    80%
assign (resid 48 and name HN) (resid 47 and name HN) 4.0 2.2 1.5    !# 479        80%

!V49
assign (resid 49 and name HN) (resid 50 and name HG2#) 4.0 2.2 1.5  !# 480  45    80%  L 4-4.5
assign (resid 49 and name HN) (resid 49 and name HG2#) 4.0 2.2 1.5  !# 482  99   100%  L 3-4
assign (resid 49 and name HN) (resid 49 and name HG1#) 3.0 1.2 1.5  !# 483 196   100%
assign (resid 49 and name HN) (resid 48 and name HG#) 4.0 2.2 1.5   !# 484  24    80%
assign (resid 49 and name HN) (resid 50 and name HB) 4.0 2.2 1.5    !# 485  46    80%  L 4-4.5
assign (resid 49 and name HN) (resid 48 and name HB#) 4.0 2.2 1.5   !# 486  77    80%
assign (resid 49 and name HN) (resid 49 and name HB) 3.0 1.2 1.5    !# 487 177   100%
assign (resid 49 and name HN) (resid 48 and name HD#) 4.0 2.2 1.5   !# 488  28    80%
assign (resid 49 and name HN) (resid 49 and name HA) 3.0 1.2 1.5    !# 490 132   100%
assign (resid 49 and name HN) (resid 45 and name HA#) 4.0 2.2 1.5   !# 491  26    10%
assign (resid 49 and name HN) (resid 48 and name HA) 4.0 2.2 1.5    !# 492  41    80%
assign (resid 49 and name HN) (resid 46 and name HA) 4.0 2.2 1.5    !# 493  43    30%  L 4-4.5
assign (resid 49 and name HN) (resid 52 and name HN) 4.0 2.2 1.5    !# 494  20    50%
assign (resid 49 and name HN) (resid 50 and name HN) 4.0 2.2 1.5    !# 495 117    80%  L 3-4
assign (resid 49 and name HN) (resid 51 and name HN) 4.0 2.2 1.5    !# 496  54    50%
assign (resid 49 and name HN) (resid 48 and name HN) 4.0 2.2 1.5    !# 497  98    80%  L 3-4

!V50
assign (resid 50 and name HN) (resid 50 and name HG2#) 3.0 1.2 1.5  !# 498 221   100%
assign (resid 50 and name HN) (resid 50 and name HG1#) 4.0 2.2 1.5  !# 499  70   100%  L 4-4.5
assign (resid 50 and name HN) (resid 49 and name HG2#) 4.0 2.2 1.5  !# 500  57    80%  L 4-4.5
assign (resid 50 and name HN) (resid 49 and name HG1#) 4.0 2.2 1.5  !# 501  40    80%  L 4-4.5
assign (resid 50 and name HN) (resid 50 and name HB) 3.0 1.2 1.5    !# 503 160   100%
assign (resid 50 and name HN) (resid 49 and name HB) 4.0 2.2 1.5    !# 505 104    80%
assign (resid 50 and name HN) (resid 50 and name HA) 3.0 1.2 1.5    !# 507 162   100%
assign (resid 50 and name HN) (resid 49 and name HA) 4.0 2.2 1.5    !# 508  26    80%
assign (resid 50 and name HN) (resid 47 and name HA) 4.0 2.2 1.5    !# 509  42    50%
assign (resid 50 and name HN) (resid 46 and name HA) 4.0 2.2 1.5    !# 510  39    50%
assign (resid 50 and name HN) (resid 52 and name HN) 4.0 2.2 1.5    !# 511  23    50%
assign (resid 50 and name HN) (resid 49 and name HN) 4.0 2.2 1.5    !# 512  91    80%
assign (resid 50 and name HN) (resid 48 and name HN) 4.0 2.2 1.5    !# 513  45    50%
assign (resid 50 and name HN) (resid 51 and name HN) 4.0 2.2 1.5    !# 514        50%

!G51
assign (resid 51 and name HN) (resid 50 and name HG2#) 4.0 2.2 1.5  !# 515  48    80%
assign (resid 51 and name HN) (resid 50 and name HG1#) 4.0 2.2 1.5  !# 516  42    80%
assign (resid 51 and name HN) (resid 50 and name HB) 4.0 2.2 1.5    !# 518  82    80%
assign (resid 51 and name HN) (resid 47 and name HB#) 4.0 2.2 1.5   !# 519  27    50%  L 4-4.5
assign (resid 51 and name HN) (resid 50 and name HA) 4.0 2.2 1.5    !# 520  59    80%
assign (resid 51 and name HN) (resid 51 and name HA2) 2.0 0.2 1.5   !# 521 202   100%
assign (resid 51 and name HN) (resid 51 and name HA1) 3.0 1.2 1.5   !# 522 167    80%
assign (resid 51 and name HN) (resid 48 and name HA) 4.0 2.2 1.5    !# 523  35    50%
assign (resid 51 and name HN) (resid 47 and name HA) 4.0 2.2 1.5    !# 524  33    50%
assign (resid 51 and name HN) (resid 52 and name HN) 4.0 2.2 1.5    !# 525  73    80%
assign (resid 51 and name HN) (resid 49 and name HN) 4.0 2.2 1.5    !# 526  42    60%
assign (resid 51 and name HN) (resid 50 and name HN) 4.0 2.2 1.5    !# 527 109    80%
assign (resid 51 and name HN) (resid 48 and name HN) 4.0 2.2 1.5    !# 528  79    60%  L 4-4.5

!R52
assign (resid 52 and name HN) (resid 49 and name HG2#) 4.0 2.2 1.5  !# 530  21    50%  L 4-4.5
assign (resid 52 and name HN) (resid 52 and name HB#) 3.0 1.2 1.5   !# 531 160   100%
assign (resid 52 and name HN) (resid 51 and name HA2) 4.0 2.2 1.5   !# 532  94    80%  L 3-4
assign (resid 52 and name HN) (resid 51 and name HA1) 4.0 2.2 1.5   !# 533  36    80%
assign (resid 52 and name HN) (resid 48 and name HA) 4.0 2.2 1.5    !# 534  20    50%
assign (resid 52 and name HN) (resid 52 and name HA) 3.0 1.2 1.5    !# 535 155   100%
assign (resid 52 and name HN) (resid 53 and name HN) 4.0 2.2 1.5    !# 536 124    80%  L 3-4
assign (resid 52 and name HN) (resid 50 and name HN) 4.0 2.2 1.5    !# 537  25    60%
assign (resid 52 and name HN) (resid 51 and name HN) 4.0 2.2 1.5    !# 538  78    80%
assign (resid 52 and name HN) (resid 48 and name HN) 4.0 2.2 1.5    !# 539  26    30%  L 4-4.5

!M53
assign (resid 53 and name HN) (resid 49 and name HG2#) 4.0 2.2 1.5  !# 541  36    50%  L 4-4.5
assign (resid 53 and name HN) (resid 54 and name HB#) 4.0 2.2 1.5   !# 543  26    80%  L 4-4.5
assign (resid 53 and name HN) (resid 55 and name HG#) 4.0 2.2 1.5   !# 544  61    10%  L 4-4.5
assign (resid 53 and name HN) (resid 52 and name HB#) 4.0 2.2 1.5   !# 545  92    80%
assign (resid 53 and name HN) (resid 53 and name HB#) 3.0 1.2 1.5   !# 546 154   100%
assign (resid 53 and name HN) (resid 53 and name HG#) 4.0 2.2 1.5   !# 547  43    80%
assign (resid 53 and name HN) (resid 50 and name HA) 4.0 2.2 1.5    !# 548  28    50%
assign (resid 53 and name HN) (resid 51 and name HA2) 4.0 2.2 1.5   !# 549  45    30%  L 4-4.5
assign (resid 53 and name HN) (resid 51 and name HA1) 4.0 2.2 1.5   !# 550  56    30%  L 4-4.5
assign (resid 53 and name HN) (resid 52 and name HA) 4.0 2.2 1.5    !# 551  43    80%
assign (resid 53 and name HN) (resid 53 and name HA) 3.0 1.2 1.5    !# 552 156   100%
assign (resid 53 and name HN) (resid 52 and name HN) 4.0 2.2 1.5    !# 553 101    80%
assign (resid 53 and name HN) (resid 54 and name HN) 4.0 2.2 1.5    !# 554        50%
assign (resid 53 and name HN) (resid 51 and name HN) 4.0 2.2 1.5    !# 555  80    60%

!L54
assign (resid 54 and name HN) (resid 54 and name HD#) 4.0 2.2 1.5   !# 556  54   100%
assign (resid 54 and name HN) (resid 54 and name HG) 4.0 2.2 1.5    !# 557  19    10%
assign (resid 54 and name HN) (resid 54 and name HB#) 4.0 2.2 1.5   !# 558  82   100%
assign (resid 54 and name HN) (resid 55 and name HG#) 4.0 2.2 1.5   !# 559 176    10%  L 3-4.5
assign (resid 54 and name HN) (resid 53 and name HB#) 4.0 2.2 1.5   !# 560  52    80%
assign (resid 54 and name HN) (resid 55 and name HD#) 4.0 2.2 1.5   !# 562 114    50%  L 4-4.5
assign (resid 54 and name HN) (resid 54 and name HA) 3.0 1.2 1.5    !# 563 110   100%
assign (resid 54 and name HN) (resid 53 and name HA) 4.0 2.2 1.5    !# 564  57    80%
assign (resid 54 and name HN) (resid 53 and name HN) 4.0 2.2 1.5    !# 565        50%
assign (resid 54 and name HN) (resid 51 and name HN) 4.0 2.2 1.5    !# 566  30    50%  L 4-4.5

!P55

!I56
assign (resid 56 and name HN) (resid 56 and name HG2#) 4.0 2.2 1.5  !# 567  53   100%
assign (resid 56 and name HN) (resid 56 and name HG1#) 4.0 2.2 1.5  !# 568  27    50%
assign (resid 56 and name HN) (resid 54 and name HB#) 4.0 2.2 1.5   !# 569  52    50%  L 4-4.5
assign (resid 56 and name HN) (resid 55 and name HG#) 4.0 2.2 1.5   !# 570  26    30%
assign (resid 56 and name HN) (resid 55 and name HD#) 4.0 2.2 1.5   !# 571  36    50%
assign (resid 56 and name HN) (resid 56 and name HA) 4.0 2.2 1.5    !# 572  59   100%
assign (resid 56 and name HN) (resid 54 and name HA) 4.0 2.2 1.5    !# 573  30    20%  L 4-4.5
assign (resid 56 and name HN) (resid 57 and name HN) 4.0 2.2 1.5    !# 576  57    80%

!Q57
assign (resid 57 and name HN) (resid 56 and name HG2#) 4.0 2.2 1.5  !# 577 114    80%  L 3-4
assign (resid 57 and name HN) (resid 56 and name HG1#) 4.0 2.2 1.5  !# 578  35    80%  L 4-4.5
assign (resid 57 and name HN) (resid 57 and name HB#) 3.0 1.2 1.5   !# 579 233   100%
assign (resid 57 and name HN) (resid 57 and name HG#) 4.0 2.2 1.5   !# 580  55   100%
assign (resid 57 and name HN) (resid 56 and name HA) 4.0 2.2 1.5    !# 581  72    80%
assign (resid 57 and name HN) (resid 57 and name HA) 3.0 1.2 1.5    !# 582 188   100%
assign (resid 57 and name HN) (resid 56 and name HN) 4.0 2.2 1.5    !# 584 118    80%  L 3-4
assign (resid 57 and name HN) (resid 58 and name HN) 4.0 2.2 1.5    !# 585 176    80%  L 3-4

!E58
assign (resid 58 and name HN) (resid 56 and name HG2#) 4.0 2.2 1.5  !# 586  23    30%  L 4-4.5
assign (resid 58 and name HN) (resid 58 and name HB#) 3.0 1.2 1.5   !# 588 121   100%
assign (resid 58 and name HN) (resid 58 and name HG#) 4.0 2.2 1.5   !# 589  28    60%
assign (resid 58 and name HN) (resid 56 and name HA) 4.0 2.2 1.5    !# 590  38    30%  L 4-4.5
assign (resid 58 and name HN) (resid 58 and name HA) 3.0 1.2 1.5    !# 591  95   100%
assign (resid 58 and name HN) (resid 54 and name HA) 4.0 2.2 1.5    !# 592  48    50%  L 4-4.5
assign (resid 58 and name HN) (resid 59 and name HN) 4.0 2.2 1.5    !# 593  72    80%
assign (resid 58 and name HN) (resid 57 and name HN) 4.0 2.2 1.5    !# 594        80%

!N59
assign (resid 59 and name HN) (resid 58 and name HB#) 4.0 2.2 1.5   !# 595  62    80%
assign (resid 59 and name HN) (resid 58 and name HG#) 4.0 2.2 1.5   !# 596  23    50%
assign (resid 59 and name HN) (resid 59 and name HB#) 4.0 2.2 1.5   !# 597 131   100%  L 3-4
assign (resid 59 and name HN) (resid 58 and name HA) 4.0 2.2 1.5    !# 599  51    80%
assign (resid 59 and name HN) (resid 60 and name HA) 4.0 2.2 1.5    !# 600  22    80%  L 4-4.5
assign (resid 59 and name HN) (resid 59 and name HA) 3.0 1.2 1.5    !# 601 154   100%
assign (resid 59 and name HN) (resid 60 and name HN) 4.0 2.2 1.5    !# 602  38    80%
assign (resid 59 and name HN) (resid 58 and name HN) 4.0 2.2 1.5    !# 604  95    80%

!Q60
assign (resid 60 and name HN) (resid 60 and name HB#) 4.0 2.2 1.5   !# 605  80   100%
assign (resid 60 and name HN) (resid 60 and name HG2) 4.0 2.2 1.5   !# 606  46    80%
assign (resid 60 and name HN) (resid 60 and name HG1) 4.0 2.2 1.5   !# 607  45    80%
assign (resid 60 and name HN) (resid 59 and name HB#) 4.0 2.2 1.5   !# 608  26    80%
assign (resid 60 and name HN) (resid 58 and name HA) 4.0 2.2 1.5    !# 609  40    40%  L 4-4.5
assign (resid 60 and name HN) (resid 60 and name HA) 4.0 2.2 1.5    !# 610  84   100%
assign (resid 60 and name HN) (resid 59 and name HA) 4.0 2.2 1.5    !# 611  50    80%
assign (resid 60 and name HN) (resid 59 and name HN) 4.0 2.2 1.5    !# 612  21    80%
assign (resid 60 and name HN) (resid 61 and name HN) 4.0 2.2 1.5    !# 614        50%

!A61
assign (resid 61 and name HN) (resid 61 and name HB#) 3.0 1.2 1.5   !# 615 218   100%
assign (resid 61 and name HN) (resid 62 and name HD#) 4.0 2.2 1.5   !# 616  47    60%  L 4-4.5
assign (resid 61 and name HN) (resid 61 and name HA) 2.0 0.2 1.5    !# 617  77   100%
assign (resid 61 and name HN) (resid 60 and name HN) 4.0 2.2 1.5    !# 619        50%

!P62

!A63
assign (resid 63 and name HN) (resid 63 and name HB#) 3.0 1.2 1.5   !# 620 158   100%
assign (resid 63 and name HN) (resid 62 and name HG#) 4.0 2.2 1.5   !# 621  53    60%
assign (resid 63 and name HN) (resid 62 and name HD#) 4.0 2.2 1.5   !# 622  25    60%
assign (resid 63 and name HN) (resid 64 and name HD#) 4.0 2.2 1.5   !# 623  44    60%  L 4-4.5
assign (resid 63 and name HN) (resid 63 and name HA) 2.0 0.2 1.5    !# 624 213   100%
assign (resid 63 and name HN) (resid 61 and name HN) 4.0 2.2 1.5    !# 625  46    80%  L 4-4.5

!P64

!N65
assign (resid 65 and name HN) (resid 65 and name HB1) 4.0 2.2 1.5   !# 626  55   100%
assign (resid 65 and name HN) (resid 65 and name HB2) 4.0 2.2 1.5   !# 627  44   100%
assign (resid 65 and name HN) (resid 65 and name HA) 4.0 2.2 1.5    !# 628  49   100%
assign (resid 65 and name HN) (resid 66 and name HN) 4.0 2.2 1.5    !# 629  49   100%

!I66
assign (resid 66 and name HN) (resid 66 and name HG2#) 4.0 2.2 1.5  !# 630  44   100%
assign (resid 66 and name HN) (resid 67 and name HG2#) 4.0 2.2 1.5  !# 631  39    80%  L 4-4.5
assign (resid 66 and name HN) (resid 66 and name HG12) 4.0 2.2 1.5  !# 632  36   100%
assign (resid 66 and name HN) (resid 66 and name HG11) 4.0 2.2 1.5  !# 633  70   100%
assign (resid 66 and name HN) (resid 66 and name HB) 3.0 1.2 1.5    !# 634 167   100%
assign (resid 66 and name HN) (resid 65 and name HB#) 4.0 2.2 1.5   !# 635  34    80%
assign (resid 66 and name HN) (resid 66 and name HA) 3.0 1.2 1.5    !# 636 102   100%
assign (resid 66 and name HN) (resid 64 and name HA) 4.0 2.2 1.5    !# 637  37    60%  L 4-4.5
assign (resid 66 and name HN) (resid 65 and name HA) 4.0 2.2 1.5    !# 638  83    80%
assign (resid 66 and name HN) (resid 67 and name HN) 4.0 2.2 1.5    !# 639  98    80%
assign (resid 66 and name HN) (resid 65 and name HN) 4.0 2.2 1.5    !# 640        50%

!T67
assign (resid 67 and name HN) (resid 66 and name HG2#) 4.0 2.2 1.5  !# 641  44    80%
assign (resid 67 and name HN) (resid 67 and name HG2#) 4.0 2.2 1.5  !# 642  56   100%
assign (resid 67 and name HN) (resid 66 and name HB) 4.0 2.2 1.5    !# 643  97    80%
assign (resid 67 and name HN) (resid 67 and name HA) 3.0 1.2 1.5    !# 644 141   100%
assign (resid 67 and name HN) (resid 67 and name HB) 4.0 2.2 1.5    !# 645  95    80%
assign (resid 67 and name HN) (resid 67 and name HG1) 4.0 2.2 1.5   !#     141    80%  add
assign (resid 67 and name HN) (resid 68 and name HN) 4.0 2.2 1.5    !# 646 180    80%  L 3-4
assign (resid 67 and name HN) (resid 66 and name HN) 4.0 2.2 1.5    !# 647        50%

!G68
assign (resid 68 and name HN) (resid 67 and name HG2#) 4.0 2.2 1.5  !# 648  19    20%
assign (resid 68 and name HN) (resid 68 and name HA#) 3.0 1.2 1.5   !# 650 273   100%  L 2-3
assign (resid 68 and name HN) (resid 67 and name HB) 4.0 2.2 1.5    !# 651  46    80%
assign (resid 68 and name HN) (resid 67 and name HN) 4.0 2.2 1.5    !# 652 113    80%  L 3-4
assign (resid 68 and name HN) (resid 69 and name HN) 4.0 2.2 1.5    !# 654        50%

!A69
assign (resid 69 and name HN) (resid 69 and name HB#) 3.0 1.2 1.5   !# 656 203   100%
assign (resid 69 and name HN) (resid 68 and name HA#) 4.0 2.2 1.5   !# 657 102    80%  L 3-4
assign (resid 69 and name HN) (resid 69 and name HA) 3.0 1.2 1.5    !# 658 104   100%
assign (resid 69 and name HN) (resid 70 and name HN) 4.0 2.2 1.5    !# 659 200    80%  L 3-4
assign (resid 69 and name HN) (resid 68 and name HN) 4.0 2.2 1.5    !# 660        50%

!L70
assign (resid 70 and name HN) (resid 70 and name HD#) 4.0 2.2 1.5   !# 661  41   100%
assign (resid 70 and name HN) (resid 70 and name HB2) 3.0 1.2 1.5   !# 662 164   100%
assign (resid 70 and name HN) (resid 70 and name HG) 4.0 2.2 1.5    !# 663  82   100%
assign (resid 70 and name HN) (resid 70 and name HB1) 4.0 2.2 1.5   !# 664 128   100%
assign (resid 70 and name HN) (resid 70 and name HA) 3.0 1.2 1.5    !# 665 115   100%
assign (resid 70 and name HN) (resid 69 and name HN) 4.0 2.2 1.5    !# 666 109    80%  L 3-4
assign (resid 70 and name HN) (resid 71 and name HN) 4.0 2.2 1.5    !# 667        50%

!E71
assign (resid 71 and name HN) (resid 70 and name HB2) 4.0 2.2 1.5   !# 668  33    80%
assign (resid 71 and name HN) (resid 70 and name HB1) 4.0 2.2 1.5   !# 669  46    80%
assign (resid 71 and name HN) (resid 71 and name HB#) 4.0 2.2 1.5   !# 670  50   100%
assign (resid 71 and name HN) (resid 71 and name HG#) 4.0 2.2 1.5   !# 671  20    80%
assign (resid 71 and name HN) (resid 71 and name HA) 4.0 2.2 1.5    !# 672  48   100%
assign (resid 71 and name HN) (resid 70 and name HN) 4.0 2.2 1.5    !# 674        50%

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1          1HT       ALA   1  -9.428 -53.572  16.219
    2   2H    ALA   1          2HT       ALA   1  -8.458 -53.353  17.619
    3   3H    ALA   1          3HT       ALA   1  -7.745 -53.285  16.061
    4    HA   ALA   1           HA       ALA   1  -9.806 -51.467  16.072
    5   1HB   ALA   1          1HB       ALA   1  -9.126 -51.842  18.679
    6   2HB   ALA   1          2HB       ALA   1  -9.783 -50.346  18.017
    7   3HB   ALA   1          3HB       ALA   1  -8.041 -50.532  18.217
    8    H    ASP   2           H        ASP   2  -9.083 -50.403  14.351
    9    HA   ASP   2           HA       ASP   2  -6.579 -49.010  14.435
   10   1HB   ASP   2          2HB       ASP   2  -6.048 -51.415  13.680
   11   2HB   ASP   2          1HB       ASP   2  -6.862 -50.987  12.179
   12    H    LYS   3           H        LYS   3  -8.551 -50.260  11.744
   13    HA   LYS   3           HA       LYS   3  -8.843 -47.544  10.731
   14   1HB   LYS   3          2HB       LYS   3  -8.200 -49.555   9.298
   15   2HB   LYS   3          1HB       LYS   3  -9.873 -50.073   9.457
   16   1HG   LYS   3          2HG       LYS   3 -10.605 -48.572   7.971
   17   2HG   LYS   3          1HG       LYS   3  -9.562 -47.297   8.598
   18   1HD   LYS   3          2HD       LYS   3  -7.646 -48.577   7.471
   19   2HD   LYS   3          1HD       LYS   3  -8.913 -49.445   6.603
   20   1HE   LYS   3          2HE       LYS   3  -8.132 -47.602   5.258
   21   2HE   LYS   3          1HE       LYS   3  -9.786 -47.289   5.783
   22   1HZ   LYS   3          1HZ       LYS   3  -8.522 -46.068   7.720
   23   2HZ   LYS   3          2HZ       LYS   3  -8.835 -45.295   6.250
   24   3HZ   LYS   3          3HZ       LYS   3  -7.303 -45.946   6.553
   25    H    THR   4           H        THR   4 -10.799 -50.201  11.948
   26    HA   THR   4           HA       THR   4 -13.313 -49.010  11.384
   27    HB   THR   4           HB       THR   4 -12.732 -51.067  13.519
   28    HG1  THR   4           1HG      THR   4 -11.909 -51.584  11.349
   29   1HG2  THR   4          1HG2      THR   4 -15.186 -50.186  12.096
   30   2HG2  THR   4          2HG2      THR   4 -14.955 -50.630  13.788
   31   3HG2  THR   4          3HG2      THR   4 -15.019 -51.882  12.547
   32    H    ILE   5           H        ILE   5 -14.084 -47.237  12.278
   33    HA   ILE   5           HA       ILE   5 -14.391 -45.493  13.721
   34    HB   ILE   5           HB       ILE   5 -14.502 -47.662  15.815
   35   1HG1  ILE   5          2HG1      ILE   5 -15.872 -48.303  13.890
   36   2HG1  ILE   5          1HG1      ILE   5 -16.892 -47.857  15.255
   37   1HG2  ILE   5          1HG2      ILE   5 -14.648 -45.625  16.923
   38   2HG2  ILE   5          2HG2      ILE   5 -16.337 -46.052  16.657
   39   3HG2  ILE   5          3HG2      ILE   5 -15.554 -44.865  15.614
   40   1HD1  ILE   5          1HD1      ILE   5 -17.935 -46.363  14.010
   41   2HD1  ILE   5          2HD1      ILE   5 -16.957 -46.858  12.628
   42   3HD1  ILE   5          3HD1      ILE   5 -16.411 -45.543  13.668
   43    H    PHE   6           H        PHE   6 -11.826 -45.436  13.197
   44    HA   PHE   6           HA       PHE   6 -10.656 -44.540  15.673
   45   1HB   PHE   6          2HB       PHE   6  -9.987 -47.140  14.624
   46   2HB   PHE   6          1HB       PHE   6  -8.572 -46.094  14.584
   47    HD1  PHE   6           1HD      PHE   6 -11.007 -47.782  16.722
   48    HD2  PHE   6           2HD      PHE   6  -7.582 -45.256  16.622
   49    HE1  PHE   6           1HE      PHE   6 -10.649 -48.177  19.125
   50    HE2  PHE   6           2HE      PHE   6  -7.219 -45.646  19.024
   51    HZ   PHE   6           HZ       PHE   6  -8.753 -47.108  20.279
   52    H    ASN   7           H        ASN   7  -9.183 -45.572  12.605
   53    HA   ASN   7           HA       ASN   7  -8.186 -44.402  10.923
   54   1HB   ASN   7          2HB       ASN   7 -10.256 -42.726  11.650
   55   2HB   ASN   7          1HB       ASN   7  -8.844 -41.685  11.810
   56   1HD2  ASN   7          1HD2      ASN   7 -10.628 -43.753   9.605
   57   2HD2  ASN   7          2HD2      ASN   7 -10.052 -43.015   8.153
   58    H    ASP   8           H        ASP   8  -8.016 -41.951  13.493
   59    HA   ASP   8           HA       ASP   8  -6.266 -41.016  14.597
   60   1HB   ASP   8          2HB       ASP   8  -6.017 -43.657  15.015
   61   2HB   ASP   8          1HB       ASP   8  -4.497 -43.363  14.177
   62    H    HIS   9           H        HIS   9  -4.438 -39.814  14.228
   63    HA   HIS   9           HA       HIS   9  -2.700 -38.849  13.126
   64   1HB   HIS   9          2HB       HIS   9  -2.848 -41.431  11.631
   65   2HB   HIS   9          1HB       HIS   9  -1.912 -40.110  10.944
   66    HD1  HIS   9           1HD      HIS   9  -1.523 -42.939  13.049
   67    HD2  HIS   9           2HD      HIS   9   0.013 -39.077  13.047
   68    HE1  HIS   9           1HE      HIS   9   0.549 -43.038  14.471
   69    HE2  HIS   9           2HE      HIS   9   1.498 -40.706  14.402
   70    H    LEU  10           H        LEU  10  -2.290 -37.512  11.297
   71    HA   LEU  10           HA       LEU  10  -4.688 -36.504  10.109
   72   1HB   LEU  10          2HB       LEU  10  -1.892 -35.696  10.338
   73   2HB   LEU  10          1HB       LEU  10  -2.563 -35.329   8.760
   74    HG   LEU  10           HG       LEU  10  -4.424 -34.110   9.893
   75   1HD1  LEU  10          1HD1      LEU  10  -4.296 -35.275  12.046
   76   2HD1  LEU  10          2HD1      LEU  10  -4.195 -33.525  12.236
   77   3HD1  LEU  10          3HD1      LEU  10  -2.738 -34.511  12.359
   78   1HD2  LEU  10          1HD2      LEU  10  -3.233 -32.240   9.671
   79   2HD2  LEU  10          2HD2      LEU  10  -1.845 -33.279   9.351
   80   3HD2  LEU  10          3HD2      LEU  10  -2.143 -32.683  10.984
   81    H    ASN  11           H        ASN  11  -2.079 -38.593   9.106
   82    HA   ASN  11           HA       ASN  11  -1.731 -39.854   7.250
   83   1HB   ASN  11          2HB       ASN  11  -4.566 -39.803   7.667
   84   2HB   ASN  11          1HB       ASN  11  -4.250 -39.793   5.935
   85   1HD2  ASN  11          1HD2      ASN  11  -5.109 -41.883   5.758
   86   2HD2  ASN  11          2HD2      ASN  11  -4.216 -43.272   6.265
   87    H    THR  12           H        THR  12  -1.312 -37.006   7.129
   88    HA   THR  12           HA       THR  12  -0.643 -35.458   5.603
   89    HB   THR  12           HB       THR  12  -1.388 -37.163   3.277
   90    HG1  THR  12           1HG      THR  12   0.969 -38.007   4.081
   91   1HG2  THR  12          1HG2      THR  12   0.785 -35.267   3.977
   92   2HG2  THR  12          2HG2      THR  12  -0.175 -35.398   2.504
   93   3HG2  THR  12          3HG2      THR  12   1.124 -36.548   2.815
   94    H    ASN  13           H        ASN  13  -3.288 -37.175   3.938
   95    HA   ASN  13           HA       ASN  13  -5.241 -36.439   3.032
   96   1HB   ASN  13          2HB       ASN  13  -5.139 -35.595   5.699
   97   2HB   ASN  13          1HB       ASN  13  -5.720 -34.198   4.801
   98   1HD2  ASN  13          1HD2      ASN  13  -7.430 -35.156   6.519
   99   2HD2  ASN  13          2HD2      ASN  13  -8.681 -36.074   5.762
  100    HA   PRO  14           HA       PRO  14  -3.226 -33.184   0.487
  101   1HB   PRO  14          2HB       PRO  14  -5.393 -34.159  -1.306
  102   2HB   PRO  14          1HB       PRO  14  -3.688 -33.861  -1.661
  103   1HG   PRO  14          2HG       PRO  14  -4.593 -36.346  -1.395
  104   2HG   PRO  14          1HG       PRO  14  -3.008 -35.885  -0.748
  105   1HD   PRO  14          2HD       PRO  14  -5.589 -36.317   0.693
  106   2HD   PRO  14          1HD       PRO  14  -3.935 -36.727   1.192
  107    H    LYS  15           H        LYS  15  -6.714 -33.822   0.783
  108    HA   LYS  15           HA       LYS  15  -7.650 -31.321   0.005
  109   1HB   LYS  15          2HB       LYS  15  -8.964 -33.476   0.524
  110   2HB   LYS  15          1HB       LYS  15  -8.951 -32.925   2.194
  111   1HG   LYS  15          2HG       LYS  15  -9.936 -30.743   1.264
  112   2HG   LYS  15          1HG       LYS  15 -10.287 -31.690  -0.181
  113   1HD   LYS  15          2HD       LYS  15 -11.250 -33.355   1.687
  114   2HD   LYS  15          1HD       LYS  15 -11.492 -31.817   2.517
  115   1HE   LYS  15          2HE       LYS  15 -13.391 -31.647   1.359
  116   2HE   LYS  15          1HE       LYS  15 -12.381 -31.313  -0.048
  117   1HZ   LYS  15          1HZ       LYS  15 -12.683 -33.389  -0.874
  118   2HZ   LYS  15          2HZ       LYS  15 -14.142 -33.252  -0.031
  119   3HZ   LYS  15          3HZ       LYS  15 -12.852 -34.112   0.646
  120    H    THR  16           H        THR  16  -6.556 -32.449   3.174
  121    HA   THR  16           HA       THR  16  -7.261 -30.056   4.543
  122    HB   THR  16           HB       THR  16  -5.110 -31.957   5.442
  123    HG1  THR  16           1HG      THR  16  -7.060 -33.034   6.435
  124   1HG2  THR  16          1HG2      THR  16  -7.246 -30.498   6.978
  125   2HG2  THR  16          2HG2      THR  16  -5.555 -30.010   6.863
  126   3HG2  THR  16          3HG2      THR  16  -5.983 -31.529   7.652
  127    H    ASN  17           H        ASN  17  -4.267 -31.254   3.080
  128    HA   ASN  17           HA       ASN  17  -2.631 -29.102   3.915
  129   1HB   ASN  17          2HB       ASN  17  -2.425 -31.296   1.920
  130   2HB   ASN  17          1HB       ASN  17  -1.367 -29.906   1.687
  131   1HD2  ASN  17          1HD2      ASN  17  -2.535 -31.740   4.495
  132   2HD2  ASN  17          2HD2      ASN  17  -0.972 -32.013   5.179
  133    H    LEU  18           H        LEU  18  -4.583 -29.660   1.021
  134    HA   LEU  18           HA       LEU  18  -3.747 -27.410  -0.439
  135   1HB   LEU  18          2HB       LEU  18  -5.052 -29.317  -1.357
  136   2HB   LEU  18          1HB       LEU  18  -6.461 -28.732  -0.491
  137    HG   LEU  18           HG       LEU  18  -5.162 -26.775  -2.285
  138   1HD1  LEU  18          1HD1      LEU  18  -6.066 -29.404  -3.221
  139   2HD1  LEU  18          2HD1      LEU  18  -5.013 -28.219  -3.995
  140   3HD1  LEU  18          3HD1      LEU  18  -6.764 -28.029  -4.078
  141   1HD2  LEU  18          1HD2      LEU  18  -7.922 -27.546  -1.442
  142   2HD2  LEU  18          2HD2      LEU  18  -7.679 -26.573  -2.891
  143   3HD2  LEU  18          3HD2      LEU  18  -7.110 -25.986  -1.329
  144    H    ARG  19           H        ARG  19  -6.467 -27.847   1.805
  145    HA   ARG  19           HA       ARG  19  -7.503 -25.240   1.552
  146   1HB   ARG  19          2HB       ARG  19  -7.846 -27.507   3.416
  147   2HB   ARG  19          1HB       ARG  19  -8.230 -25.924   4.077
  148   1HG   ARG  19          2HG       ARG  19 -10.252 -26.737   3.237
  149   2HG   ARG  19          1HG       ARG  19  -9.688 -25.593   2.019
  150   1HD   ARG  19          2HD       ARG  19  -9.481 -27.187   0.460
  151   2HD   ARG  19          1HD       ARG  19  -8.732 -28.308   1.587
  152    HE   ARG  19           HE       ARG  19 -10.802 -29.221   2.046
  153   1HH1  ARG  19          1HH1      ARG  19 -11.163 -26.349   0.097
  154   2HH1  ARG  19          2HH1      ARG  19 -12.817 -26.673  -0.297
  155   1HH2  ARG  19          1HH2      ARG  19 -12.979 -29.650   1.527
  156   2HH2  ARG  19          2HH2      ARG  19 -13.849 -28.546   0.514
  157    H    LEU  20           H        LEU  20  -5.096 -26.637   3.729
  158    HA   LEU  20           HA       LEU  20  -4.770 -24.387   5.395
  159   1HB   LEU  20          2HB       LEU  20  -3.601 -26.961   5.099
  160   2HB   LEU  20          1HB       LEU  20  -2.296 -25.791   5.128
  161    HG   LEU  20           HG       LEU  20  -3.525 -24.876   7.248
  162   1HD1  LEU  20          1HD1      LEU  20  -4.377 -27.149   8.385
  163   2HD1  LEU  20          2HD1      LEU  20  -4.872 -27.447   6.720
  164   3HD1  LEU  20          3HD1      LEU  20  -5.449 -26.013   7.567
  165   1HD2  LEU  20          1HD2      LEU  20  -2.363 -26.934   8.498
  166   2HD2  LEU  20          2HD2      LEU  20  -1.448 -25.625   7.752
  167   3HD2  LEU  20          3HD2      LEU  20  -1.667 -27.149   6.893
  168    H    TRP  21           H        TRP  21  -3.048 -25.445   2.486
  169    HA   TRP  21           HA       TRP  21  -1.157 -23.375   2.396
  170   1HB   TRP  21          2HB       TRP  21  -1.380 -25.594   1.009
  171   2HB   TRP  21          1HB       TRP  21  -2.268 -24.570  -0.115
  172    HD1  TRP  21           HD       TRP  21  -0.796 -23.572  -1.942
  173    HE1  TRP  21           1HE      TRP  21   1.689 -22.945  -2.180
  174    HE3  TRP  21           3HE      TRP  21   0.792 -24.755   2.769
  175    HZ2  TRP  21           2HZ      TRP  21   4.016 -22.953  -0.580
  176    HZ3  TRP  21           3HZ      TRP  21   3.161 -24.416   3.336
  177    HH2  TRP  21           HH       TRP  21   4.740 -23.535   1.695
  178    H    VAL  22           H        VAL  22  -4.230 -23.703   0.624
  179    HA   VAL  22           HA       VAL  22  -4.159 -21.178  -0.595
  180    HB   VAL  22           HB       VAL  22  -6.646 -22.719   0.154
  181   1HG1  VAL  22          1HG1      VAL  22  -7.244 -20.549  -0.573
  182   2HG1  VAL  22          2HG1      VAL  22  -7.498 -21.615  -1.954
  183   3HG1  VAL  22          3HG1      VAL  22  -6.068 -20.586  -1.887
  184   1HG2  VAL  22          1HG2      VAL  22  -5.518 -22.958  -2.563
  185   2HG2  VAL  22          2HG2      VAL  22  -6.340 -24.157  -1.565
  186   3HG2  VAL  22          3HG2      VAL  22  -4.639 -23.791  -1.281
  187    H    ALA  23           H        ALA  23  -5.523 -22.245   2.482
  188    HA   ALA  23           HA       ALA  23  -6.883 -19.889   3.157
  189   1HB   ALA  23          1HB       ALA  23  -5.578 -21.831   5.060
  190   2HB   ALA  23          2HB       ALA  23  -7.155 -22.066   4.308
  191   3HB   ALA  23          3HB       ALA  23  -6.900 -20.720   5.418
  192    H    PHE  24           H        PHE  24  -3.587 -20.952   3.978
  193    HA   PHE  24           HA       PHE  24  -2.879 -18.649   5.443
  194   1HB   PHE  24          2HB       PHE  24  -1.522 -21.017   4.378
  195   2HB   PHE  24          1HB       PHE  24  -0.494 -19.589   4.427
  196    HD1  PHE  24           2HD      PHE  24  -3.130 -20.958   6.684
  197    HD2  PHE  24           1HD      PHE  24   0.890 -19.637   6.249
  198    HE1  PHE  24           2HE      PHE  24  -2.755 -21.323   9.088
  199    HE2  PHE  24           1HE      PHE  24   1.274 -20.001   8.652
  200    HZ   PHE  24           HZ       PHE  24  -0.550 -20.844  10.075
  201    H    GLN  25           H        GLN  25  -2.359 -19.538   2.050
  202    HA   GLN  25           HA       GLN  25  -0.858 -17.293   1.306
  203   1HB   GLN  25          2HB       GLN  25  -1.152 -19.396  -0.029
  204   2HB   GLN  25          1HB       GLN  25  -2.770 -18.849  -0.445
  205   1HG   GLN  25          2HG       GLN  25  -1.008 -16.735  -1.055
  206   2HG   GLN  25          1HG       GLN  25  -0.281 -18.215  -1.679
  207   1HE2  GLN  25          1HE2      GLN  25  -1.191 -19.234  -3.401
  208   2HE2  GLN  25          2HE2      GLN  25  -2.534 -18.608  -4.289
  209    H    MET  26           H        MET  26  -4.353 -17.882   1.163
  210    HA   MET  26           HA       MET  26  -5.015 -15.382   0.019
  211   1HB   MET  26          2HB       MET  26  -6.656 -17.354   1.610
  212   2HB   MET  26          1HB       MET  26  -7.330 -15.921   0.845
  213   1HG   MET  26          2HG       MET  26  -5.784 -17.938  -0.734
  214   2HG   MET  26          1HG       MET  26  -7.496 -18.164  -0.381
  215   1HE   MET  26          1HE       MET  26  -9.416 -16.889  -1.446
  216   2HE   MET  26          2HE       MET  26  -8.701 -18.025  -2.589
  217   3HE   MET  26          3HE       MET  26  -9.179 -16.413  -3.128
  218    H    MET  27           H        MET  27  -5.087 -16.546   3.381
  219    HA   MET  27           HA       MET  27  -6.069 -14.163   4.503
  220   1HB   MET  27          2HB       MET  27  -4.674 -16.577   5.559
  221   2HB   MET  27          1HB       MET  27  -4.799 -15.164   6.600
  222   1HG   MET  27          2HG       MET  27  -7.049 -15.361   6.837
  223   2HG   MET  27          1HG       MET  27  -7.266 -16.092   5.249
  224   1HE   MET  27          1HE       MET  27  -7.275 -16.233   8.681
  225   2HE   MET  27          2HE       MET  27  -6.141 -17.482   9.197
  226   3HE   MET  27          3HE       MET  27  -7.850 -17.869   8.998
  227    H    LYS  28           H        LYS  28  -2.720 -15.417   4.643
  228    HA   LYS  28           HA       LYS  28  -1.632 -13.011   5.630
  229   1HB   LYS  28          2HB       LYS  28  -0.695 -15.598   5.066
  230   2HB   LYS  28          1HB       LYS  28   0.296 -14.519   4.095
  231   1HG   LYS  28          2HG       LYS  28   1.223 -13.496   5.922
  232   2HG   LYS  28          1HG       LYS  28  -0.162 -13.852   6.958
  233   1HD   LYS  28          2HD       LYS  28   0.639 -15.876   7.549
  234   2HD   LYS  28          1HD       LYS  28   1.294 -16.201   5.943
  235   1HE   LYS  28          2HE       LYS  28   3.181 -14.734   6.400
  236   2HE   LYS  28          1HE       LYS  28   2.518 -14.356   7.990
  237   1HZ   LYS  28          1HZ       LYS  28   2.753 -16.694   8.588
  238   2HZ   LYS  28          2HZ       LYS  28   4.243 -16.027   8.147
  239   3HZ   LYS  28          3HZ       LYS  28   3.416 -17.035   7.070
  240    H    GLY  29           H        GLY  29  -1.890 -14.321   2.351
  241   1HA   GLY  29          2HA       GLY  29  -0.434 -12.285   1.057
  242   2HA   GLY  29          1HA       GLY  29  -1.617 -13.338   0.297
  243    H    ALA  30           H        ALA  30  -3.980 -12.724   0.929
  244    HA   ALA  30           HA       ALA  30  -4.473 -10.159  -0.101
  245   1HB   ALA  30          1HB       ALA  30  -6.202 -11.653  -0.465
  246   2HB   ALA  30          2HB       ALA  30  -6.850 -10.618   0.808
  247   3HB   ALA  30          3HB       ALA  30  -6.211 -12.208   1.208
  248    H    GLY  31           H        GLY  31  -4.758 -11.370   3.238
  249   1HA   GLY  31          2HA       GLY  31  -5.712  -9.015   4.391
  250   2HA   GLY  31          1HA       GLY  31  -4.807 -10.254   5.243
  251    H    TRP  32           H        TRP  32  -2.377 -10.170   4.828
  252    HA   TRP  32           HA       TRP  32  -1.372  -7.756   5.772
  253   1HB   TRP  32          2HB       TRP  32  -0.348 -10.180   5.672
  254   2HB   TRP  32          1HB       TRP  32   0.392  -9.576   4.193
  255    HD1  TRP  32           HD       TRP  32   0.201  -8.608   7.947
  256    HE1  TRP  32           1HE      TRP  32   2.427  -7.484   8.588
  257    HE3  TRP  32           3HE      TRP  32   2.440  -8.571   3.353
  258    HZ2  TRP  32           2HZ      TRP  32   4.818  -6.688   7.311
  259    HZ3  TRP  32           3HZ      TRP  32   4.695  -7.611   3.147
  260    HH2  TRP  32           HH       TRP  32   5.858  -6.690   5.085
  261    H    ALA  33           H        ALA  33  -0.695  -9.109   2.535
  262    HA   ALA  33           HA       ALA  33   0.482  -6.836   1.467
  263   1HB   ALA  33          1HB       ALA  33   0.356  -7.871  -0.619
  264   2HB   ALA  33          2HB       ALA  33  -1.137  -8.717  -0.214
  265   3HB   ALA  33          3HB       ALA  33   0.386  -9.211   0.526
  266    H    GLY  34           H        GLY  34  -2.826  -7.935   0.663
  267   1HA   GLY  34          2HA       GLY  34  -3.572  -5.550  -0.607
  268   2HA   GLY  34          1HA       GLY  34  -4.685  -6.752   0.026
  269    H    GLY  35           H        GLY  35  -4.033  -6.582   2.757
  270   1HA   GLY  35          2HA       GLY  35  -5.675  -4.453   3.553
  271   2HA   GLY  35          1HA       GLY  35  -4.646  -5.392   4.622
  272    H    VAL  36           H        VAL  36  -2.179  -4.788   4.185
  273    HA   VAL  36           HA       VAL  36  -1.860  -2.173   5.163
  274    HB   VAL  36           HB       VAL  36   0.289  -3.866   3.885
  275   1HG1  VAL  36          1HG1      VAL  36   0.636  -1.364   4.504
  276   2HG1  VAL  36          2HG1      VAL  36   1.848  -2.554   4.978
  277   3HG1  VAL  36          3HG1      VAL  36   0.680  -1.965   6.162
  278   1HG2  VAL  36          1HG2      VAL  36   0.544  -5.072   5.820
  279   2HG2  VAL  36          2HG2      VAL  36  -1.204  -4.859   5.811
  280   3HG2  VAL  36          3HG2      VAL  36  -0.197  -3.828   6.826
  281    H    PHE  37           H        PHE  37  -1.025  -3.519   1.962
  282    HA   PHE  37           HA       PHE  37  -0.079  -1.133   0.856
  283   1HB   PHE  37          2HB       PHE  37  -0.074  -3.629  -0.030
  284   2HB   PHE  37          1HB       PHE  37  -1.505  -3.080  -0.897
  285    HD1  PHE  37           2HD      PHE  37   1.723  -1.388  -0.096
  286    HD2  PHE  37           1HD      PHE  37  -0.942  -2.786  -3.108
  287    HE1  PHE  37           2HE      PHE  37   3.161  -0.392  -1.826
  288    HE2  PHE  37           1HE      PHE  37   0.490  -1.791  -4.842
  289    HZ   PHE  37           HZ       PHE  37   2.544  -0.592  -4.202
  290    H    PHE  38           H        PHE  38  -3.240  -2.641   0.126
  291    HA   PHE  38           HA       PHE  38  -4.271  -0.328  -1.105
  292   1HB   PHE  38          2HB       PHE  38  -5.148  -2.984  -0.610
  293   2HB   PHE  38          1HB       PHE  38  -6.412  -1.900  -0.045
  294    HD1  PHE  38           1HD      PHE  38  -4.060  -1.674  -2.928
  295    HD2  PHE  38           2HD      PHE  38  -8.099  -1.915  -1.608
  296    HE1  PHE  38           1HE      PHE  38  -4.830  -1.398  -5.247
  297    HE2  PHE  38           2HE      PHE  38  -8.877  -1.640  -3.927
  298    HZ   PHE  38           HZ       PHE  38  -7.242  -1.382  -5.749
  299    H    GLY  39           H        GLY  39  -4.688  -1.604   2.189
  300   1HA   GLY  39          2HA       GLY  39  -6.539   0.294   3.088
  301   2HA   GLY  39          1HA       GLY  39  -5.430  -0.600   4.112
  302    H    THR  40           H        THR  40  -3.049   0.292   3.844
  303    HA   THR  40           HA       THR  40  -3.027   2.845   4.979
  304    HB   THR  40           HB       THR  40  -0.643   1.673   3.572
  305    HG1  THR  40           1HG      THR  40  -1.496   0.898   6.152
  306   1HG2  THR  40          1HG2      THR  40  -0.546   3.879   4.848
  307   2HG2  THR  40          2HG2      THR  40   0.656   2.653   5.233
  308   3HG2  THR  40          3HG2      THR  40  -0.726   2.900   6.300
  309    H    LEU  41           H        LEU  41  -1.860   1.909   1.728
  310    HA   LEU  41           HA       LEU  41  -1.190   4.383   0.767
  311   1HB   LEU  41          2HB       LEU  41  -1.742   1.820  -0.356
  312   2HB   LEU  41          1HB       LEU  41  -2.479   3.037  -1.371
  313    HG   LEU  41           HG       LEU  41  -0.273   2.529  -2.192
  314   1HD1  LEU  41          1HD1      LEU  41  -0.061   5.186  -0.808
  315   2HD1  LEU  41          2HD1      LEU  41  -1.147   4.907  -2.169
  316   3HD1  LEU  41          3HD1      LEU  41   0.594   4.707  -2.374
  317   1HD2  LEU  41          1HD2      LEU  41   1.724   3.033  -0.785
  318   2HD2  LEU  41          2HD2      LEU  41   0.777   1.654  -0.227
  319   3HD2  LEU  41          3HD2      LEU  41   0.644   3.206   0.598
  320    H    LEU  42           H        LEU  42  -4.443   2.931   0.754
  321    HA   LEU  42           HA       LEU  42  -5.655   5.098  -0.622
  322   1HB   LEU  42          2HB       LEU  42  -6.583   2.688   0.791
  323   2HB   LEU  42          1HB       LEU  42  -7.721   4.018   0.769
  324    HG   LEU  42           HG       LEU  42  -7.704   4.060  -1.652
  325   1HD1  LEU  42          1HD1      LEU  42  -5.927   1.648  -1.679
  326   2HD1  LEU  42          2HD1      LEU  42  -5.264   3.281  -1.751
  327   3HD1  LEU  42          3HD1      LEU  42  -6.367   2.719  -3.008
  328   1HD2  LEU  42          1HD2      LEU  42  -8.057   1.206  -1.484
  329   2HD2  LEU  42          2HD2      LEU  42  -9.262   2.477  -1.683
  330   3HD2  LEU  42          3HD2      LEU  42  -8.737   2.006  -0.067
  331    H    LEU  43           H        LEU  43  -5.469   4.260   2.828
  332    HA   LEU  43           HA       LEU  43  -6.989   6.462   3.726
  333   1HB   LEU  43          2HB       LEU  43  -6.172   4.260   4.931
  334   2HB   LEU  43          1HB       LEU  43  -4.840   5.285   5.428
  335    HG   LEU  43           HG       LEU  43  -6.614   5.151   7.128
  336   1HD1  LEU  43          1HD1      LEU  43  -7.034   7.916   6.575
  337   2HD1  LEU  43          2HD1      LEU  43  -5.383   7.487   6.133
  338   3HD1  LEU  43          3HD1      LEU  43  -5.967   7.169   7.763
  339   1HD2  LEU  43          1HD2      LEU  43  -8.311   5.481   4.891
  340   2HD2  LEU  43          2HD2      LEU  43  -8.555   6.869   5.950
  341   3HD2  LEU  43          3HD2      LEU  43  -8.757   5.234   6.578
  342    H    ILE  44           H        ILE  44  -3.478   5.980   4.197
  343    HA   ILE  44           HA       ILE  44  -3.018   8.691   4.790
  344    HB   ILE  44           HB       ILE  44  -0.636   8.202   4.569
  345   1HG1  ILE  44          2HG1      ILE  44  -0.931   5.348   4.036
  346   2HG1  ILE  44          1HG1      ILE  44  -1.424   6.338   2.674
  347   1HG2  ILE  44          1HG2      ILE  44  -0.580   6.245   6.183
  348   2HG2  ILE  44          2HG2      ILE  44  -2.334   6.186   6.010
  349   3HG2  ILE  44          3HG2      ILE  44  -1.561   7.632   6.656
  350   1HD1  ILE  44          1HD1      ILE  44   0.736   7.436   2.663
  351   2HD1  ILE  44          2HD1      ILE  44   0.921   5.687   2.537
  352   3HD1  ILE  44          3HD1      ILE  44   1.233   6.499   4.071
  353    H    GLY  45           H        GLY  45  -2.903   6.912   1.739
  354   1HA   GLY  45          2HA       GLY  45  -1.551   8.875   0.237
  355   2HA   GLY  45          1HA       GLY  45  -2.618   7.648  -0.421
  356    H    PHE  46           H        PHE  46  -5.057   8.208   0.340
  357    HA   PHE  46           HA       PHE  46  -5.743  10.486  -1.170
  358   1HB   PHE  46          2HB       PHE  46  -7.152   8.417  -0.808
  359   2HB   PHE  46          1HB       PHE  46  -7.554   9.064   0.779
  360    HD1  PHE  46           2HD      PHE  46  -8.793  11.215   0.948
  361    HD2  PHE  46           1HD      PHE  46  -8.208   9.212  -2.762
  362    HE1  PHE  46           2HE      PHE  46 -10.614  12.535  -0.047
  363    HE2  PHE  46           1HE      PHE  46 -10.027  10.531  -3.764
  364    HZ   PHE  46           HZ       PHE  46 -11.233  12.195  -2.405
  365    H    PHE  47           H        PHE  47  -5.637   9.942   2.340
  366    HA   PHE  47           HA       PHE  47  -6.766  12.444   3.026
  367   1HB   PHE  47          2HB       PHE  47  -5.911  10.168   4.412
  368   2HB   PHE  47          1HB       PHE  47  -4.923  11.481   5.037
  369    HD1  PHE  47           2HD      PHE  47  -8.492  11.164   3.979
  370    HD2  PHE  47           1HD      PHE  47  -5.731  12.277   7.020
  371    HE1  PHE  47           2HE      PHE  47 -10.363  11.873   5.411
  372    HE2  PHE  47           1HE      PHE  47  -7.597  12.987   8.459
  373    HZ   PHE  47           HZ       PHE  47  -9.916  12.785   7.654
  374    H    ARG  48           H        ARG  48  -3.399  11.369   2.657
  375    HA   ARG  48           HA       ARG  48  -2.242  13.815   3.498
  376   1HB   ARG  48          2HB       ARG  48  -1.299  11.286   2.575
  377   2HB   ARG  48          1HB       ARG  48  -0.491  12.540   1.654
  378   1HG   ARG  48          2HG       ARG  48   0.392  13.531   3.611
  379   2HG   ARG  48          1HG       ARG  48  -0.639  12.550   4.655
  380   1HD   ARG  48          2HD       ARG  48   1.767  11.822   4.502
  381   2HD   ARG  48          1HD       ARG  48   0.570  10.577   4.151
  382    HE   ARG  48           HE       ARG  48   1.414  10.436   2.035
  383   1HH1  ARG  48          1HH1      ARG  48   2.408  13.480   3.420
  384   2HH1  ARG  48          2HH1      ARG  48   3.451  13.885   2.100
  385   1HH2  ARG  48          1HH2      ARG  48   2.792  10.964   0.297
  386   2HH2  ARG  48          2HH2      ARG  48   3.670  12.457   0.326
  387    H    VAL  49           H        VAL  49  -3.212  12.600   0.315
  388    HA   VAL  49           HA       VAL  49  -2.032  14.761  -1.112
  389    HB   VAL  49           HB       VAL  49  -2.507  12.634  -2.218
  390   1HG1  VAL  49          1HG1      VAL  49  -4.654  12.214  -1.003
  391   2HG1  VAL  49          2HG1      VAL  49  -4.700  11.883  -2.732
  392   3HG1  VAL  49          3HG1      VAL  49  -5.422  13.361  -2.099
  393   1HG2  VAL  49          1HG2      VAL  49  -2.430  13.884  -4.051
  394   2HG2  VAL  49          2HG2      VAL  49  -3.196  15.236  -3.216
  395   3HG2  VAL  49          3HG2      VAL  49  -4.189  14.004  -3.995
  396    H    VAL  50           H        VAL  50  -5.417  14.070  -0.206
  397    HA   VAL  50           HA       VAL  50  -6.400  16.543  -1.220
  398    HB   VAL  50           HB       VAL  50  -7.714  14.783   0.848
  399   1HG1  VAL  50          1HG1      VAL  50  -9.273  16.255  -1.178
  400   2HG1  VAL  50          2HG1      VAL  50  -8.490  17.233   0.063
  401   3HG1  VAL  50          3HG1      VAL  50  -9.617  15.958   0.526
  402   1HG2  VAL  50          1HG2      VAL  50  -8.790  13.627  -0.977
  403   2HG2  VAL  50          2HG2      VAL  50  -7.044  13.494  -1.144
  404   3HG2  VAL  50          3HG2      VAL  50  -7.943  14.625  -2.153
  405    H    GLY  51           H        GLY  51  -5.497  15.407   2.002
  406   1HA   GLY  51          2HA       GLY  51  -6.353  17.695   3.421
  407   2HA   GLY  51          1HA       GLY  51  -5.191  16.510   3.990
  408    H    ARG  52           H        ARG  52  -3.047  16.722   2.532
  409    HA   ARG  52           HA       ARG  52  -2.007  19.309   3.231
  410   1HB   ARG  52          2HB       ARG  52  -0.890  16.717   2.332
  411   2HB   ARG  52          1HB       ARG  52   0.053  18.147   1.951
  412   1HG   ARG  52          2HG       ARG  52  -0.687  18.437   4.629
  413   2HG   ARG  52          1HG       ARG  52  -0.230  16.743   4.442
  414   1HD   ARG  52          2HD       ARG  52   1.900  17.363   4.558
  415   2HD   ARG  52          1HD       ARG  52   1.691  18.206   3.026
  416    HE   ARG  52           HE       ARG  52   1.049  19.568   5.544
  417   1HH1  ARG  52          1HH1      ARG  52   3.015  19.330   2.661
  418   2HH1  ARG  52          2HH1      ARG  52   3.714  20.898   2.865
  419   1HH2  ARG  52          1HH2      ARG  52   1.973  21.625   5.805
  420   2HH2  ARG  52          2HH2      ARG  52   3.127  22.200   4.646
  421    H    MET  53           H        MET  53  -3.274  17.848   0.379
  422    HA   MET  53           HA       MET  53  -3.563  18.632  -1.744
  423   1HB   MET  53          2HB       MET  53  -3.138  21.062  -0.142
  424   2HB   MET  53          1HB       MET  53  -2.738  21.248  -1.845
  425   1HG   MET  53          2HG       MET  53  -5.106  20.027  -2.082
  426   2HG   MET  53          1HG       MET  53  -5.350  20.837  -0.537
  427   1HE   MET  53          1HE       MET  53  -5.187  21.206  -4.385
  428   2HE   MET  53          2HE       MET  53  -6.254  22.611  -4.408
  429   3HE   MET  53          3HE       MET  53  -6.741  21.148  -3.552
  430    H    LEU  54           H        LEU  54  -1.158  17.381  -0.914
  431    HA   LEU  54           HA       LEU  54   1.245  18.430  -1.567
  432   1HB   LEU  54          2HB       LEU  54   0.613  16.046  -0.857
  433   2HB   LEU  54          1HB       LEU  54   0.488  15.706  -2.571
  434    HG   LEU  54           HG       LEU  54   2.839  16.321  -2.877
  435   1HD1  LEU  54          1HD1      LEU  54   3.383  17.911  -1.307
  436   2HD1  LEU  54          2HD1      LEU  54   4.152  16.475  -0.632
  437   3HD1  LEU  54          3HD1      LEU  54   2.606  17.031   0.009
  438   1HD2  LEU  54          1HD2      LEU  54   3.282  14.179  -2.507
  439   2HD2  LEU  54          2HD2      LEU  54   1.839  14.058  -1.499
  440   3HD2  LEU  54          3HD2      LEU  54   3.389  14.485  -0.773
  441    HA   PRO  55           HA       PRO  55   0.701  17.288  -6.321
  442   1HB   PRO  55          2HB       PRO  55  -1.979  17.584  -7.063
  443   2HB   PRO  55          1HB       PRO  55  -1.101  16.059  -6.911
  444   1HG   PRO  55          2HG       PRO  55  -2.940  17.391  -4.980
  445   2HG   PRO  55          1HG       PRO  55  -2.721  15.665  -5.323
  446   1HD   PRO  55          2HD       PRO  55  -1.711  16.783  -3.113
  447   2HD   PRO  55          1HD       PRO  55  -0.832  15.513  -3.987
  448    H    ILE  56           H        ILE  56   1.715  19.304  -6.363
  449    HA   ILE  56           HA       ILE  56   1.976  21.466  -7.022
  450    HB   ILE  56           HB       ILE  56  -0.897  21.350  -7.936
  451   1HG1  ILE  56          2HG1      ILE  56   1.515  20.734  -9.635
  452   2HG1  ILE  56          1HG1      ILE  56   0.650  19.473  -8.765
  453   1HG2  ILE  56          1HG2      ILE  56  -0.111  23.580  -7.989
  454   2HG2  ILE  56          2HG2      ILE  56  -0.018  22.983  -9.646
  455   3HG2  ILE  56          3HG2      ILE  56   1.444  23.093  -8.665
  456   1HD1  ILE  56          1HD1      ILE  56  -1.372  19.973  -9.981
  457   2HD1  ILE  56          2HD1      ILE  56  -0.049  19.663 -11.105
  458   3HD1  ILE  56          3HD1      ILE  56  -0.577  21.318 -10.798
  459    H    GLN  57           H        GLN  57   1.371  23.680  -6.555
  460    HA   GLN  57           HA       GLN  57   0.634  25.383  -5.260
  461   1HB   GLN  57          2HB       GLN  57  -1.554  23.402  -4.693
  462   2HB   GLN  57          1HB       GLN  57  -1.491  24.954  -3.872
  463   1HG   GLN  57          2HG       GLN  57  -1.459  26.049  -6.112
  464   2HG   GLN  57          1HG       GLN  57  -1.736  24.461  -6.828
  465   1HE2  GLN  57          1HE2      GLN  57  -3.564  26.095  -7.529
  466   2HE2  GLN  57          2HE2      GLN  57  -5.028  25.939  -6.625
  467    H    GLU  58           H        GLU  58  -0.350  22.773  -3.083
  468    HA   GLU  58           HA       GLU  58   0.519  22.020  -1.109
  469   1HB   GLU  58          2HB       GLU  58   2.823  23.764  -1.925
  470   2HB   GLU  58          1HB       GLU  58   2.737  23.111  -0.299
  471   1HG   GLU  58          2HG       GLU  58   2.878  20.898  -1.060
  472   2HG   GLU  58          1HG       GLU  58   2.527  21.363  -2.725
  473    H    ASN  59           H        ASN  59   1.727  25.358  -0.937
  474    HA   ASN  59           HA       ASN  59  -0.537  26.188   0.659
  475   1HB   ASN  59          2HB       ASN  59   0.986  25.002   2.266
  476   2HB   ASN  59          1HB       ASN  59   2.214  26.214   1.912
  477   1HD2  ASN  59          1HD2      ASN  59  -1.282  26.584   2.335
  478   2HD2  ASN  59          2HD2      ASN  59  -1.178  27.660   3.682
  479    H    GLN  60           H        GLN  60   2.727  26.969  -0.478
  480    HA   GLN  60           HA       GLN  60   1.765  29.574  -1.347
  481   1HB   GLN  60          2HB       GLN  60   3.752  29.141   0.834
  482   2HB   GLN  60          1HB       GLN  60   4.043  30.466  -0.277
  483   1HG   GLN  60          2HG       GLN  60   1.550  31.053   0.256
  484   2HG   GLN  60          1HG       GLN  60   1.873  30.111   1.712
  485   1HE2  GLN  60          1HE2      GLN  60   1.695  31.911   3.042
  486   2HE2  GLN  60          2HE2      GLN  60   2.909  33.138   3.101
  487    H    ALA  61           H        ALA  61   4.962  30.021  -1.379
  488    HA   ALA  61           HA       ALA  61   5.809  28.224  -3.421
  489   1HB   ALA  61          1HB       ALA  61   5.549  31.058  -4.350
  490   2HB   ALA  61          2HB       ALA  61   4.217  29.919  -4.546
  491   3HB   ALA  61          3HB       ALA  61   5.776  29.590  -5.301
  492    HA   PRO  62           HA       PRO  62   9.555  29.414  -1.272
  493   1HB   PRO  62          2HB       PRO  62  10.731  28.312  -3.787
  494   2HB   PRO  62          1HB       PRO  62  11.160  27.980  -2.103
  495   1HG   PRO  62          2HG       PRO  62   9.739  26.217  -3.486
  496   2HG   PRO  62          1HG       PRO  62   9.346  26.554  -1.788
  497   1HD   PRO  62          2HD       PRO  62   7.955  27.456  -4.274
  498   2HD   PRO  62          1HD       PRO  62   7.272  26.996  -2.701
  499    H    ALA  63           H        ALA  63   8.523  30.502  -4.384
  500    HA   ALA  63           HA       ALA  63  10.681  32.155  -5.086
  501   1HB   ALA  63          1HB       ALA  63   8.431  31.432  -6.337
  502   2HB   ALA  63          2HB       ALA  63   9.388  32.835  -6.817
  503   3HB   ALA  63          3HB       ALA  63   7.957  33.047  -5.808
  504    HA   PRO  64           HA       PRO  64  10.808  35.533  -2.253
  505   1HB   PRO  64          2HB       PRO  64  10.620  37.181  -4.748
  506   2HB   PRO  64          1HB       PRO  64  11.721  37.346  -3.374
  507   1HG   PRO  64          2HG       PRO  64  12.539  36.222  -5.648
  508   2HG   PRO  64          1HG       PRO  64  13.074  35.600  -4.076
  509   1HD   PRO  64          2HD       PRO  64  11.146  34.443  -6.009
  510   2HD   PRO  64          1HD       PRO  64  12.178  33.630  -4.817
  511    H    ASN  65           H        ASN  65   8.415  35.515  -4.838
  512    HA   ASN  65           HA       ASN  65   6.226  36.133  -4.896
  513   1HB   ASN  65          2HB       ASN  65   6.740  35.579  -2.088
  514   2HB   ASN  65          1HB       ASN  65   5.505  36.817  -2.287
  515   1HD2  ASN  65          1HD2      ASN  65   6.273  33.502  -2.546
  516   2HD2  ASN  65          2HD2      ASN  65   4.728  32.950  -3.087
  517    H    ILE  66           H        ILE  66   7.215  38.123  -2.122
  518    HA   ILE  66           HA       ILE  66   7.494  40.377  -1.884
  519    HB   ILE  66           HB       ILE  66   7.198  40.624  -4.880
  520   1HG1  ILE  66          2HG1      ILE  66   9.886  40.956  -4.178
  521   2HG1  ILE  66          1HG1      ILE  66   9.359  39.542  -3.270
  522   1HG2  ILE  66          1HG2      ILE  66   7.126  42.596  -3.020
  523   2HG2  ILE  66          2HG2      ILE  66   7.692  42.805  -4.678
  524   3HG2  ILE  66          3HG2      ILE  66   8.851  42.527  -3.377
  525   1HD1  ILE  66          1HD1      ILE  66   8.850  38.349  -5.199
  526   2HD1  ILE  66          2HD1      ILE  66  10.349  39.188  -5.593
  527   3HD1  ILE  66          3HD1      ILE  66   8.810  39.800  -6.198
  528    H    THR  67           H        THR  67   5.103  39.696  -4.447
  529    HA   THR  67           HA       THR  67   2.893  40.458  -2.891
  530    HB   THR  67           HB       THR  67   3.726  42.711  -3.063
  531    HG1  THR  67           1HG      THR  67   1.445  42.335  -3.423
  532   1HG2  THR  67          1HG2      THR  67   4.652  43.675  -4.846
  533   2HG2  THR  67          2HG2      THR  67   3.463  42.994  -5.956
  534   3HG2  THR  67          3HG2      THR  67   4.842  42.025  -5.440
  535    H    GLY  68           H        GLY  68   3.378  38.285  -4.462
  536   1HA   GLY  68          2HA       GLY  68   1.790  37.093  -5.778
  537   2HA   GLY  68          1HA       GLY  68   1.314  38.609  -6.523
  538    H    ALA  69           H        ALA  69   1.955  38.875  -8.544
  539    HA   ALA  69           HA       ALA  69   4.573  38.433  -9.467
  540   1HB   ALA  69          1HB       ALA  69   4.376  36.148  -9.507
  541   2HB   ALA  69          2HB       ALA  69   3.800  36.549 -11.126
  542   3HB   ALA  69          3HB       ALA  69   2.644  36.193  -9.842
  543    H    LEU  70           H        LEU  70   1.186  38.235 -10.568
  544    HA   LEU  70           HA       LEU  70   1.325  40.632 -12.040
  545   1HB   LEU  70          2HB       LEU  70   1.270  39.801 -14.310
  546   2HB   LEU  70          1HB       LEU  70   2.752  39.303 -13.517
  547    HG   LEU  70           HG       LEU  70   0.621  37.304 -13.326
  548   1HD1  LEU  70          1HD1      LEU  70   1.326  36.713 -15.842
  549   2HD1  LEU  70          2HD1      LEU  70   1.334  38.474 -15.939
  550   3HD1  LEU  70          3HD1      LEU  70  -0.126  37.627 -15.431
  551   1HD2  LEU  70          1HD2      LEU  70   3.121  36.646 -14.682
  552   2HD2  LEU  70          2HD2      LEU  70   2.367  35.912 -13.266
  553   3HD2  LEU  70          3HD2      LEU  70   3.345  37.370 -13.089
  554    H    GLU  71           H        GLU  71  -0.659  41.256 -11.476
  555    HA   GLU  71           HA       GLU  71  -2.853  39.493 -11.156
  556   1HB   GLU  71          2HB       GLU  71  -4.190  41.663 -11.098
  557   2HB   GLU  71          1HB       GLU  71  -2.935  41.470  -9.883
  558   1HG   GLU  71          2HG       GLU  71  -1.785  43.230 -10.621
  559   2HG   GLU  71          1HG       GLU  71  -2.003  42.783 -12.312
  560    H    HIS  72           H        HIS  72  -1.816  41.601 -13.791
  561    HA   HIS  72           HA       HIS  72  -3.189  40.067 -15.736
  562   1HB   HIS  72          2HB       HIS  72  -4.963  41.624 -14.504
  563   2HB   HIS  72          1HB       HIS  72  -4.332  42.821 -15.631
  564    HD1  HIS  72           1HD      HIS  72  -6.417  42.955 -17.077
  565    HD2  HIS  72           2HD      HIS  72  -4.913  39.099 -16.722
  566    HE1  HIS  72           1HE      HIS  72  -7.669  41.588 -18.775
  567    HE2  HIS  72           2HE      HIS  72  -6.672  39.279 -18.609
  568    H    HIS  73           H        HIS  73  -0.574  40.847 -15.494
  569    HA   HIS  73           HA       HIS  73   1.156  41.740 -16.666
  570   1HB   HIS  73          2HB       HIS  73  -0.999  42.124 -18.755
  571   2HB   HIS  73          1HB       HIS  73   0.723  42.337 -19.049
  572    HD1  HIS  73           1HD      HIS  73  -1.036  39.500 -17.223
  573    HD2  HIS  73           2HD      HIS  73   1.356  40.172 -20.554
  574    HE1  HIS  73           1HE      HIS  73  -0.500  37.221 -18.135
  575    HE2  HIS  73           2HE      HIS  73   0.952  37.649 -20.148
  576    H    HIS  74           H        HIS  74   1.878  43.534 -15.686
  577    HA   HIS  74           HA       HIS  74   0.554  46.080 -16.357
  578   1HB   HIS  74          2HB       HIS  74   1.249  46.928 -14.138
  579   2HB   HIS  74          1HB       HIS  74   0.137  45.570 -14.016
  580    HD1  HIS  74           1HD      HIS  74   1.029  43.400 -12.976
  581    HD2  HIS  74           2HD      HIS  74   3.873  46.415 -13.258
  582    HE1  HIS  74           1HE      HIS  74   2.974  42.620 -11.586
  583    HE2  HIS  74           2HE      HIS  74   4.719  44.418 -11.849
  584    H    HIS  75           H        HIS  75   2.127  47.979 -15.859
  585    HA   HIS  75           HA       HIS  75   4.916  47.371 -16.342
  586   1HB   HIS  75          2HB       HIS  75   3.213  47.895 -18.534
  587   2HB   HIS  75          1HB       HIS  75   4.169  49.355 -18.293
  588    HD1  HIS  75           1HD      HIS  75   4.359  47.028 -20.601
  589    HD2  HIS  75           2HD      HIS  75   7.009  47.819 -17.501
  590    HE1  HIS  75           1HE      HIS  75   6.563  46.070 -21.341
  591    HE2  HIS  75           2HE      HIS  75   8.170  46.628 -19.482
  592    H    HIS  76           H        HIS  76   5.645  48.488 -14.631
  593    HA   HIS  76           HA       HIS  76   4.575  51.090 -13.959
  594   1HB   HIS  76          2HB       HIS  76   6.410  49.135 -12.695
  595   2HB   HIS  76          1HB       HIS  76   6.677  50.828 -12.294
  596    HD1  HIS  76           1HD      HIS  76   3.438  48.854 -12.665
  597    HD2  HIS  76           2HD      HIS  76   5.478  51.198  -9.904
  598    HE1  HIS  76           1HE      HIS  76   1.897  49.056 -10.686
  599    HE2  HIS  76           2HE      HIS  76   3.164  50.456  -9.017
  600    H    HIS  77           H        HIS  77   7.295  49.793 -15.676
  601    HA   HIS  77           HA       HIS  77   8.944  50.778 -16.895
  602   1HB   HIS  77          2HB       HIS  77   6.899  52.886 -16.674
  603   2HB   HIS  77          1HB       HIS  77   8.524  53.475 -17.009
  604    HD1  HIS  77           1HD      HIS  77   9.696  52.075 -19.129
  605    HD2  HIS  77           2HD      HIS  77   5.550  52.234 -18.915
  606    HE1  HIS  77           1HE      HIS  77   8.882  51.534 -21.446
  607    HE2  HIS  77           2HE      HIS  77   6.374  51.734 -21.314
  Start of MODEL    2
    1   1H    ALA   1          1HT       ALA   1 -10.105 -51.561  11.922
    2   2H    ALA   1          2HT       ALA   1  -8.999 -52.579  11.095
    3   3H    ALA   1          3HT       ALA   1 -10.357 -51.931  10.268
    4    HA   ALA   1           HA       ALA   1  -9.512 -49.738  10.528
    5   1HB   ALA   1          1HB       ALA   1  -8.332 -49.825  12.558
    6   2HB   ALA   1          2HB       ALA   1  -7.103 -49.556  11.321
    7   3HB   ALA   1          3HB       ALA   1  -7.324 -51.164  12.009
    8    H    ASP   2           H        ASP   2  -7.489 -48.916   9.279
    9    HA   ASP   2           HA       ASP   2  -7.459 -50.269   6.782
   10   1HB   ASP   2          2HB       ASP   2  -5.756 -47.989   7.815
   11   2HB   ASP   2          1HB       ASP   2  -5.781 -48.538   6.141
   12    H    LYS   3           H        LYS   3  -5.126 -49.977   9.421
   13    HA   LYS   3           HA       LYS   3  -3.256 -51.148   9.945
   14   1HB   LYS   3          2HB       LYS   3  -4.347 -53.198   8.004
   15   2HB   LYS   3          1HB       LYS   3  -3.098 -53.476   9.211
   16   1HG   LYS   3          2HG       LYS   3  -4.633 -53.963  10.725
   17   2HG   LYS   3          1HG       LYS   3  -5.392 -52.386  10.502
   18   1HD   LYS   3          2HD       LYS   3  -7.131 -53.780   9.946
   19   2HD   LYS   3          1HD       LYS   3  -6.399 -53.522   8.361
   20   1HE   LYS   3          2HE       LYS   3  -5.687 -55.658   8.197
   21   2HE   LYS   3          1HE       LYS   3  -5.302 -55.769   9.914
   22   1HZ   LYS   3          1HZ       LYS   3  -7.171 -57.211   9.158
   23   2HZ   LYS   3          2HZ       LYS   3  -8.073 -55.811   8.857
   24   3HZ   LYS   3          3HZ       LYS   3  -7.569 -56.168  10.433
   25    H    THR   4           H        THR   4  -3.372 -52.449   6.649
   26    HA   THR   4           HA       THR   4  -0.706 -51.542   6.150
   27    HB   THR   4           HB       THR   4  -2.351 -52.483   3.875
   28    HG1  THR   4           1HG      THR   4  -2.193 -54.660   4.735
   29   1HG2  THR   4          1HG2      THR   4  -0.429 -53.320   3.119
   30   2HG2  THR   4          2HG2      THR   4  -0.004 -54.013   4.683
   31   3HG2  THR   4          3HG2      THR   4   0.328 -52.313   4.353
   32    H    ILE   5           H        ILE   5  -0.887 -50.855   3.400
   33    HA   ILE   5           HA       ILE   5  -0.771 -48.859   2.268
   34    HB   ILE   5           HB       ILE   5  -2.969 -49.856   1.644
   35   1HG1  ILE   5          2HG1      ILE   5  -3.604 -47.002   1.506
   36   2HG1  ILE   5          1HG1      ILE   5  -1.939 -47.364   1.063
   37   1HG2  ILE   5          1HG2      ILE   5  -3.819 -48.436   4.057
   38   2HG2  ILE   5          2HG2      ILE   5  -4.540 -49.819   3.239
   39   3HG2  ILE   5          3HG2      ILE   5  -4.865 -48.184   2.662
   40   1HD1  ILE   5          1HD1      ILE   5  -4.276 -47.640  -0.494
   41   2HD1  ILE   5          2HD1      ILE   5  -3.625 -49.254  -0.213
   42   3HD1  ILE   5          3HD1      ILE   5  -2.610 -48.008  -0.938
   43    H    PHE   6           H        PHE   6  -0.219 -48.531   5.072
   44    HA   PHE   6           HA       PHE   6  -1.538 -46.075   5.848
   45   1HB   PHE   6          2HB       PHE   6  -0.161 -46.237   7.900
   46   2HB   PHE   6          1HB       PHE   6  -1.112 -47.685   7.600
   47    HD1  PHE   6           1HD      PHE   6   0.045 -49.713   6.649
   48    HD2  PHE   6           2HD      PHE   6   2.164 -46.326   8.107
   49    HE1  PHE   6           1HE      PHE   6   2.083 -51.079   6.845
   50    HE2  PHE   6           2HE      PHE   6   4.206 -47.684   8.303
   51    HZ   PHE   6           HZ       PHE   6   4.168 -50.063   7.672
   52    H    ASN   7           H        ASN   7   1.891 -47.023   5.414
   53    HA   ASN   7           HA       ASN   7   3.632 -45.893   4.469
   54   1HB   ASN   7          2HB       ASN   7   1.491 -44.774   3.157
   55   2HB   ASN   7          1HB       ASN   7   2.258 -43.367   3.883
   56   1HD2  ASN   7          1HD2      ASN   7   3.604 -46.372   2.571
   57   2HD2  ASN   7          2HD2      ASN   7   4.620 -45.608   1.401
   58    H    ASP   8           H        ASP   8   1.478 -43.706   6.272
   59    HA   ASP   8           HA       ASP   8   1.850 -42.605   8.251
   60   1HB   ASP   8          2HB       ASP   8   4.775 -43.323   7.929
   61   2HB   ASP   8          1HB       ASP   8   4.054 -42.537   9.325
   62    H    HIS   9           H        HIS   9   1.359 -40.596   7.772
   63    HA   HIS   9           HA       HIS   9   1.738 -38.361   7.464
   64   1HB   HIS   9          2HB       HIS   9   4.437 -39.347   7.354
   65   2HB   HIS   9          1HB       HIS   9   4.203 -38.131   6.105
   66    HD1  HIS   9           1HD      HIS   9   6.070 -37.140   8.019
   67    HD2  HIS   9           2HD      HIS   9   2.002 -36.984   8.848
   68    HE1  HIS   9           1HE      HIS   9   5.815 -35.392   9.808
   69    HE2  HIS   9           2HE      HIS   9   3.362 -35.403  10.377
   70    H    LEU  10           H        LEU  10   2.223 -40.754   5.030
   71    HA   LEU  10           HA       LEU  10   1.319 -40.887   2.934
   72   1HB   LEU  10          2HB       LEU  10   0.020 -38.608   3.936
   73   2HB   LEU  10          1HB       LEU  10   0.679 -38.123   2.386
   74    HG   LEU  10           HG       LEU  10  -1.650 -38.941   2.249
   75   1HD1  LEU  10          1HD1      LEU  10   0.590 -39.826   0.672
   76   2HD1  LEU  10          2HD1      LEU  10  -1.025 -39.337   0.162
   77   3HD1  LEU  10          3HD1      LEU  10  -0.718 -41.009   0.634
   78   1HD2  LEU  10          1HD2      LEU  10  -1.416 -40.633   4.066
   79   2HD2  LEU  10          2HD2      LEU  10  -0.510 -41.643   2.937
   80   3HD2  LEU  10          3HD2      LEU  10  -2.195 -41.238   2.604
   81    H    ASN  11           H        ASN  11   3.843 -38.916   3.940
   82    HA   ASN  11           HA       ASN  11   5.738 -38.153   2.945
   83   1HB   ASN  11          2HB       ASN  11   5.510 -40.577   1.999
   84   2HB   ASN  11          1HB       ASN  11   5.094 -39.761   0.495
   85   1HD2  ASN  11          1HD2      ASN  11   7.587 -40.485   2.765
   86   2HD2  ASN  11          2HD2      ASN  11   8.907 -39.874   1.832
   87    H    THR  12           H        THR  12   6.482 -36.576   1.504
   88    HA   THR  12           HA       THR  12   6.370 -34.806   0.104
   89    HB   THR  12           HB       THR  12   5.333 -36.814  -1.353
   90    HG1  THR  12           1HG      THR  12   6.456 -34.599  -1.859
   91   1HG2  THR  12          1HG2      THR  12   3.350 -36.008  -2.548
   92   2HG2  THR  12          2HG2      THR  12   3.172 -34.717  -1.361
   93   3HG2  THR  12          3HG2      THR  12   3.003 -36.398  -0.867
   94    H    ASN  13           H        ASN  13   3.661 -35.655   2.019
   95    HA   ASN  13           HA       ASN  13   1.820 -34.508   2.759
   96   1HB   ASN  13          2HB       ASN  13   4.201 -32.733   3.079
   97   2HB   ASN  13          1HB       ASN  13   2.614 -32.107   3.512
   98   1HD2  ASN  13          1HD2      ASN  13   4.411 -35.142   3.908
   99   2HD2  ASN  13          2HD2      ASN  13   4.062 -35.328   5.589
  100    HA   PRO  14           HA       PRO  14   0.931 -32.136  -1.120
  101   1HB   PRO  14          2HB       PRO  14  -1.031 -33.674  -2.097
  102   2HB   PRO  14          1HB       PRO  14   0.671 -34.089  -2.328
  103   1HG   PRO  14          2HG       PRO  14  -1.310 -35.216  -0.399
  104   2HG   PRO  14          1HG       PRO  14  -0.044 -36.045  -1.320
  105   1HD   PRO  14          2HD       PRO  14   0.157 -35.289   1.340
  106   2HD   PRO  14          1HD       PRO  14   1.532 -35.626   0.270
  107    H    LYS  15           H        LYS  15  -1.530 -33.765   0.888
  108    HA   LYS  15           HA       LYS  15  -3.580 -31.904   0.442
  109   1HB   LYS  15          2HB       LYS  15  -3.714 -34.256   1.468
  110   2HB   LYS  15          1HB       LYS  15  -3.285 -33.481   2.987
  111   1HG   LYS  15          2HG       LYS  15  -5.278 -31.913   2.467
  112   2HG   LYS  15          1HG       LYS  15  -5.770 -33.193   1.357
  113   1HD   LYS  15          2HD       LYS  15  -5.590 -34.794   3.283
  114   2HD   LYS  15          1HD       LYS  15  -5.359 -33.395   4.335
  115   1HE   LYS  15          2HE       LYS  15  -7.517 -32.595   3.944
  116   2HE   LYS  15          1HE       LYS  15  -7.715 -33.573   2.490
  117   1HZ   LYS  15          1HZ       LYS  15  -8.082 -34.303   5.284
  118   2HZ   LYS  15          2HZ       LYS  15  -7.389 -35.484   4.290
  119   3HZ   LYS  15          3HZ       LYS  15  -8.905 -34.839   3.906
  120    H    THR  16           H        THR  16  -1.065 -32.053   2.924
  121    HA   THR  16           HA       THR  16  -2.085 -29.872   4.442
  122    HB   THR  16           HB       THR  16   0.505 -29.909   5.165
  123    HG1  THR  16           1HG      THR  16   1.243 -32.063   4.962
  124   1HG2  THR  16          1HG2      THR  16  -0.017 -31.424   6.904
  125   2HG2  THR  16          2HG2      THR  16  -1.327 -32.145   5.970
  126   3HG2  THR  16          3HG2      THR  16  -1.479 -30.495   6.571
  127    H    ASN  17           H        ASN  17   0.422 -30.147   1.946
  128    HA   ASN  17           HA       ASN  17   1.289 -27.468   2.082
  129   1HB   ASN  17          2HB       ASN  17   2.496 -29.374   0.953
  130   2HB   ASN  17          1HB       ASN  17   1.343 -29.231  -0.371
  131   1HD2  ASN  17          1HD2      ASN  17   1.203 -27.094  -1.410
  132   2HD2  ASN  17          2HD2      ASN  17   2.656 -26.175  -1.582
  133    H    LEU  18           H        LEU  18  -1.021 -29.061  -0.104
  134    HA   LEU  18           HA       LEU  18  -1.719 -26.804  -1.598
  135   1HB   LEU  18          2HB       LEU  18  -2.324 -29.389  -1.793
  136   2HB   LEU  18          1HB       LEU  18  -3.795 -28.850  -1.004
  137    HG   LEU  18           HG       LEU  18  -2.769 -27.587  -3.539
  138   1HD1  LEU  18          1HD1      LEU  18  -3.244 -30.105  -3.673
  139   2HD1  LEU  18          2HD1      LEU  18  -4.039 -29.044  -4.838
  140   3HD1  LEU  18          3HD1      LEU  18  -4.935 -29.655  -3.446
  141   1HD2  LEU  18          1HD2      LEU  18  -4.494 -26.211  -3.296
  142   2HD2  LEU  18          2HD2      LEU  18  -4.847 -26.952  -1.735
  143   3HD2  LEU  18          3HD2      LEU  18  -5.605 -27.578  -3.199
  144    H    ARG  19           H        ARG  19  -3.299 -28.196   1.271
  145    HA   ARG  19           HA       ARG  19  -5.355 -26.297   1.454
  146   1HB   ARG  19          2HB       ARG  19  -5.187 -28.527   2.658
  147   2HB   ARG  19          1HB       ARG  19  -4.110 -27.732   3.798
  148   1HG   ARG  19          2HG       ARG  19  -6.364 -27.820   4.671
  149   2HG   ARG  19          1HG       ARG  19  -5.885 -26.149   4.372
  150   1HD   ARG  19          2HD       ARG  19  -7.084 -27.149   2.003
  151   2HD   ARG  19          1HD       ARG  19  -8.130 -27.567   3.359
  152    HE   ARG  19           HE       ARG  19  -7.192 -24.811   2.909
  153   1HH1  ARG  19          1HH1      ARG  19  -9.788 -27.088   3.480
  154   2HH1  ARG  19          2HH1      ARG  19 -10.986 -25.854   3.663
  155   1HH2  ARG  19          1HH2      ARG  19  -8.779 -23.201   3.147
  156   2HH2  ARG  19          2HH2      ARG  19 -10.417 -23.656   3.472
  157    H    LEU  20           H        LEU  20  -2.214 -26.439   3.135
  158    HA   LEU  20           HA       LEU  20  -2.523 -24.071   4.595
  159   1HB   LEU  20          2HB       LEU  20  -0.659 -25.978   4.584
  160   2HB   LEU  20          1HB       LEU  20   0.183 -24.793   3.604
  161    HG   LEU  20           HG       LEU  20  -0.415 -23.161   5.563
  162   1HD1  LEU  20          1HD1      LEU  20  -1.082 -25.818   6.642
  163   2HD1  LEU  20          2HD1      LEU  20  -1.665 -24.220   7.108
  164   3HD1  LEU  20          3HD1      LEU  20  -0.098 -24.791   7.683
  165   1HD2  LEU  20          1HD2      LEU  20   1.662 -24.755   6.677
  166   2HD2  LEU  20          2HD2      LEU  20   1.792 -23.250   5.769
  167   3HD2  LEU  20          3HD2      LEU  20   1.812 -24.796   4.920
  168    H    TRP  21           H        TRP  21  -1.287 -24.644   1.336
  169    HA   TRP  21           HA       TRP  21  -0.300 -22.073   0.838
  170   1HB   TRP  21          2HB       TRP  21  -0.732 -24.467  -0.657
  171   2HB   TRP  21          1HB       TRP  21  -1.376 -23.117  -1.583
  172    HD1  TRP  21           HD       TRP  21   0.329 -21.829  -2.993
  173    HE1  TRP  21           1HE      TRP  21   2.897 -21.672  -3.086
  174    HE3  TRP  21           3HE      TRP  21   1.462 -24.657   1.109
  175    HZ2  TRP  21           2HZ      TRP  21   5.110 -22.625  -1.615
  176    HZ3  TRP  21           3HZ      TRP  21   3.828 -24.987   1.700
  177    HH2  TRP  21           HH       TRP  21   5.612 -23.991   0.365
  178    H    VAL  22           H        VAL  22  -3.427 -23.450  -0.209
  179    HA   VAL  22           HA       VAL  22  -4.491 -21.054  -1.179
  180    HB   VAL  22           HB       VAL  22  -6.099 -23.315   0.004
  181   1HG1  VAL  22          1HG1      VAL  22  -7.806 -22.618  -1.581
  182   2HG1  VAL  22          2HG1      VAL  22  -6.747 -21.343  -2.186
  183   3HG1  VAL  22          3HG1      VAL  22  -7.354 -21.274  -0.532
  184   1HG2  VAL  22          1HG2      VAL  22  -4.403 -23.216  -2.380
  185   2HG2  VAL  22          2HG2      VAL  22  -6.052 -23.757  -2.691
  186   3HG2  VAL  22          3HG2      VAL  22  -5.056 -24.602  -1.507
  187    H    ALA  23           H        ALA  23  -4.857 -22.571   2.015
  188    HA   ALA  23           HA       ALA  23  -6.638 -20.712   3.103
  189   1HB   ALA  23          1HB       ALA  23  -5.658 -23.022   3.977
  190   2HB   ALA  23          2HB       ALA  23  -6.391 -21.834   5.055
  191   3HB   ALA  23          3HB       ALA  23  -4.634 -21.930   4.911
  192    H    PHE  24           H        PHE  24  -3.085 -20.843   3.513
  193    HA   PHE  24           HA       PHE  24  -2.893 -18.450   4.969
  194   1HB   PHE  24          2HB       PHE  24  -1.074 -20.369   3.826
  195   2HB   PHE  24          1HB       PHE  24  -0.483 -18.739   3.541
  196    HD1  PHE  24           2HD      PHE  24  -1.366 -21.215   6.097
  197    HD2  PHE  24           1HD      PHE  24   0.271 -17.361   5.340
  198    HE1  PHE  24           2HE      PHE  24  -0.505 -21.133   8.401
  199    HE2  PHE  24           1HE      PHE  24   1.138 -17.273   7.641
  200    HZ   PHE  24           HZ       PHE  24   0.750 -19.159   9.176
  201    H    GLN  25           H        GLN  25  -2.693 -19.076   1.494
  202    HA   GLN  25           HA       GLN  25  -1.895 -16.497   0.715
  203   1HB   GLN  25          2HB       GLN  25  -2.181 -18.809  -0.599
  204   2HB   GLN  25          1HB       GLN  25  -3.678 -18.033  -1.093
  205   1HG   GLN  25          2HG       GLN  25  -2.621 -16.709  -2.523
  206   2HG   GLN  25          1HG       GLN  25  -1.413 -16.249  -1.324
  207   1HE2  GLN  25          1HE2      GLN  25   0.403 -17.670  -1.016
  208   2HE2  GLN  25          2HE2      GLN  25   0.964 -18.642  -2.329
  209    H    MET  26           H        MET  26  -5.162 -17.942   0.706
  210    HA   MET  26           HA       MET  26  -6.458 -15.539  -0.027
  211   1HB   MET  26          2HB       MET  26  -7.192 -18.234   0.404
  212   2HB   MET  26          1HB       MET  26  -8.226 -17.258   1.438
  213   1HG   MET  26          2HG       MET  26  -8.985 -15.972  -0.442
  214   2HG   MET  26          1HG       MET  26  -7.842 -16.788  -1.508
  215   1HE   MET  26          1HE       MET  26 -10.754 -18.554  -3.094
  216   2HE   MET  26          2HE       MET  26  -9.225 -17.692  -3.270
  217   3HE   MET  26          3HE       MET  26 -10.661 -16.833  -2.716
  218    H    MET  27           H        MET  27  -6.201 -17.173   3.132
  219    HA   MET  27           HA       MET  27  -7.592 -15.178   4.563
  220   1HB   MET  27          2HB       MET  27  -6.744 -17.685   5.143
  221   2HB   MET  27          1HB       MET  27  -5.571 -16.737   6.045
  222   1HG   MET  27          2HG       MET  27  -8.465 -16.092   6.309
  223   2HG   MET  27          1HG       MET  27  -7.819 -17.505   7.137
  224   1HE   MET  27          1HE       MET  27  -8.043 -13.459   8.690
  225   2HE   MET  27          2HE       MET  27  -9.034 -14.871   9.050
  226   3HE   MET  27          3HE       MET  27  -8.910 -14.280   7.393
  227    H    LYS  28           H        LYS  28  -4.106 -15.936   4.773
  228    HA   LYS  28           HA       LYS  28  -3.459 -13.543   6.107
  229   1HB   LYS  28          2HB       LYS  28  -2.117 -15.884   5.384
  230   2HB   LYS  28          1HB       LYS  28  -1.237 -14.595   4.573
  231   1HG   LYS  28          2HG       LYS  28  -0.150 -14.324   6.490
  232   2HG   LYS  28          1HG       LYS  28  -1.631 -13.586   7.103
  233   1HD   LYS  28          2HD       LYS  28  -1.387 -16.551   7.187
  234   2HD   LYS  28          1HD       LYS  28  -0.467 -15.602   8.356
  235   1HE   LYS  28          2HE       LYS  28  -2.322 -15.595   9.598
  236   2HE   LYS  28          1HE       LYS  28  -2.970 -14.448   8.426
  237   1HZ   LYS  28          1HZ       LYS  28  -4.145 -16.754   9.037
  238   2HZ   LYS  28          2HZ       LYS  28  -3.212 -17.253   7.716
  239   3HZ   LYS  28          3HZ       LYS  28  -4.323 -15.989   7.538
  240    H    GLY  29           H        GLY  29  -3.454 -14.395   2.678
  241   1HA   GLY  29          2HA       GLY  29  -2.100 -12.124   1.724
  242   2HA   GLY  29          1HA       GLY  29  -3.234 -13.089   0.796
  243    H    ALA  30           H        ALA  30  -5.616 -12.683   1.477
  244    HA   ALA  30           HA       ALA  30  -6.252 -10.037   0.847
  245   1HB   ALA  30          1HB       ALA  30  -8.571 -10.695   1.694
  246   2HB   ALA  30          2HB       ALA  30  -7.868 -12.279   2.020
  247   3HB   ALA  30          3HB       ALA  30  -7.890 -11.647   0.375
  248    H    GLY  31           H        GLY  31  -6.003 -11.675   3.960
  249   1HA   GLY  31          2HA       GLY  31  -7.067  -9.594   5.541
  250   2HA   GLY  31          1HA       GLY  31  -6.013 -10.878   6.110
  251    H    TRP  32           H        TRP  32  -3.685 -10.591   5.759
  252    HA   TRP  32           HA       TRP  32  -2.761  -8.198   6.815
  253   1HB   TRP  32          2HB       TRP  32  -1.619 -10.507   6.699
  254   2HB   TRP  32          1HB       TRP  32  -1.010  -9.965   5.138
  255    HD1  TRP  32           HD       TRP  32  -0.713  -9.217   8.886
  256    HE1  TRP  32           1HE      TRP  32   1.420  -7.833   9.279
  257    HE3  TRP  32           3HE      TRP  32   0.615  -8.374   4.022
  258    HZ2  TRP  32           2HZ      TRP  32   3.404  -6.551   7.732
  259    HZ3  TRP  32           3HZ      TRP  32   2.644  -7.059   3.565
  260    HH2  TRP  32           HH       TRP  32   4.009  -6.167   5.382
  261    H    ALA  33           H        ALA  33  -1.961  -9.326   3.509
  262    HA   ALA  33           HA       ALA  33  -0.905  -6.922   2.634
  263   1HB   ALA  33          1HB       ALA  33  -0.486  -8.810   1.303
  264   2HB   ALA  33          2HB       ALA  33  -1.496  -7.759   0.309
  265   3HB   ALA  33          3HB       ALA  33  -2.202  -9.161   1.110
  266    H    GLY  34           H        GLY  34  -4.266  -7.995   2.673
  267   1HA   GLY  34          2HA       GLY  34  -5.332  -5.925   1.097
  268   2HA   GLY  34          1HA       GLY  34  -6.214  -6.829   2.318
  269    H    GLY  35           H        GLY  35  -5.027  -6.179   4.636
  270   1HA   GLY  35          2HA       GLY  35  -6.077  -3.627   5.205
  271   2HA   GLY  35          1HA       GLY  35  -5.053  -4.571   6.274
  272    H    VAL  36           H        VAL  36  -2.662  -4.653   5.291
  273    HA   VAL  36           HA       VAL  36  -1.609  -2.092   5.674
  274    HB   VAL  36           HB       VAL  36  -0.186  -4.342   4.262
  275   1HG1  VAL  36          1HG1      VAL  36   1.534  -3.022   5.999
  276   2HG1  VAL  36          2HG1      VAL  36   0.585  -1.736   5.257
  277   3HG1  VAL  36          3HG1      VAL  36   1.482  -2.866   4.244
  278   1HG2  VAL  36          1HG2      VAL  36  -0.779  -3.935   7.177
  279   2HG2  VAL  36          2HG2      VAL  36   0.605  -4.881   6.631
  280   3HG2  VAL  36          3HG2      VAL  36  -1.029  -5.375   6.191
  281    H    PHE  37           H        PHE  37  -1.787  -3.968   2.627
  282    HA   PHE  37           HA       PHE  37  -0.684  -1.992   0.998
  283   1HB   PHE  37          2HB       PHE  37  -1.155  -4.439   0.427
  284   2HB   PHE  37          1HB       PHE  37  -2.793  -3.917   0.044
  285    HD1  PHE  37           1HD      PHE  37  -3.172  -2.302  -1.794
  286    HD2  PHE  37           2HD      PHE  37   0.647  -4.023  -1.046
  287    HE1  PHE  37           1HE      PHE  37  -2.435  -1.636  -4.046
  288    HE2  PHE  37           2HE      PHE  37   1.392  -3.361  -3.295
  289    HZ   PHE  37           HZ       PHE  37  -0.151  -2.166  -4.798
  290    H    PHE  38           H        PHE  38  -4.168  -2.836   1.063
  291    HA   PHE  38           HA       PHE  38  -4.938  -0.481  -0.264
  292   1HB   PHE  38          2HB       PHE  38  -6.536  -2.351   1.486
  293   2HB   PHE  38          1HB       PHE  38  -7.246  -1.036   0.561
  294    HD1  PHE  38           2HD      PHE  38  -5.576  -4.288   0.357
  295    HD2  PHE  38           1HD      PHE  38  -7.530  -1.197  -1.810
  296    HE1  PHE  38           2HE      PHE  38  -5.759  -5.778  -1.592
  297    HE2  PHE  38           1HE      PHE  38  -7.718  -2.680  -3.765
  298    HZ   PHE  38           HZ       PHE  38  -6.829  -4.975  -3.658
  299    H    GLY  39           H        GLY  39  -4.886  -1.290   3.197
  300   1HA   GLY  39          2HA       GLY  39  -6.085   1.059   4.138
  301   2HA   GLY  39          1HA       GLY  39  -4.968   0.060   5.054
  302    H    THR  40           H        THR  40  -2.586   0.342   4.083
  303    HA   THR  40           HA       THR  40  -1.776   2.914   4.815
  304    HB   THR  40           HB       THR  40  -0.227   0.931   3.146
  305    HG1  THR  40           1HG      THR  40   0.564   0.263   5.218
  306   1HG2  THR  40          1HG2      THR  40   0.651   3.207   4.892
  307   2HG2  THR  40          2HG2      THR  40   0.976   2.964   3.176
  308   3HG2  THR  40          3HG2      THR  40   1.723   1.907   4.374
  309    H    LEU  41           H        LEU  41  -1.972   1.470   1.555
  310    HA   LEU  41           HA       LEU  41  -1.044   3.709   0.159
  311   1HB   LEU  41          2HB       LEU  41  -1.913   1.168  -0.506
  312   2HB   LEU  41          1HB       LEU  41  -3.067   2.214  -1.306
  313    HG   LEU  41           HG       LEU  41  -1.246   3.356  -2.470
  314   1HD1  LEU  41          1HD1      LEU  41   1.000   1.886  -2.234
  315   2HD1  LEU  41          2HD1      LEU  41   0.384   1.788  -0.584
  316   3HD1  LEU  41          3HD1      LEU  41   0.691   3.362  -1.319
  317   1HD2  LEU  41          1HD2      LEU  41  -1.261   1.818  -4.090
  318   2HD2  LEU  41          2HD2      LEU  41  -2.204   0.830  -2.976
  319   3HD2  LEU  41          3HD2      LEU  41  -0.457   0.618  -3.080
  320    H    LEU  42           H        LEU  42  -4.373   2.791   1.019
  321    HA   LEU  42           HA       LEU  42  -5.618   4.928  -0.341
  322   1HB   LEU  42          2HB       LEU  42  -6.497   2.725   1.034
  323   2HB   LEU  42          1HB       LEU  42  -6.978   4.030   2.096
  324    HG   LEU  42           HG       LEU  42  -7.984   5.054  -0.099
  325   1HD1  LEU  42          1HD1      LEU  42  -7.996   2.114  -0.762
  326   2HD1  LEU  42          2HD1      LEU  42  -6.983   3.322  -1.556
  327   3HD1  LEU  42          3HD1      LEU  42  -8.739   3.418  -1.690
  328   1HD2  LEU  42          1HD2      LEU  42 -10.079   3.706   0.331
  329   2HD2  LEU  42          2HD2      LEU  42  -9.385   4.525   1.729
  330   3HD2  LEU  42          3HD2      LEU  42  -9.141   2.792   1.511
  331    H    LEU  43           H        LEU  43  -4.379   4.612   2.952
  332    HA   LEU  43           HA       LEU  43  -5.398   7.085   3.884
  333   1HB   LEU  43          2HB       LEU  43  -3.483   5.055   4.847
  334   2HB   LEU  43          1HB       LEU  43  -3.257   6.671   5.485
  335    HG   LEU  43           HG       LEU  43  -4.625   5.340   6.988
  336   1HD1  LEU  43          1HD1      LEU  43  -6.611   6.818   7.116
  337   2HD1  LEU  43          2HD1      LEU  43  -6.150   7.514   5.563
  338   3HD1  LEU  43          3HD1      LEU  43  -5.089   7.694   6.959
  339   1HD2  LEU  43          1HD2      LEU  43  -6.014   4.669   4.493
  340   2HD2  LEU  43          2HD2      LEU  43  -7.071   4.999   5.866
  341   3HD2  LEU  43          3HD2      LEU  43  -5.839   3.743   5.984
  342    H    ILE  44           H        ILE  44  -2.128   6.144   2.821
  343    HA   ILE  44           HA       ILE  44  -1.034   8.732   3.029
  344    HB   ILE  44           HB       ILE  44   0.768   7.877   1.521
  345   1HG1  ILE  44          2HG1      ILE  44   0.342   5.146   1.496
  346   2HG1  ILE  44          1HG1      ILE  44  -1.242   5.793   1.087
  347   1HG2  ILE  44          1HG2      ILE  44   1.773   6.703   3.208
  348   2HG2  ILE  44          2HG2      ILE  44   0.313   5.793   3.597
  349   3HG2  ILE  44          3HG2      ILE  44   0.461   7.478   4.097
  350   1HD1  ILE  44          1HD1      ILE  44   0.310   5.263  -0.832
  351   2HD1  ILE  44          2HD1      ILE  44   1.256   6.661  -0.323
  352   3HD1  ILE  44          3HD1      ILE  44  -0.420   6.869  -0.831
  353    H    GLY  45           H        GLY  45  -2.442   6.987   0.274
  354   1HA   GLY  45          2HA       GLY  45  -1.886   8.912  -1.689
  355   2HA   GLY  45          1HA       GLY  45  -3.175   7.722  -1.769
  356    H    PHE  46           H        PHE  46  -4.882   8.433   0.191
  357    HA   PHE  46           HA       PHE  46  -6.248  10.613  -0.939
  358   1HB   PHE  46          2HB       PHE  46  -6.630   8.824   1.371
  359   2HB   PHE  46          1HB       PHE  46  -7.400  10.398   1.516
  360    HD1  PHE  46           1HD      PHE  46  -7.036   7.603  -0.926
  361    HD2  PHE  46           2HD      PHE  46  -9.519  10.669   0.671
  362    HE1  PHE  46           1HE      PHE  46  -8.901   6.816  -2.324
  363    HE2  PHE  46           2HE      PHE  46 -11.388   9.886  -0.724
  364    HZ   PHE  46           HZ       PHE  46 -11.081   7.957  -2.224
  365    H    PHE  47           H        PHE  47  -4.544  10.379   2.188
  366    HA   PHE  47           HA       PHE  47  -4.975  13.057   2.911
  367   1HB   PHE  47          2HB       PHE  47  -3.179  10.880   3.846
  368   2HB   PHE  47          1HB       PHE  47  -2.810  12.525   4.358
  369    HD1  PHE  47           2HD      PHE  47  -5.078  13.851   5.082
  370    HD2  PHE  47           1HD      PHE  47  -4.419   9.652   5.331
  371    HE1  PHE  47           2HE      PHE  47  -6.791  13.689   6.843
  372    HE2  PHE  47           1HE      PHE  47  -6.132   9.484   7.089
  373    HZ   PHE  47           HZ       PHE  47  -7.319  11.505   7.848
  374    H    ARG  48           H        ARG  48  -2.048  11.559   1.476
  375    HA   ARG  48           HA       ARG  48  -0.664  14.030   1.321
  376   1HB   ARG  48          2HB       ARG  48  -0.208  11.295   0.261
  377   2HB   ARG  48          1HB       ARG  48   0.655  12.613  -0.509
  378   1HG   ARG  48          2HG       ARG  48   1.588  13.266   1.653
  379   2HG   ARG  48          1HG       ARG  48   0.730  11.927   2.421
  380   1HD   ARG  48          2HD       ARG  48   2.148  10.367   1.595
  381   2HD   ARG  48          1HD       ARG  48   2.428  11.253   0.099
  382    HE   ARG  48           HE       ARG  48   3.847  12.770   1.532
  383   1HH1  ARG  48          1HH1      ARG  48   3.392   9.388   2.311
  384   2HH1  ARG  48          2HH1      ARG  48   4.891   9.263   3.165
  385   1HH2  ARG  48          1HH2      ARG  48   5.816  12.590   2.648
  386   2HH2  ARG  48          2HH2      ARG  48   6.266  11.074   3.356
  387    H    VAL  49           H        VAL  49  -2.279  12.101  -1.218
  388    HA   VAL  49           HA       VAL  49  -1.844  14.097  -3.203
  389    HB   VAL  49           HB       VAL  49  -3.882  11.883  -3.342
  390   1HG1  VAL  49          1HG1      VAL  49  -2.545  12.418  -5.794
  391   2HG1  VAL  49          2HG1      VAL  49  -3.114  13.948  -5.126
  392   3HG1  VAL  49          3HG1      VAL  49  -4.251  12.627  -5.398
  393   1HG2  VAL  49          1HG2      VAL  49  -0.985  11.738  -3.221
  394   2HG2  VAL  49          2HG2      VAL  49  -1.622  11.050  -4.715
  395   3HG2  VAL  49          3HG2      VAL  49  -2.183  10.446  -3.156
  396    H    VAL  50           H        VAL  50  -4.961  12.912  -1.878
  397    HA   VAL  50           HA       VAL  50  -6.420  15.100  -2.906
  398    HB   VAL  50           HB       VAL  50  -7.259  13.400  -0.562
  399   1HG1  VAL  50          1HG1      VAL  50  -8.803  15.108  -0.728
  400   2HG1  VAL  50          2HG1      VAL  50  -9.524  13.853  -1.734
  401   3HG1  VAL  50          3HG1      VAL  50  -8.668  15.199  -2.483
  402   1HG2  VAL  50          1HG2      VAL  50  -7.662  11.639  -1.887
  403   2HG2  VAL  50          2HG2      VAL  50  -6.533  12.401  -3.007
  404   3HG2  VAL  50          3HG2      VAL  50  -8.269  12.650  -3.198
  405    H    GLY  51           H        GLY  51  -5.095  14.468   0.332
  406   1HA   GLY  51          2HA       GLY  51  -6.194  16.734   1.586
  407   2HA   GLY  51          1HA       GLY  51  -4.765  15.869   2.123
  408    H    ARG  52           H        ARG  52  -3.134  16.322  -0.156
  409    HA   ARG  52           HA       ARG  52  -2.375  19.057   0.413
  410   1HB   ARG  52          2HB       ARG  52  -0.857  16.906   0.095
  411   2HB   ARG  52          1HB       ARG  52  -0.903  17.412  -1.589
  412   1HG   ARG  52          2HG       ARG  52   0.225  19.387  -1.155
  413   2HG   ARG  52          1HG       ARG  52  -0.196  19.367   0.558
  414   1HD   ARG  52          2HD       ARG  52   1.940  18.663   0.771
  415   2HD   ARG  52          1HD       ARG  52   1.213  17.097   0.431
  416    HE   ARG  52           HE       ARG  52   2.643  18.767  -1.528
  417   1HH1  ARG  52          1HH1      ARG  52   1.467  15.643  -0.477
  418   2HH1  ARG  52          2HH1      ARG  52   2.275  14.783  -1.742
  419   1HH2  ARG  52          1HH2      ARG  52   3.696  17.627  -3.185
  420   2HH2  ARG  52          2HH2      ARG  52   3.537  15.904  -3.276
  421    H    MET  53           H        MET  53  -3.670  17.210  -2.286
  422    HA   MET  53           HA       MET  53  -3.347  19.381  -4.153
  423   1HB   MET  53          2HB       MET  53  -3.373  16.861  -4.682
  424   2HB   MET  53          1HB       MET  53  -5.124  16.994  -4.581
  425   1HG   MET  53          2HG       MET  53  -4.421  19.077  -6.241
  426   2HG   MET  53          1HG       MET  53  -3.303  17.793  -6.697
  427   1HE   MET  53          1HE       MET  53  -4.509  15.089  -7.386
  428   2HE   MET  53          2HE       MET  53  -3.658  16.322  -8.314
  429   3HE   MET  53          3HE       MET  53  -5.161  15.636  -8.929
  430    H    LEU  54           H        LEU  54  -6.230  17.754  -2.775
  431    HA   LEU  54           HA       LEU  54  -7.579  20.285  -2.509
  432   1HB   LEU  54          2HB       LEU  54  -8.086  18.505  -4.800
  433   2HB   LEU  54          1HB       LEU  54  -9.523  19.049  -3.953
  434    HG   LEU  54           HG       LEU  54  -7.887  21.328  -4.352
  435   1HD1  LEU  54          1HD1      LEU  54  -7.826  19.402  -6.591
  436   2HD1  LEU  54          2HD1      LEU  54  -6.680  20.668  -6.146
  437   3HD1  LEU  54          3HD1      LEU  54  -8.167  21.084  -7.000
  438   1HD2  LEU  54          1HD2      LEU  54 -10.028  21.961  -4.454
  439   2HD2  LEU  54          2HD2      LEU  54 -10.569  20.369  -4.984
  440   3HD2  LEU  54          3HD2      LEU  54  -9.939  21.521  -6.160
  441    HA   PRO  55           HA       PRO  55  -8.846  17.214   0.685
  442   1HB   PRO  55          2HB       PRO  55  -9.458  19.722   2.125
  443   2HB   PRO  55          1HB       PRO  55  -8.498  18.335   2.643
  444   1HG   PRO  55          2HG       PRO  55  -7.353  20.666   1.989
  445   2HG   PRO  55          1HG       PRO  55  -6.584  19.113   1.632
  446   1HD   PRO  55          2HD       PRO  55  -8.049  20.965  -0.200
  447   2HD   PRO  55          1HD       PRO  55  -6.590  19.998  -0.504
  448    H    ILE  56           H        ILE  56 -10.683  16.634  -0.595
  449    HA   ILE  56           HA       ILE  56 -12.903  16.522  -1.110
  450    HB   ILE  56           HB       ILE  56 -13.489  18.208   1.307
  451   1HG1  ILE  56          2HG1      ILE  56 -11.816  16.676   2.102
  452   2HG1  ILE  56          1HG1      ILE  56 -13.383  16.088   2.647
  453   1HG2  ILE  56          1HG2      ILE  56 -15.416  16.708   1.499
  454   2HG2  ILE  56          2HG2      ILE  56 -14.869  15.831   0.071
  455   3HG2  ILE  56          3HG2      ILE  56 -15.370  17.515  -0.067
  456   1HD1  ILE  56          1HD1      ILE  56 -11.429  14.866   0.854
  457   2HD1  ILE  56          2HD1      ILE  56 -13.097  14.772   0.287
  458   3HD1  ILE  56          3HD1      ILE  56 -12.664  14.123   1.869
  459    H    GLN  57           H        GLN  57 -11.394  18.671  -2.237
  460    HA   GLN  57           HA       GLN  57 -11.558  20.764  -3.166
  461   1HB   GLN  57          2HB       GLN  57 -13.376  20.923  -4.724
  462   2HB   GLN  57          1HB       GLN  57 -12.878  19.242  -4.631
  463   1HG   GLN  57          2HG       GLN  57 -14.847  18.566  -3.789
  464   2HG   GLN  57          1HG       GLN  57 -15.049  20.017  -2.808
  465   1HE2  GLN  57          1HE2      GLN  57 -16.659  18.418  -4.925
  466   2HE2  GLN  57          2HE2      GLN  57 -17.327  19.666  -5.917
  467    H    GLU  58           H        GLU  58 -11.998  20.995  -0.456
  468    HA   GLU  58           HA       GLU  58 -12.928  22.303   1.167
  469   1HB   GLU  58          2HB       GLU  58 -13.444  24.241  -1.084
  470   2HB   GLU  58          1HB       GLU  58 -13.140  24.614   0.607
  471   1HG   GLU  58          2HG       GLU  58 -11.009  23.098  -0.720
  472   2HG   GLU  58          1HG       GLU  58 -11.284  24.718  -1.360
  473    H    ASN  59           H        ASN  59 -14.742  20.911   1.521
  474    HA   ASN  59           HA       ASN  59 -17.243  21.541   0.198
  475   1HB   ASN  59          2HB       ASN  59 -16.200  19.358   1.838
  476   2HB   ASN  59          1HB       ASN  59 -17.847  19.809   2.270
  477   1HD2  ASN  59          1HD2      ASN  59 -18.945  18.128   1.445
  478   2HD2  ASN  59          2HD2      ASN  59 -18.969  17.701  -0.228
  479    H    GLN  60           H        GLN  60 -15.964  21.627   3.519
  480    HA   GLN  60           HA       GLN  60 -18.255  23.165   4.420
  481   1HB   GLN  60          2HB       GLN  60 -16.302  21.473   5.642
  482   2HB   GLN  60          1HB       GLN  60 -16.235  23.050   6.420
  483   1HG   GLN  60          2HG       GLN  60 -18.834  21.622   6.001
  484   2HG   GLN  60          1HG       GLN  60 -17.805  21.284   7.392
  485   1HE2  GLN  60          1HE2      GLN  60 -17.410  22.954   8.899
  486   2HE2  GLN  60          2HE2      GLN  60 -18.494  24.291   9.051
  487    H    ALA  61           H        ALA  61 -18.333  25.307   4.368
  488    HA   ALA  61           HA       ALA  61 -16.104  26.952   5.048
  489   1HB   ALA  61          1HB       ALA  61 -16.801  27.872   2.422
  490   2HB   ALA  61          2HB       ALA  61 -16.266  26.194   2.348
  491   3HB   ALA  61          3HB       ALA  61 -15.222  27.423   3.065
  492    HA   PRO  62           HA       PRO  62 -20.576  28.460   5.670
  493   1HB   PRO  62          2HB       PRO  62 -19.261  29.106   8.265
  494   2HB   PRO  62          1HB       PRO  62 -20.883  28.476   7.950
  495   1HG   PRO  62          2HG       PRO  62 -18.961  26.880   8.871
  496   2HG   PRO  62          1HG       PRO  62 -20.123  26.302   7.666
  497   1HD   PRO  62          2HD       PRO  62 -17.272  27.100   7.318
  498   2HD   PRO  62          1HD       PRO  62 -18.197  25.826   6.500
  499    H    ALA  63           H        ALA  63 -17.557  29.918   6.909
  500    HA   ALA  63           HA       ALA  63 -16.822  32.083   6.952
  501   1HB   ALA  63          1HB       ALA  63 -16.798  33.201   4.838
  502   2HB   ALA  63          2HB       ALA  63 -18.174  32.261   4.264
  503   3HB   ALA  63          3HB       ALA  63 -16.620  31.474   4.538
  504    HA   PRO  64           HA       PRO  64 -20.929  33.625   8.549
  505   1HB   PRO  64          2HB       PRO  64 -18.944  34.901  10.369
  506   2HB   PRO  64          1HB       PRO  64 -20.481  34.118  10.751
  507   1HG   PRO  64          2HG       PRO  64 -18.175  32.882  11.240
  508   2HG   PRO  64          1HG       PRO  64 -19.579  31.984  10.631
  509   1HD   PRO  64          2HD       PRO  64 -17.121  32.875   9.187
  510   2HD   PRO  64          1HD       PRO  64 -18.071  31.388   8.991
  511    H    ASN  65           H        ASN  65 -17.866  35.263   7.921
  512    HA   ASN  65           HA       ASN  65 -19.148  37.841   7.593
  513   1HB   ASN  65          2HB       ASN  65 -16.731  37.317   8.477
  514   2HB   ASN  65          1HB       ASN  65 -16.322  37.266   6.766
  515   1HD2  ASN  65          1HD2      ASN  65 -17.965  39.296   9.157
  516   2HD2  ASN  65          2HD2      ASN  65 -17.452  40.803   8.485
  517    H    ILE  66           H        ILE  66 -17.283  35.621   5.541
  518    HA   ILE  66           HA       ILE  66 -17.623  34.986   3.372
  519    HB   ILE  66           HB       ILE  66 -20.082  35.914   3.837
  520   1HG1  ILE  66          2HG1      ILE  66 -19.385  35.572   0.959
  521   2HG1  ILE  66          1HG1      ILE  66 -19.005  34.258   2.068
  522   1HG2  ILE  66          1HG2      ILE  66 -19.659  37.571   1.456
  523   2HG2  ILE  66          2HG2      ILE  66 -18.981  38.237   2.943
  524   3HG2  ILE  66          3HG2      ILE  66 -20.694  37.835   2.859
  525   1HD1  ILE  66          1HD1      ILE  66 -21.698  35.432   1.454
  526   2HD1  ILE  66          2HD1      ILE  66 -21.406  34.331   2.801
  527   3HD1  ILE  66          3HD1      ILE  66 -21.126  33.793   1.144
  528    H    THR  67           H        THR  67 -17.078  38.251   4.346
  529    HA   THR  67           HA       THR  67 -15.407  39.671   3.713
  530    HB   THR  67           HB       THR  67 -13.828  39.191   2.077
  531    HG1  THR  67           1HG      THR  67 -15.467  37.309   0.777
  532   1HG2  THR  67          1HG2      THR  67 -14.427  37.166   3.794
  533   2HG2  THR  67          2HG2      THR  67 -13.006  37.245   2.753
  534   3HG2  THR  67          3HG2      THR  67 -14.434  36.350   2.232
  535    H    GLY  68           H        GLY  68 -17.075  38.540   0.770
  536   1HA   GLY  68          2HA       GLY  68 -18.788  39.774  -0.329
  537   2HA   GLY  68          1HA       GLY  68 -18.219  41.228   0.481
  538    H    ALA  69           H        ALA  69 -18.580  41.827  -1.939
  539    HA   ALA  69           HA       ALA  69 -16.066  42.408  -3.042
  540   1HB   ALA  69          1HB       ALA  69 -17.541  40.165  -4.415
  541   2HB   ALA  69          2HB       ALA  69 -15.948  40.086  -3.663
  542   3HB   ALA  69          3HB       ALA  69 -16.190  41.057  -5.115
  543    H    LEU  70           H        LEU  70 -17.291  44.390  -2.885
  544    HA   LEU  70           HA       LEU  70 -18.045  46.173  -4.147
  545   1HB   LEU  70          2HB       LEU  70 -19.394  44.236  -6.019
  546   2HB   LEU  70          1HB       LEU  70 -19.084  45.940  -6.282
  547    HG   LEU  70           HG       LEU  70 -16.691  44.275  -5.813
  548   1HD1  LEU  70          1HD1      LEU  70 -17.368  44.098  -8.592
  549   2HD1  LEU  70          2HD1      LEU  70 -18.620  43.330  -7.615
  550   3HD1  LEU  70          3HD1      LEU  70 -16.941  42.815  -7.460
  551   1HD2  LEU  70          1HD2      LEU  70 -17.250  46.826  -6.734
  552   2HD2  LEU  70          2HD2      LEU  70 -16.792  45.934  -8.185
  553   3HD2  LEU  70          3HD2      LEU  70 -15.694  45.998  -6.807
  554    H    GLU  71           H        GLU  71 -19.903  43.545  -2.970
  555    HA   GLU  71           HA       GLU  71 -22.483  44.695  -3.160
  556   1HB   GLU  71          2HB       GLU  71 -21.481  42.258  -2.380
  557   2HB   GLU  71          1HB       GLU  71 -22.032  42.939  -0.854
  558   1HG   GLU  71          2HG       GLU  71 -23.736  41.559  -1.965
  559   2HG   GLU  71          1HG       GLU  71 -24.252  43.228  -1.728
  560    H    HIS  72           H        HIS  72 -19.806  45.496  -1.233
  561    HA   HIS  72           HA       HIS  72 -21.343  46.539   0.988
  562   1HB   HIS  72          2HB       HIS  72 -18.976  45.501   1.090
  563   2HB   HIS  72          1HB       HIS  72 -18.424  47.066   0.502
  564    HD1  HIS  72           1HD      HIS  72 -20.975  48.242   2.427
  565    HD2  HIS  72           2HD      HIS  72 -17.452  46.289   3.448
  566    HE1  HIS  72           1HE      HIS  72 -20.545  48.842   4.831
  567    HE2  HIS  72           2HE      HIS  72 -18.452  47.587   5.450
  568    H    HIS  73           H        HIS  73 -22.639  48.138   0.055
  569    HA   HIS  73           HA       HIS  73 -21.328  50.357  -1.311
  570   1HB   HIS  73          2HB       HIS  73 -23.536  49.315  -2.081
  571   2HB   HIS  73          1HB       HIS  73 -24.271  50.119  -0.699
  572    HD1  HIS  73           1HD      HIS  73 -25.339  52.239  -1.357
  573    HD2  HIS  73           2HD      HIS  73 -21.960  51.450  -3.644
  574    HE1  HIS  73           1HE      HIS  73 -25.142  54.171  -2.956
  575    HE2  HIS  73           2HE      HIS  73 -23.142  53.628  -4.386
  576    H    HIS  74           H        HIS  74 -20.187  51.341   0.363
  577    HA   HIS  74           HA       HIS  74 -21.857  52.877   2.215
  578   1HB   HIS  74          2HB       HIS  74 -20.919  50.808   3.346
  579   2HB   HIS  74          1HB       HIS  74 -19.322  51.515   3.126
  580    HD1  HIS  74           1HD      HIS  74 -19.328  51.380   5.828
  581    HD2  HIS  74           2HD      HIS  74 -21.875  54.171   4.099
  582    HE1  HIS  74           1HE      HIS  74 -19.922  52.981   7.673
  583    HE2  HIS  74           2HE      HIS  74 -21.535  54.610   6.626
  584    H    HIS  75           H        HIS  75 -18.426  52.363   1.368
  585    HA   HIS  75           HA       HIS  75 -16.761  53.810   0.826
  586   1HB   HIS  75          2HB       HIS  75 -19.099  54.771  -0.503
  587   2HB   HIS  75          1HB       HIS  75 -18.178  56.162   0.062
  588    HD1  HIS  75           1HD      HIS  75 -15.444  55.854  -0.584
  589    HD2  HIS  75           2HD      HIS  75 -18.296  53.969  -2.945
  590    HE1  HIS  75           1HE      HIS  75 -14.297  55.372  -2.768
  591    HE2  HIS  75           2HE      HIS  75 -16.018  54.161  -4.153
  592    H    HIS  76           H        HIS  76 -15.857  54.221   2.792
  593    HA   HIS  76           HA       HIS  76 -16.977  55.858   4.789
  594   1HB   HIS  76          2HB       HIS  76 -14.694  54.241   4.513
  595   2HB   HIS  76          1HB       HIS  76 -14.089  55.847   4.904
  596    HD1  HIS  76           1HD      HIS  76 -17.017  53.791   6.231
  597    HD2  HIS  76           2HD      HIS  76 -13.746  55.976   7.571
  598    HE1  HIS  76           1HE      HIS  76 -17.127  53.694   8.741
  599    HE2  HIS  76           2HE      HIS  76 -15.186  55.094   9.531
  600    H    HIS  77           H        HIS  77 -14.842  56.549   2.086
  601    HA   HIS  77           HA       HIS  77 -14.272  59.235   2.904
  602   1HB   HIS  77          2HB       HIS  77 -13.048  57.554   1.198
  603   2HB   HIS  77          1HB       HIS  77 -14.004  58.479   0.046
  604    HD1  HIS  77           1HD      HIS  77 -10.772  58.471   1.381
  605    HD2  HIS  77           2HD      HIS  77 -13.585  61.465   0.754
  606    HE1  HIS  77           1HE      HIS  77  -9.468  60.623   1.344
  607    HE2  HIS  77           2HE      HIS  77 -11.181  62.411   0.885
  Start of MODEL    3
    1   1H    ALA   1          1HT       ALA   1 -11.275 -49.302  14.604
    2   2H    ALA   1          2HT       ALA   1 -12.403 -50.477  14.068
    3   3H    ALA   1          3HT       ALA   1 -11.559 -50.702  15.545
    4    HA   ALA   1           HA       ALA   1 -13.617 -50.029  16.194
    5   1HB   ALA   1          1HB       ALA   1 -13.231 -47.620  16.938
    6   2HB   ALA   1          2HB       ALA   1 -11.680 -47.740  16.109
    7   3HB   ALA   1          3HB       ALA   1 -12.051 -48.826  17.448
    8    H    ASP   2           H        ASP   2 -15.542 -49.690  15.351
    9    HA   ASP   2           HA       ASP   2 -17.269 -48.838  14.156
   10   1HB   ASP   2          2HB       ASP   2 -15.436 -46.445  14.003
   11   2HB   ASP   2          1HB       ASP   2 -17.088 -46.447  13.395
   12    H    LYS   3           H        LYS   3 -14.626 -49.957  12.764
   13    HA   LYS   3           HA       LYS   3 -14.009 -50.509  10.645
   14   1HB   LYS   3          2HB       LYS   3 -16.917 -50.435  10.691
   15   2HB   LYS   3          1HB       LYS   3 -16.283 -50.127   9.082
   16   1HG   LYS   3          2HG       LYS   3 -16.066 -52.312   8.817
   17   2HG   LYS   3          1HG       LYS   3 -14.812 -52.294  10.056
   18   1HD   LYS   3          2HD       LYS   3 -16.118 -53.560  11.337
   19   2HD   LYS   3          1HD       LYS   3 -17.271 -52.228  11.423
   20   1HE   LYS   3          2HE       LYS   3 -18.740 -53.359  10.194
   21   2HE   LYS   3          1HE       LYS   3 -17.550 -53.593   8.914
   22   1HZ   LYS   3          1HZ       LYS   3 -16.685 -55.429  10.527
   23   2HZ   LYS   3          2HZ       LYS   3 -17.997 -55.739   9.506
   24   3HZ   LYS   3          3HZ       LYS   3 -18.263 -55.372  11.136
   25    H    THR   4           H        THR   4 -13.400 -47.854  11.334
   26    HA   THR   4           HA       THR   4 -13.034 -46.729   8.731
   27    HB   THR   4           HB       THR   4 -14.174 -44.492   9.856
   28    HG1  THR   4           1HG      THR   4 -15.757 -45.041  11.099
   29   1HG2  THR   4          1HG2      THR   4 -14.789 -46.283   7.686
   30   2HG2  THR   4          2HG2      THR   4 -14.997 -44.536   7.805
   31   3HG2  THR   4          3HG2      THR   4 -16.252 -45.617   8.410
   32    H    ILE   5           H        ILE   5 -10.861 -46.685   9.198
   33    HA   ILE   5           HA       ILE   5  -9.926 -44.459  10.800
   34    HB   ILE   5           HB       ILE   5  -8.768 -47.172  11.414
   35   1HG1  ILE   5          2HG1      ILE   5  -9.913 -46.631  13.729
   36   2HG1  ILE   5          1HG1      ILE   5 -11.045 -45.746  12.717
   37   1HG2  ILE   5          1HG2      ILE   5  -8.189 -45.565  13.512
   38   2HG2  ILE   5          2HG2      ILE   5  -8.200 -44.402  12.187
   39   3HG2  ILE   5          3HG2      ILE   5  -7.137 -45.806  12.116
   40   1HD1  ILE   5          1HD1      ILE   5 -10.329 -48.631  12.305
   41   2HD1  ILE   5          2HD1      ILE   5 -11.615 -47.726  11.519
   42   3HD1  ILE   5          3HD1      ILE   5 -11.714 -48.077  13.238
   43    H    PHE   6           H        PHE   6  -9.900 -45.406   7.980
   44    HA   PHE   6           HA       PHE   6  -7.109 -44.862   7.475
   45   1HB   PHE   6          2HB       PHE   6  -7.399 -47.409   7.759
   46   2HB   PHE   6          1HB       PHE   6  -8.250 -47.349   6.219
   47    HD1  PHE   6           2HD      PHE   6  -5.109 -45.884   7.616
   48    HD2  PHE   6           1HD      PHE   6  -6.980 -48.004   4.437
   49    HE1  PHE   6           2HE      PHE   6  -2.954 -46.002   6.432
   50    HE2  PHE   6           1HE      PHE   6  -4.827 -48.128   3.249
   51    HZ   PHE   6           HZ       PHE   6  -2.814 -47.123   4.246
   52    H    ASN   7           H        ASN   7  -7.795 -43.016   6.444
   53    HA   ASN   7           HA       ASN   7  -8.388 -41.730   4.666
   54   1HB   ASN   7          2HB       ASN   7  -8.596 -44.403   3.266
   55   2HB   ASN   7          1HB       ASN   7  -8.753 -42.850   2.456
   56   1HD2  ASN   7          1HD2      ASN   7  -6.854 -44.710   1.738
   57   2HD2  ASN   7          2HD2      ASN   7  -5.284 -44.095   2.111
   58    H    ASP   8           H        ASP   8 -10.271 -41.249   3.175
   59    HA   ASP   8           HA       ASP   8 -12.508 -41.062   2.747
   60   1HB   ASP   8          2HB       ASP   8 -12.378 -43.669   3.065
   61   2HB   ASP   8          1HB       ASP   8 -13.190 -43.321   4.589
   62    H    HIS   9           H        HIS   9 -13.214 -39.248   3.648
   63    HA   HIS   9           HA       HIS   9 -14.334 -37.908   5.129
   64   1HB   HIS   9          2HB       HIS   9 -15.369 -40.079   5.985
   65   2HB   HIS   9          1HB       HIS   9 -14.116 -40.073   7.221
   66    HD1  HIS   9           1HD      HIS   9 -15.902 -39.796   9.080
   67    HD2  HIS   9           2HD      HIS   9 -15.796 -36.683   6.329
   68    HE1  HIS   9           1HE      HIS   9 -17.254 -37.941  10.111
   69    HE2  HIS   9           2HE      HIS   9 -17.129 -36.047   8.453
   70    H    LEU  10           H        LEU  10 -12.052 -39.872   7.026
   71    HA   LEU  10           HA       LEU  10 -10.240 -39.327   8.277
   72   1HB   LEU  10          2HB       LEU  10 -10.213 -36.910   6.471
   73   2HB   LEU  10          1HB       LEU  10  -8.921 -37.337   7.576
   74    HG   LEU  10           HG       LEU  10  -9.845 -39.022   5.247
   75   1HD1  LEU  10          1HD1      LEU  10  -7.139 -38.131   5.068
   76   2HD1  LEU  10          2HD1      LEU  10  -8.196 -36.737   5.291
   77   3HD1  LEU  10          3HD1      LEU  10  -8.479 -37.853   3.956
   78   1HD2  LEU  10          1HD2      LEU  10  -8.912 -40.647   6.493
   79   2HD2  LEU  10          2HD2      LEU  10  -8.046 -39.505   7.521
   80   3HD2  LEU  10          3HD2      LEU  10  -7.393 -39.939   5.941
   81    H    ASN  11           H        ASN  11 -11.006 -39.037  10.298
   82    HA   ASN  11           HA       ASN  11 -12.458 -36.682  11.072
   83   1HB   ASN  11          2HB       ASN  11 -12.524 -39.132  12.059
   84   2HB   ASN  11          1HB       ASN  11 -11.214 -38.531  13.070
   85   1HD2  ASN  11          1HD2      ASN  11 -14.123 -39.292  13.509
   86   2HD2  ASN  11          2HD2      ASN  11 -14.760 -37.970  14.420
   87    H    THR  12           H        THR  12  -9.256 -38.022  11.851
   88    HA   THR  12           HA       THR  12  -8.448 -35.553  13.130
   89    HB   THR  12           HB       THR  12  -6.238 -36.783  13.364
   90    HG1  THR  12           1HG      THR  12  -6.339 -39.026  12.956
   91   1HG2  THR  12          1HG2      THR  12  -7.483 -38.720  14.767
   92   2HG2  THR  12          2HG2      THR  12  -8.776 -37.529  14.623
   93   3HG2  THR  12          3HG2      THR  12  -7.233 -37.073  15.345
   94    H    ASN  13           H        ASN  13  -7.201 -34.006  12.277
   95    HA   ASN  13           HA       ASN  13  -6.056 -32.768  10.769
   96   1HB   ASN  13          2HB       ASN  13  -5.193 -35.532   9.976
   97   2HB   ASN  13          1HB       ASN  13  -4.713 -34.146   9.004
   98   1HD2  ASN  13          1HD2      ASN  13  -2.579 -34.988   9.675
   99   2HD2  ASN  13          2HD2      ASN  13  -1.910 -34.394  11.153
  100    HA   PRO  14           HA       PRO  14  -9.729 -33.577   7.857
  101   1HB   PRO  14          2HB       PRO  14 -10.085 -30.707   8.560
  102   2HB   PRO  14          1HB       PRO  14 -11.298 -31.981   8.384
  103   1HG   PRO  14          2HG       PRO  14 -10.584 -31.106  10.796
  104   2HG   PRO  14          1HG       PRO  14 -10.910 -32.825  10.509
  105   1HD   PRO  14          2HD       PRO  14  -8.295 -31.414  10.817
  106   2HD   PRO  14          1HD       PRO  14  -8.781 -33.029  11.372
  107    H    LYS  15           H        LYS  15  -7.604 -30.767   8.276
  108    HA   LYS  15           HA       LYS  15  -6.905 -30.881   5.449
  109   1HB   LYS  15          2HB       LYS  15  -7.771 -28.311   6.765
  110   2HB   LYS  15          1HB       LYS  15  -7.332 -28.536   5.079
  111   1HG   LYS  15          2HG       LYS  15  -9.666 -29.952   6.324
  112   2HG   LYS  15          1HG       LYS  15  -9.800 -28.327   5.657
  113   1HD   LYS  15          2HD       LYS  15  -8.823 -29.278   3.519
  114   2HD   LYS  15          1HD       LYS  15  -9.099 -30.873   4.220
  115   1HE   LYS  15          2HE       LYS  15 -11.505 -30.131   4.573
  116   2HE   LYS  15          1HE       LYS  15 -11.127 -28.766   3.522
  117   1HZ   LYS  15          1HZ       LYS  15 -12.060 -31.084   2.627
  118   2HZ   LYS  15          2HZ       LYS  15 -10.400 -31.390   2.510
  119   3HZ   LYS  15          3HZ       LYS  15 -11.073 -30.067   1.703
  120    H    THR  16           H        THR  16  -6.338 -29.460   8.638
  121    HA   THR  16           HA       THR  16  -4.497 -28.424   9.550
  122    HB   THR  16           HB       THR  16  -2.578 -29.968   9.703
  123    HG1  THR  16           1HG      THR  16  -2.810 -31.992   8.573
  124   1HG2  THR  16          1HG2      THR  16  -5.028 -30.413  10.746
  125   2HG2  THR  16          2HG2      THR  16  -3.602 -31.399  11.077
  126   3HG2  THR  16          3HG2      THR  16  -4.760 -31.906   9.848
  127    H    ASN  17           H        ASN  17  -2.351 -29.959   7.268
  128    HA   ASN  17           HA       ASN  17  -0.994 -27.572   6.696
  129   1HB   ASN  17          2HB       ASN  17  -0.975 -30.245   5.289
  130   2HB   ASN  17          1HB       ASN  17   0.128 -28.927   4.904
  131   1HD2  ASN  17          1HD2      ASN  17   0.909 -27.946   7.233
  132   2HD2  ASN  17          2HD2      ASN  17   1.690 -29.146   8.201
  133    H    LEU  18           H        LEU  18  -3.423 -29.393   4.880
  134    HA   LEU  18           HA       LEU  18  -3.351 -27.726   2.588
  135   1HB   LEU  18          2HB       LEU  18  -5.528 -29.529   3.650
  136   2HB   LEU  18          1HB       LEU  18  -5.573 -28.746   2.081
  137    HG   LEU  18           HG       LEU  18  -3.485 -30.748   2.951
  138   1HD1  LEU  18          1HD1      LEU  18  -4.884 -32.359   2.355
  139   2HD1  LEU  18          2HD1      LEU  18  -5.084 -31.624   0.764
  140   3HD1  LEU  18          3HD1      LEU  18  -6.148 -31.158   2.091
  141   1HD2  LEU  18          1HD2      LEU  18  -2.728 -29.065   1.290
  142   2HD2  LEU  18          2HD2      LEU  18  -4.032 -29.586   0.224
  143   3HD2  LEU  18          3HD2      LEU  18  -2.749 -30.713   0.663
  144    H    ARG  19           H        ARG  19  -5.118 -27.629   5.621
  145    HA   ARG  19           HA       ARG  19  -7.011 -25.658   4.951
  146   1HB   ARG  19          2HB       ARG  19  -6.866 -27.104   7.084
  147   2HB   ARG  19          1HB       ARG  19  -5.753 -25.888   7.675
  148   1HG   ARG  19          2HG       ARG  19  -8.400 -25.024   6.632
  149   2HG   ARG  19          1HG       ARG  19  -8.298 -25.751   8.237
  150   1HD   ARG  19          2HD       ARG  19  -6.203 -23.843   7.971
  151   2HD   ARG  19          1HD       ARG  19  -7.707 -23.089   7.455
  152    HE   ARG  19           HE       ARG  19  -8.633 -23.651   9.631
  153   1HH1  ARG  19          1HH1      ARG  19  -5.150 -23.828   9.329
  154   2HH1  ARG  19          2HH1      ARG  19  -4.877 -23.641  11.026
  155   1HH2  ARG  19          1HH2      ARG  19  -8.258 -23.398  11.856
  156   2HH2  ARG  19          2HH2      ARG  19  -6.634 -23.392  12.457
  157    H    LEU  20           H        LEU  20  -4.079 -25.251   6.903
  158    HA   LEU  20           HA       LEU  20  -4.079 -22.467   6.845
  159   1HB   LEU  20          2HB       LEU  20  -1.852 -22.589   7.724
  160   2HB   LEU  20          1HB       LEU  20  -2.824 -23.855   8.449
  161    HG   LEU  20           HG       LEU  20  -1.729 -25.249   6.419
  162   1HD1  LEU  20          1HD1      LEU  20   0.235 -23.079   7.121
  163   2HD1  LEU  20          2HD1      LEU  20  -0.392 -23.494   5.525
  164   3HD1  LEU  20          3HD1      LEU  20   0.691 -24.605   6.364
  165   1HD2  LEU  20          1HD2      LEU  20  -0.767 -26.406   8.087
  166   2HD2  LEU  20          2HD2      LEU  20  -1.600 -25.266   9.139
  167   3HD2  LEU  20          3HD2      LEU  20   0.088 -24.996   8.707
  168    H    TRP  21           H        TRP  21  -2.801 -24.799   4.568
  169    HA   TRP  21           HA       TRP  21  -1.092 -23.093   3.132
  170   1HB   TRP  21          2HB       TRP  21  -1.218 -25.597   2.922
  171   2HB   TRP  21          1HB       TRP  21  -2.686 -25.382   1.972
  172    HD1  TRP  21           HD       TRP  21   0.889 -23.848   1.798
  173    HE1  TRP  21           1HE      TRP  21   1.643 -23.905  -0.662
  174    HE3  TRP  21           3HE      TRP  21  -3.264 -25.989  -0.278
  175    HZ2  TRP  21           2HZ      TRP  21   0.614 -24.743  -3.152
  176    HZ3  TRP  21           3HZ      TRP  21  -3.298 -26.382  -2.706
  177    HH2  TRP  21           HH       TRP  21  -1.399 -25.772  -4.112
  178    H    VAL  22           H        VAL  22  -4.385 -24.141   2.214
  179    HA   VAL  22           HA       VAL  22  -4.667 -22.268   0.133
  180    HB   VAL  22           HB       VAL  22  -6.931 -23.472   1.720
  181   1HG1  VAL  22          1HG1      VAL  22  -8.286 -22.558   0.212
  182   2HG1  VAL  22          2HG1      VAL  22  -7.327 -23.199  -1.123
  183   3HG1  VAL  22          3HG1      VAL  22  -6.902 -21.649  -0.396
  184   1HG2  VAL  22          1HG2      VAL  22  -6.108 -25.454   1.083
  185   2HG2  VAL  22          2HG2      VAL  22  -4.978 -24.722  -0.056
  186   3HG2  VAL  22          3HG2      VAL  22  -6.652 -25.009  -0.533
  187    H    ALA  23           H        ALA  23  -5.799 -22.174   3.503
  188    HA   ALA  23           HA       ALA  23  -7.198 -19.771   3.385
  189   1HB   ALA  23          1HB       ALA  23  -5.641 -20.463   5.834
  190   2HB   ALA  23          2HB       ALA  23  -6.945 -21.526   5.302
  191   3HB   ALA  23          3HB       ALA  23  -7.283 -19.838   5.682
  192    H    PHE  24           H        PHE  24  -3.826 -20.260   4.461
  193    HA   PHE  24           HA       PHE  24  -3.240 -17.531   4.745
  194   1HB   PHE  24          2HB       PHE  24  -1.509 -19.957   4.337
  195   2HB   PHE  24          1HB       PHE  24  -0.812 -18.347   4.441
  196    HD1  PHE  24           1HD      PHE  24  -3.458 -20.209   6.317
  197    HD2  PHE  24           2HD      PHE  24   0.124 -17.918   6.478
  198    HE1  PHE  24           1HE      PHE  24  -3.478 -20.359   8.769
  199    HE2  PHE  24           2HE      PHE  24   0.110 -18.065   8.933
  200    HZ   PHE  24           HZ       PHE  24  -1.693 -19.287  10.082
  201    H    GLN  25           H        GLN  25  -3.057 -19.678   1.955
  202    HA   GLN  25           HA       GLN  25  -1.560 -18.004   0.278
  203   1HB   GLN  25          2HB       GLN  25  -2.289 -20.450  -0.082
  204   2HB   GLN  25          1HB       GLN  25  -3.772 -19.768  -0.738
  205   1HG   GLN  25          2HG       GLN  25  -1.273 -18.657  -1.819
  206   2HG   GLN  25          1HG       GLN  25  -1.593 -20.348  -2.202
  207   1HE2  GLN  25          1HE2      GLN  25  -1.728 -19.577  -4.401
  208   2HE2  GLN  25          2HE2      GLN  25  -3.213 -18.908  -4.978
  209    H    MET  26           H        MET  26  -5.101 -18.482   0.173
  210    HA   MET  26           HA       MET  26  -5.519 -16.193  -1.444
  211   1HB   MET  26          2HB       MET  26  -7.413 -17.881   0.183
  212   2HB   MET  26          1HB       MET  26  -7.943 -16.555  -0.844
  213   1HG   MET  26          2HG       MET  26  -6.381 -18.935  -1.813
  214   2HG   MET  26          1HG       MET  26  -8.135 -18.789  -1.893
  215   1HE   MET  26          1HE       MET  26  -5.683 -18.408  -5.105
  216   2HE   MET  26          2HE       MET  26  -7.369 -18.897  -5.261
  217   3HE   MET  26          3HE       MET  26  -6.369 -19.581  -3.981
  218    H    MET  27           H        MET  27  -6.279 -16.761   2.009
  219    HA   MET  27           HA       MET  27  -7.179 -14.137   2.485
  220   1HB   MET  27          2HB       MET  27  -6.947 -16.538   3.948
  221   2HB   MET  27          1HB       MET  27  -6.125 -15.299   4.884
  222   1HG   MET  27          2HG       MET  27  -8.032 -14.128   5.267
  223   2HG   MET  27          1HG       MET  27  -8.791 -14.651   3.766
  224   1HE   MET  27          1HE       MET  27  -7.211 -17.540   6.031
  225   2HE   MET  27          2HE       MET  27  -8.310 -17.427   7.405
  226   3HE   MET  27          3HE       MET  27  -7.267 -16.065   6.996
  227    H    LYS  28           H        LYS  28  -4.159 -15.595   3.736
  228    HA   LYS  28           HA       LYS  28  -3.071 -13.135   4.540
  229   1HB   LYS  28          2HB       LYS  28  -2.328 -15.305   5.447
  230   2HB   LYS  28          1HB       LYS  28  -1.602 -15.696   3.899
  231   1HG   LYS  28          2HG       LYS  28  -0.355 -13.394   4.338
  232   2HG   LYS  28          1HG       LYS  28  -0.675 -13.854   6.011
  233   1HD   LYS  28          2HD       LYS  28   0.820 -15.536   5.961
  234   2HD   LYS  28          1HD       LYS  28   0.349 -16.031   4.334
  235   1HE   LYS  28          2HE       LYS  28   2.664 -15.259   4.389
  236   2HE   LYS  28          1HE       LYS  28   1.662 -14.208   3.388
  237   1HZ   LYS  28          1HZ       LYS  28   2.062 -12.476   4.704
  238   2HZ   LYS  28          2HZ       LYS  28   3.313 -13.390   5.380
  239   3HZ   LYS  28          3HZ       LYS  28   1.794 -13.356   6.124
  240    H    GLY  29           H        GLY  29  -2.759 -14.969   1.536
  241   1HA   GLY  29          2HA       GLY  29  -0.673 -13.466   0.396
  242   2HA   GLY  29          1HA       GLY  29  -1.871 -14.383  -0.502
  243    H    ALA  30           H        ALA  30  -4.116 -13.254  -0.528
  244    HA   ALA  30           HA       ALA  30  -3.833 -10.821  -1.898
  245   1HB   ALA  30          1HB       ALA  30  -6.460 -10.824  -1.149
  246   2HB   ALA  30          2HB       ALA  30  -6.042 -12.533  -1.045
  247   3HB   ALA  30          3HB       ALA  30  -5.804 -11.658  -2.556
  248    H    GLY  31           H        GLY  31  -4.812 -11.537   1.431
  249   1HA   GLY  31          2HA       GLY  31  -5.493  -8.930   2.207
  250   2HA   GLY  31          1HA       GLY  31  -4.938 -10.199   3.291
  251    H    TRP  32           H        TRP  32  -2.369 -10.575   2.106
  252    HA   TRP  32           HA       TRP  32  -0.896  -8.615   3.498
  253   1HB   TRP  32          2HB       TRP  32   0.502 -10.371   3.318
  254   2HB   TRP  32          1HB       TRP  32  -0.351 -10.995   1.918
  255    HD1  TRP  32           HD       TRP  32   1.061 -11.135  -0.179
  256    HE1  TRP  32           1HE      TRP  32   3.171  -9.966  -1.075
  257    HE3  TRP  32           3HE      TRP  32   1.784  -7.758   3.593
  258    HZ2  TRP  32           2HZ      TRP  32   4.906  -7.886  -0.293
  259    HZ3  TRP  32           3HZ      TRP  32   3.697  -6.216   3.438
  260    HH2  TRP  32           HH       TRP  32   5.224  -6.282   1.536
  261    H    ALA  33           H        ALA  33  -0.847  -9.211  -0.031
  262    HA   ALA  33           HA       ALA  33   0.370  -6.785  -0.700
  263   1HB   ALA  33          1HB       ALA  33  -0.598  -9.033  -2.078
  264   2HB   ALA  33          2HB       ALA  33   0.377  -7.710  -2.718
  265   3HB   ALA  33          3HB       ALA  33  -1.383  -7.632  -2.806
  266    H    GLY  34           H        GLY  34  -3.072  -7.643  -1.134
  267   1HA   GLY  34          2HA       GLY  34  -3.938  -5.066  -1.776
  268   2HA   GLY  34          1HA       GLY  34  -4.957  -6.341  -1.126
  269    H    GLY  35           H        GLY  35  -3.820  -6.679   1.396
  270   1HA   GLY  35          2HA       GLY  35  -5.107  -4.666   2.855
  271   2HA   GLY  35          1HA       GLY  35  -3.957  -5.811   3.522
  272    H    VAL  36           H        VAL  36  -1.594  -5.156   2.435
  273    HA   VAL  36           HA       VAL  36  -0.891  -2.811   3.850
  274    HB   VAL  36           HB       VAL  36   0.743  -4.288   1.780
  275   1HG1  VAL  36          1HG1      VAL  36   2.437  -2.900   2.210
  276   2HG1  VAL  36          2HG1      VAL  36   2.175  -2.999   3.951
  277   3HG1  VAL  36          3HG1      VAL  36   1.255  -1.848   2.983
  278   1HG2  VAL  36          1HG2      VAL  36  -0.006  -5.747   3.610
  279   2HG2  VAL  36          2HG2      VAL  36   0.673  -4.618   4.779
  280   3HG2  VAL  36          3HG2      VAL  36   1.735  -5.474   3.661
  281    H    PHE  37           H        PHE  37  -1.141  -3.489   0.362
  282    HA   PHE  37           HA       PHE  37  -0.337  -0.962  -0.528
  283   1HB   PHE  37          2HB       PHE  37  -1.879  -3.215  -1.719
  284   2HB   PHE  37          1HB       PHE  37  -1.948  -1.657  -2.532
  285    HD1  PHE  37           1HD      PHE  37   0.360  -4.306  -1.365
  286    HD2  PHE  37           2HD      PHE  37  -0.157  -0.888  -3.847
  287    HE1  PHE  37           1HE      PHE  37   2.508  -4.781  -2.459
  288    HE2  PHE  37           2HE      PHE  37   1.996  -1.359  -4.944
  289    HZ   PHE  37           HZ       PHE  37   3.328  -3.308  -4.251
  290    H    PHE  38           H        PHE  38  -3.702  -2.200  -0.364
  291    HA   PHE  38           HA       PHE  38  -4.857   0.343  -0.776
  292   1HB   PHE  38          2HB       PHE  38  -5.886  -2.298   0.161
  293   2HB   PHE  38          1HB       PHE  38  -6.889  -0.875   0.411
  294    HD1  PHE  38           1HD      PHE  38  -4.736  -2.141  -2.364
  295    HD2  PHE  38           2HD      PHE  38  -8.543  -0.672  -1.157
  296    HE1  PHE  38           1HE      PHE  38  -5.529  -2.300  -4.687
  297    HE2  PHE  38           2HE      PHE  38  -9.343  -0.830  -3.478
  298    HZ   PHE  38           HZ       PHE  38  -7.836  -1.645  -5.247
  299    H    GLY  39           H        GLY  39  -4.018  -1.419   2.168
  300   1HA   GLY  39          2HA       GLY  39  -5.320   0.228   4.015
  301   2HA   GLY  39          1HA       GLY  39  -3.888  -0.727   4.355
  302    H    THR  40           H        THR  40  -1.829   0.305   3.299
  303    HA   THR  40           HA       THR  40  -1.345   2.711   4.636
  304    HB   THR  40           HB       THR  40   0.815   2.692   3.609
  305    HG1  THR  40           1HG      THR  40  -0.309   0.917   1.705
  306   1HG2  THR  40          1HG2      THR  40   1.238   0.955   4.922
  307   2HG2  THR  40          2HG2      THR  40   1.060  -0.031   3.471
  308   3HG2  THR  40          3HG2      THR  40  -0.310   0.191   4.558
  309    H    LEU  41           H        LEU  41  -1.966   2.116   1.185
  310    HA   LEU  41           HA       LEU  41  -1.576   4.743   0.303
  311   1HB   LEU  41          2HB       LEU  41  -2.160   2.373  -0.897
  312   2HB   LEU  41          1HB       LEU  41  -3.678   3.226  -1.088
  313    HG   LEU  41           HG       LEU  41  -2.409   5.099  -2.159
  314   1HD1  LEU  41          1HD1      LEU  41  -0.214   5.031  -1.587
  315   2HD1  LEU  41          2HD1      LEU  41  -0.119   4.103  -3.084
  316   3HD1  LEU  41          3HD1      LEU  41  -0.169   3.268  -1.531
  317   1HD2  LEU  41          1HD2      LEU  41  -2.725   4.168  -4.183
  318   2HD2  LEU  41          2HD2      LEU  41  -3.379   2.820  -3.253
  319   3HD2  LEU  41          3HD2      LEU  41  -1.707   2.774  -3.815
  320    H    LEU  42           H        LEU  42  -4.565   3.120   1.361
  321    HA   LEU  42           HA       LEU  42  -6.261   5.325   0.871
  322   1HB   LEU  42          2HB       LEU  42  -6.473   2.781   2.383
  323   2HB   LEU  42          1HB       LEU  42  -7.625   4.040   2.772
  324    HG   LEU  42           HG       LEU  42  -8.448   2.394   1.093
  325   1HD1  LEU  42          1HD1      LEU  42  -8.325   5.317   0.681
  326   2HD1  LEU  42          2HD1      LEU  42  -9.716   4.259   0.916
  327   3HD1  LEU  42          3HD1      LEU  42  -8.929   4.344  -0.660
  328   1HD2  LEU  42          1HD2      LEU  42  -7.448   2.011  -0.897
  329   2HD2  LEU  42          2HD2      LEU  42  -6.006   2.513  -0.019
  330   3HD2  LEU  42          3HD2      LEU  42  -6.855   3.665  -1.041
  331    H    LEU  43           H        LEU  43  -4.551   4.268   3.800
  332    HA   LEU  43           HA       LEU  43  -5.683   6.240   5.488
  333   1HB   LEU  43          2HB       LEU  43  -3.847   4.090   5.738
  334   2HB   LEU  43          1HB       LEU  43  -3.079   5.517   6.407
  335    HG   LEU  43           HG       LEU  43  -4.290   4.190   8.102
  336   1HD1  LEU  43          1HD1      LEU  43  -5.910   6.636   8.021
  337   2HD1  LEU  43          2HD1      LEU  43  -4.171   6.883   7.868
  338   3HD1  LEU  43          3HD1      LEU  43  -4.822   6.032   9.269
  339   1HD2  LEU  43          1HD2      LEU  43  -6.828   5.076   6.759
  340   2HD2  LEU  43          2HD2      LEU  43  -6.630   3.937   8.092
  341   3HD2  LEU  43          3HD2      LEU  43  -6.103   3.494   6.469
  342    H    ILE  44           H        ILE  44  -2.443   6.060   3.996
  343    HA   ILE  44           HA       ILE  44  -1.672   8.650   4.810
  344    HB   ILE  44           HB       ILE  44  -0.603   7.145   2.423
  345   1HG1  ILE  44          2HG1      ILE  44  -0.572   5.758   4.484
  346   2HG1  ILE  44          1HG1      ILE  44   1.044   6.170   3.924
  347   1HG2  ILE  44          1HG2      ILE  44   1.462   8.419   2.934
  348   2HG2  ILE  44          2HG2      ILE  44   0.569   9.309   4.166
  349   3HG2  ILE  44          3HG2      ILE  44   0.106   9.444   2.470
  350   1HD1  ILE  44          1HD1      ILE  44   1.519   7.335   5.775
  351   2HD1  ILE  44          2HD1      ILE  44   0.201   6.394   6.474
  352   3HD1  ILE  44          3HD1      ILE  44  -0.101   8.028   5.882
  353    H    GLY  45           H        GLY  45  -2.932   7.441   1.703
  354   1HA   GLY  45          2HA       GLY  45  -2.826   9.873   0.316
  355   2HA   GLY  45          1HA       GLY  45  -3.906   8.539  -0.059
  356    H    PHE  46           H        PHE  46  -5.622   8.402   1.974
  357    HA   PHE  46           HA       PHE  46  -7.376  10.547   1.512
  358   1HB   PHE  46          2HB       PHE  46  -7.871   8.137   2.333
  359   2HB   PHE  46          1HB       PHE  46  -7.570   8.786   3.941
  360    HD1  PHE  46           2HD      PHE  46  -9.294  10.313   1.016
  361    HD2  PHE  46           1HD      PHE  46  -9.621   8.849   4.999
  362    HE1  PHE  46           2HE      PHE  46 -11.617  11.118   1.118
  363    HE2  PHE  46           1HE      PHE  46 -11.945   9.649   5.105
  364    HZ   PHE  46           HZ       PHE  46 -12.945  10.785   3.163
  365    H    PHE  47           H        PHE  47  -5.392   9.761   4.358
  366    HA   PHE  47           HA       PHE  47  -6.177  12.003   5.877
  367   1HB   PHE  47          2HB       PHE  47  -4.977   9.868   6.659
  368   2HB   PHE  47          1HB       PHE  47  -3.495  10.654   6.124
  369    HD1  PHE  47           1HD      PHE  47  -6.518  11.782   8.005
  370    HD2  PHE  47           2HD      PHE  47  -2.277  11.453   7.889
  371    HE1  PHE  47           1HE      PHE  47  -6.373  12.958  10.162
  372    HE2  PHE  47           2HE      PHE  47  -2.124  12.628  10.045
  373    HZ   PHE  47           HZ       PHE  47  -4.173  13.381  11.184
  374    H    ARG  48           H        ARG  48  -3.711  11.546   3.435
  375    HA   ARG  48           HA       ARG  48  -2.224  13.893   3.967
  376   1HB   ARG  48          2HB       ARG  48  -2.428  11.963   1.719
  377   2HB   ARG  48          1HB       ARG  48  -1.739  13.537   1.357
  378   1HG   ARG  48          2HG       ARG  48  -0.161  13.161   3.285
  379   2HG   ARG  48          1HG       ARG  48  -0.738  11.495   3.318
  380   1HD   ARG  48          2HD       ARG  48   0.795  12.920   1.174
  381   2HD   ARG  48          1HD       ARG  48   1.189  11.419   2.004
  382    HE   ARG  48           HE       ARG  48  -1.085  11.605   0.138
  383   1HH1  ARG  48          1HH1      ARG  48   1.869  10.043   1.195
  384   2HH1  ARG  48          2HH1      ARG  48   1.727   8.746   0.060
  385   1HH2  ARG  48          1HH2      ARG  48  -1.255   9.893  -1.350
  386   2HH2  ARG  48          2HH2      ARG  48  -0.041   8.658  -1.378
  387    H    VAL  49           H        VAL  49  -4.737  13.232   1.518
  388    HA   VAL  49           HA       VAL  49  -4.804  15.935   0.612
  389    HB   VAL  49           HB       VAL  49  -6.950  13.860   0.189
  390   1HG1  VAL  49          1HG1      VAL  49  -6.706  16.559  -0.597
  391   2HG1  VAL  49          2HG1      VAL  49  -7.924  15.387  -1.099
  392   3HG1  VAL  49          3HG1      VAL  49  -6.445  15.580  -2.039
  393   1HG2  VAL  49          1HG2      VAL  49  -4.900  14.280  -1.885
  394   2HG2  VAL  49          2HG2      VAL  49  -5.713  12.800  -1.374
  395   3HG2  VAL  49          3HG2      VAL  49  -4.360  13.434  -0.434
  396    H    VAL  50           H        VAL  50  -7.137  14.007   2.521
  397    HA   VAL  50           HA       VAL  50  -8.864  16.190   3.013
  398    HB   VAL  50           HB       VAL  50  -8.512  13.753   4.765
  399   1HG1  VAL  50          1HG1      VAL  50 -11.194  14.796   4.453
  400   2HG1  VAL  50          2HG1      VAL  50 -10.091  16.013   5.099
  401   3HG1  VAL  50          3HG1      VAL  50 -10.275  14.466   5.923
  402   1HG2  VAL  50          1HG2      VAL  50 -10.357  12.778   3.413
  403   2HG2  VAL  50          2HG2      VAL  50  -8.858  12.991   2.512
  404   3HG2  VAL  50          3HG2      VAL  50 -10.189  14.125   2.286
  405    H    GLY  51           H        GLY  51  -6.159  14.806   4.804
  406   1HA   GLY  51          2HA       GLY  51  -6.426  16.536   7.059
  407   2HA   GLY  51          1HA       GLY  51  -5.056  15.503   6.699
  408    H    ARG  52           H        ARG  52  -3.615  16.313   4.898
  409    HA   ARG  52           HA       ARG  52  -2.926  19.046   5.534
  410   1HB   ARG  52          2HB       ARG  52  -1.585  16.770   4.170
  411   2HB   ARG  52          1HB       ARG  52  -1.037  18.397   3.788
  412   1HG   ARG  52          2HG       ARG  52   0.347  17.995   5.523
  413   2HG   ARG  52          1HG       ARG  52  -1.037  18.586   6.445
  414   1HD   ARG  52          2HD       ARG  52  -1.554  16.522   7.254
  415   2HD   ARG  52          1HD       ARG  52  -0.950  15.689   5.822
  416    HE   ARG  52           HE       ARG  52   1.250  16.791   7.093
  417   1HH1  ARG  52          1HH1      ARG  52  -1.214  14.429   7.814
  418   2HH1  ARG  52          2HH1      ARG  52  -0.198  13.505   8.868
  419   1HH2  ARG  52          1HH2      ARG  52   2.591  15.578   8.477
  420   2HH2  ARG  52          2HH2      ARG  52   1.963  14.159   9.247
  421    H    MET  53           H        MET  53  -4.388  17.363   2.860
  422    HA   MET  53           HA       MET  53  -5.428  18.188   0.987
  423   1HB   MET  53          2HB       MET  53  -5.909  20.204   2.490
  424   2HB   MET  53          1HB       MET  53  -4.503  20.955   1.745
  425   1HG   MET  53          2HG       MET  53  -6.484  21.720   0.645
  426   2HG   MET  53          1HG       MET  53  -5.565  20.699  -0.458
  427   1HE   MET  53          1HE       MET  53  -7.339  20.803  -1.886
  428   2HE   MET  53          2HE       MET  53  -9.016  20.839  -1.339
  429   3HE   MET  53          3HE       MET  53  -8.350  19.368  -2.049
  430    H    LEU  54           H        LEU  54  -2.868  17.159   0.943
  431    HA   LEU  54           HA       LEU  54  -1.056  16.951  -0.416
  432   1HB   LEU  54          2HB       LEU  54  -3.108  18.231  -2.037
  433   2HB   LEU  54          1HB       LEU  54  -1.488  18.635  -2.576
  434    HG   LEU  54           HG       LEU  54  -2.139  15.769  -2.068
  435   1HD1  LEU  54          1HD1      LEU  54  -4.025  16.692  -3.397
  436   2HD1  LEU  54          2HD1      LEU  54  -3.078  15.472  -4.246
  437   3HD1  LEU  54          3HD1      LEU  54  -2.861  17.180  -4.628
  438   1HD2  LEU  54          1HD2      LEU  54  -0.025  15.716  -2.785
  439   2HD2  LEU  54          2HD2      LEU  54  -0.105  17.355  -3.428
  440   3HD2  LEU  54          3HD2      LEU  54  -0.702  16.001  -4.389
  441    HA   PRO  55           HA       PRO  55   0.698  20.924   1.119
  442   1HB   PRO  55          2HB       PRO  55   2.653  19.817   2.622
  443   2HB   PRO  55          1HB       PRO  55   1.004  20.039   3.215
  444   1HG   PRO  55          2HG       PRO  55   2.344  17.571   2.214
  445   2HG   PRO  55          1HG       PRO  55   1.181  17.761   3.535
  446   1HD   PRO  55          2HD       PRO  55   0.551  16.846   1.014
  447   2HD   PRO  55          1HD       PRO  55  -0.609  17.581   2.133
  448    H    ILE  56           H        ILE  56   2.255  18.035  -0.160
  449    HA   ILE  56           HA       ILE  56   4.630  19.446  -0.979
  450    HB   ILE  56           HB       ILE  56   5.149  17.288  -2.186
  451   1HG1  ILE  56          2HG1      ILE  56   2.897  16.088  -0.604
  452   2HG1  ILE  56          1HG1      ILE  56   2.603  16.710  -2.224
  453   1HG2  ILE  56          1HG2      ILE  56   4.631  17.354   0.774
  454   2HG2  ILE  56          2HG2      ILE  56   6.151  17.622  -0.079
  455   3HG2  ILE  56          3HG2      ILE  56   5.449  16.006  -0.016
  456   1HD1  ILE  56          1HD1      ILE  56   4.422  15.206  -3.038
  457   2HD1  ILE  56          2HD1      ILE  56   3.000  14.380  -2.399
  458   3HD1  ILE  56          3HD1      ILE  56   4.464  14.494  -1.424
  459    H    GLN  57           H        GLN  57   1.639  18.359  -2.469
  460    HA   GLN  57           HA       GLN  57   0.646  18.893  -4.441
  461   1HB   GLN  57          2HB       GLN  57   2.338  21.125  -3.864
  462   2HB   GLN  57          1HB       GLN  57   2.385  20.819  -5.595
  463   1HG   GLN  57          2HG       GLN  57   0.465  21.890  -5.796
  464   2HG   GLN  57          1HG       GLN  57  -0.309  20.621  -4.848
  465   1HE2  GLN  57          1HE2      GLN  57  -1.062  23.360  -4.913
  466   2HE2  GLN  57          2HE2      GLN  57  -0.857  23.996  -3.321
  467    H    GLU  58           H        GLU  58   2.502  16.773  -4.315
  468    HA   GLU  58           HA       GLU  58   3.246  15.221  -5.827
  469   1HB   GLU  58          2HB       GLU  58   2.000  16.999  -7.531
  470   2HB   GLU  58          1HB       GLU  58   3.647  16.959  -8.146
  471   1HG   GLU  58          2HG       GLU  58   2.609  14.314  -7.544
  472   2HG   GLU  58          1HG       GLU  58   1.637  15.177  -8.734
  473    H    ASN  59           H        ASN  59   5.258  14.905  -7.292
  474    HA   ASN  59           HA       ASN  59   7.476  16.128  -5.878
  475   1HB   ASN  59          2HB       ASN  59   7.071  13.598  -6.750
  476   2HB   ASN  59          1HB       ASN  59   8.018  14.238  -8.090
  477   1HD2  ASN  59          1HD2      ASN  59   7.981  13.637  -4.647
  478   2HD2  ASN  59          2HD2      ASN  59   9.694  13.653  -4.430
  479    H    GLN  60           H        GLN  60   6.187  15.986  -9.160
  480    HA   GLN  60           HA       GLN  60   8.324  17.692 -10.141
  481   1HB   GLN  60          2HB       GLN  60   5.944  16.600 -11.651
  482   2HB   GLN  60          1HB       GLN  60   7.398  17.306 -12.342
  483   1HG   GLN  60          2HG       GLN  60   8.647  15.412 -11.167
  484   2HG   GLN  60          1HG       GLN  60   7.061  14.668 -10.967
  485   1HE2  GLN  60          1HE2      GLN  60   8.700  16.417 -13.588
  486   2HE2  GLN  60          2HE2      GLN  60   8.407  15.220 -14.798
  487    H    ALA  61           H        ALA  61   5.169  18.164 -11.526
  488    HA   ALA  61           HA       ALA  61   3.849  20.005 -11.712
  489   1HB   ALA  61          1HB       ALA  61   4.363  21.283  -9.192
  490   2HB   ALA  61          2HB       ALA  61   4.210  19.541  -8.968
  491   3HB   ALA  61          3HB       ALA  61   2.912  20.446  -9.744
  492    HA   PRO  62           HA       PRO  62   6.096  23.497 -13.155
  493   1HB   PRO  62          2HB       PRO  62   4.293  25.241 -11.542
  494   2HB   PRO  62          1HB       PRO  62   4.689  25.318 -13.263
  495   1HG   PRO  62          2HG       PRO  62   2.340  24.362 -12.469
  496   2HG   PRO  62          1HG       PRO  62   3.218  23.600 -13.811
  497   1HD   PRO  62          2HD       PRO  62   2.926  22.693 -10.977
  498   2HD   PRO  62          1HD       PRO  62   2.963  21.733 -12.471
  499    H    ALA  63           H        ALA  63   5.517  23.160  -9.742
  500    HA   ALA  63           HA       ALA  63   7.045  23.358  -8.025
  501   1HB   ALA  63          1HB       ALA  63   8.768  23.617 -10.062
  502   2HB   ALA  63          2HB       ALA  63   9.221  23.863  -8.376
  503   3HB   ALA  63          3HB       ALA  63   8.849  25.250  -9.400
  504    HA   PRO  64           HA       PRO  64   4.941  27.244  -7.025
  505   1HB   PRO  64          2HB       PRO  64   4.515  26.691  -4.423
  506   2HB   PRO  64          1HB       PRO  64   3.527  25.987  -5.708
  507   1HG   PRO  64          2HG       PRO  64   5.814  24.782  -4.201
  508   2HG   PRO  64          1HG       PRO  64   4.261  24.053  -4.648
  509   1HD   PRO  64          2HD       PRO  64   6.568  23.618  -6.032
  510   2HD   PRO  64          1HD       PRO  64   4.960  23.571  -6.783
  511    H    ASN  65           H        ASN  65   5.231  28.506  -4.669
  512    HA   ASN  65           HA       ASN  65   6.592  29.930  -3.529
  513   1HB   ASN  65          2HB       ASN  65   7.536  27.431  -2.996
  514   2HB   ASN  65          1HB       ASN  65   8.977  28.196  -3.659
  515   1HD2  ASN  65          1HD2      ASN  65   9.581  27.658  -1.343
  516   2HD2  ASN  65          2HD2      ASN  65   9.323  28.907  -0.176
  517    H    ILE  66           H        ILE  66   6.485  30.149  -6.369
  518    HA   ILE  66           HA       ILE  66   9.116  30.581  -7.390
  519    HB   ILE  66           HB       ILE  66   7.845  31.815  -9.251
  520   1HG1  ILE  66          2HG1      ILE  66   5.430  30.370  -8.228
  521   2HG1  ILE  66          1HG1      ILE  66   5.773  31.987  -7.634
  522   1HG2  ILE  66          1HG2      ILE  66   8.692  29.598  -9.564
  523   2HG2  ILE  66          2HG2      ILE  66   7.054  29.663 -10.214
  524   3HG2  ILE  66          3HG2      ILE  66   7.352  28.907  -8.650
  525   1HD1  ILE  66          1HD1      ILE  66   4.295  31.449  -9.814
  526   2HD1  ILE  66          2HD1      ILE  66   5.882  31.685 -10.547
  527   3HD1  ILE  66          3HD1      ILE  66   5.169  32.959  -9.557
  528    H    THR  67           H        THR  67   6.484  32.806  -6.456
  529    HA   THR  67           HA       THR  67   6.565  34.886  -5.532
  530    HB   THR  67           HB       THR  67   9.501  35.202  -5.651
  531    HG1  THR  67           1HG      THR  67   9.961  33.433  -4.646
  532   1HG2  THR  67          1HG2      THR  67   9.207  35.872  -3.318
  533   2HG2  THR  67          2HG2      THR  67   7.494  35.467  -3.426
  534   3HG2  THR  67          3HG2      THR  67   8.154  36.778  -4.403
  535    H    GLY  68           H        GLY  68   7.737  33.995  -8.511
  536   1HA   GLY  68          2HA       GLY  68   7.060  36.443  -9.732
  537   2HA   GLY  68          1HA       GLY  68   8.809  36.326  -9.596
  538    H    ALA  69           H        ALA  69   6.931  36.276 -11.938
  539    HA   ALA  69           HA       ALA  69   8.340  34.440 -13.529
  540   1HB   ALA  69          1HB       ALA  69   7.251  32.613 -12.616
  541   2HB   ALA  69          2HB       ALA  69   6.267  32.971 -14.035
  542   3HB   ALA  69          3HB       ALA  69   5.727  33.481 -12.435
  543    H    LEU  70           H        LEU  70   5.379  36.269 -13.035
  544    HA   LEU  70           HA       LEU  70   4.590  36.472 -15.731
  545   1HB   LEU  70          2HB       LEU  70   3.349  37.090 -13.513
  546   2HB   LEU  70          1HB       LEU  70   4.092  38.660 -13.749
  547    HG   LEU  70           HG       LEU  70   2.542  37.455 -15.998
  548   1HD1  LEU  70          1HD1      LEU  70   0.592  38.843 -14.938
  549   2HD1  LEU  70          2HD1      LEU  70   1.434  38.485 -13.431
  550   3HD1  LEU  70          3HD1      LEU  70   0.864  37.170 -14.459
  551   1HD2  LEU  70          1HD2      LEU  70   1.960  39.929 -16.227
  552   2HD2  LEU  70          2HD2      LEU  70   3.622  39.453 -16.570
  553   3HD2  LEU  70          3HD2      LEU  70   3.222  40.213 -15.030
  554    H    GLU  71           H        GLU  71   6.499  38.655 -13.675
  555    HA   GLU  71           HA       GLU  71   8.214  39.449 -15.759
  556   1HB   GLU  71          2HB       GLU  71   5.881  40.638 -16.195
  557   2HB   GLU  71          1HB       GLU  71   6.498  41.762 -14.993
  558   1HG   GLU  71          2HG       GLU  71   7.962  42.667 -16.413
  559   2HG   GLU  71          1HG       GLU  71   8.423  41.103 -17.085
  560    H    HIS  72           H        HIS  72   9.762  41.075 -15.089
  561    HA   HIS  72           HA       HIS  72   9.795  41.508 -12.175
  562   1HB   HIS  72          2HB       HIS  72  11.541  39.878 -13.601
  563   2HB   HIS  72          1HB       HIS  72  12.446  41.371 -13.375
  564    HD1  HIS  72           1HD      HIS  72  12.742  38.429 -11.931
  565    HD2  HIS  72           2HD      HIS  72  11.400  42.003 -10.293
  566    HE1  HIS  72           1HE      HIS  72  13.107  38.212  -9.451
  567    HE2  HIS  72           2HE      HIS  72  12.216  40.358  -8.474
  568    H    HIS  73           H        HIS  73   9.823  43.587 -11.657
  569    HA   HIS  73           HA       HIS  73  11.551  45.476 -12.879
  570   1HB   HIS  73          2HB       HIS  73   9.355  45.097 -14.409
  571   2HB   HIS  73          1HB       HIS  73   8.757  46.350 -13.326
  572    HD1  HIS  73           1HD      HIS  73   9.123  46.957 -16.298
  573    HD2  HIS  73           2HD      HIS  73  12.038  47.660 -13.423
  574    HE1  HIS  73           1HE      HIS  73  10.612  48.734 -17.271
  575    HE2  HIS  73           2HE      HIS  73  12.311  49.210 -15.474
  576    H    HIS  74           H        HIS  74   8.267  45.727 -11.508
  577    HA   HIS  74           HA       HIS  74   9.116  47.757  -9.662
  578   1HB   HIS  74          2HB       HIS  74   6.735  47.508  -8.802
  579   2HB   HIS  74          1HB       HIS  74   6.904  47.993 -10.486
  580    HD1  HIS  74           1HD      HIS  74   5.270  46.838 -11.919
  581    HD2  HIS  74           2HD      HIS  74   6.504  44.438  -8.758
  582    HE1  HIS  74           1HE      HIS  74   4.024  44.671 -12.194
  583    HE2  HIS  74           2HE      HIS  74   4.721  43.266 -10.221
  584    H    HIS  75           H        HIS  75   8.199  47.449  -7.295
  585    HA   HIS  75           HA       HIS  75   8.486  46.470  -5.264
  586   1HB   HIS  75          2HB       HIS  75   7.343  44.503  -6.901
  587   2HB   HIS  75          1HB       HIS  75   8.660  43.692  -6.063
  588    HD1  HIS  75           1HD      HIS  75   7.993  42.716  -3.902
  589    HD2  HIS  75           2HD      HIS  75   5.659  46.009  -4.885
  590    HE1  HIS  75           1HE      HIS  75   6.296  42.911  -2.057
  591    HE2  HIS  75           2HE      HIS  75   4.850  44.869  -2.709
  592    H    HIS  76           H        HIS  76  10.797  46.915  -7.230
  593    HA   HIS  76           HA       HIS  76  12.857  46.043  -5.489
  594   1HB   HIS  76          2HB       HIS  76  12.080  44.023  -7.125
  595   2HB   HIS  76          1HB       HIS  76  13.310  44.784  -8.127
  596    HD1  HIS  76           1HD      HIS  76  14.966  42.845  -7.868
  597    HD2  HIS  76           2HD      HIS  76  13.821  44.556  -4.260
  598    HE1  HIS  76           1HE      HIS  76  16.551  41.914  -6.150
  599    HE2  HIS  76           2HE      HIS  76  15.795  42.912  -3.963
  600    H    HIS  77           H        HIS  77  12.573  48.499  -6.024
  601    HA   HIS  77           HA       HIS  77  13.526  50.390  -6.852
  602   1HB   HIS  77          2HB       HIS  77  15.607  48.325  -7.489
  603   2HB   HIS  77          1HB       HIS  77  15.807  49.980  -8.059
  604    HD1  HIS  77           1HD      HIS  77  14.153  50.340  -4.965
  605    HD2  HIS  77           2HD      HIS  77  18.056  49.427  -6.059
  606    HE1  HIS  77           1HE      HIS  77  15.560  50.866  -2.946
  607    HE2  HIS  77           2HE      HIS  77  17.904  50.221  -3.603
  Start of MODEL    4
    1   1H    ALA   1          1HT       ALA   1  -4.813 -53.435   7.168
    2   2H    ALA   1          2HT       ALA   1  -3.555 -53.119   6.044
    3   3H    ALA   1          3HT       ALA   1  -5.099 -53.625   5.489
    4    HA   ALA   1           HA       ALA   1  -5.267 -51.456   5.098
    5   1HB   ALA   1          1HB       ALA   1  -6.338 -50.398   7.227
    6   2HB   ALA   1          2HB       ALA   1  -6.193 -52.031   7.877
    7   3HB   ALA   1          3HB       ALA   1  -7.135 -51.745   6.415
    8    H    ASP   2           H        ASP   2  -3.534 -50.227   4.666
    9    HA   ASP   2           HA       ASP   2  -1.413 -49.690   6.414
   10   1HB   ASP   2          2HB       ASP   2  -2.394 -48.443   3.872
   11   2HB   ASP   2          1HB       ASP   2  -1.104 -47.659   4.781
   12    H    LYS   3           H        LYS   3  -4.490 -48.106   5.947
   13    HA   LYS   3           HA       LYS   3  -4.023 -45.635   7.112
   14   1HB   LYS   3          2HB       LYS   3  -6.342 -47.306   6.541
   15   2HB   LYS   3          1HB       LYS   3  -6.571 -46.321   7.978
   16   1HG   LYS   3          2HG       LYS   3  -6.902 -44.497   6.766
   17   2HG   LYS   3          1HG       LYS   3  -5.416 -44.761   5.851
   18   1HD   LYS   3          2HD       LYS   3  -7.996 -46.212   5.288
   19   2HD   LYS   3          1HD       LYS   3  -7.532 -44.710   4.486
   20   1HE   LYS   3          2HE       LYS   3  -5.289 -46.215   4.160
   21   2HE   LYS   3          1HE       LYS   3  -6.549 -47.448   4.093
   22   1HZ   LYS   3          1HZ       LYS   3  -7.445 -46.564   2.203
   23   2HZ   LYS   3          2HZ       LYS   3  -5.815 -46.182   1.954
   24   3HZ   LYS   3          3HZ       LYS   3  -6.884 -44.998   2.515
   25    H    THR   4           H        THR   4  -3.225 -45.137   9.045
   26    HA   THR   4           HA       THR   4  -4.311 -46.196  11.450
   27    HB   THR   4           HB       THR   4  -1.796 -46.954  12.084
   28    HG1  THR   4           1HG      THR   4  -0.804 -47.894  10.414
   29   1HG2  THR   4          1HG2      THR   4  -2.844 -48.839  12.545
   30   2HG2  THR   4          2HG2      THR   4  -2.992 -49.213  10.828
   31   3HG2  THR   4          3HG2      THR   4  -4.240 -48.263  11.634
   32    H    ILE   5           H        ILE   5  -1.573 -44.543   9.940
   33    HA   ILE   5           HA       ILE   5  -0.182 -42.896  10.750
   34    HB   ILE   5           HB       ILE   5  -1.452 -40.782  11.139
   35   1HG1  ILE   5          2HG1      ILE   5  -3.976 -42.240  10.459
   36   2HG1  ILE   5          1HG1      ILE   5  -3.445 -42.207  12.138
   37   1HG2  ILE   5          1HG2      ILE   5  -1.399 -42.449   8.806
   38   2HG2  ILE   5          2HG2      ILE   5  -1.258 -40.696   8.935
   39   3HG2  ILE   5          3HG2      ILE   5  -2.850 -41.445   8.803
   40   1HD1  ILE   5          1HD1      ILE   5  -4.129 -39.868  10.386
   41   2HD1  ILE   5          2HD1      ILE   5  -3.351 -39.714  11.961
   42   3HD1  ILE   5          3HD1      ILE   5  -4.963 -40.418  11.838
   43    H    PHE   6           H        PHE   6  -1.893 -41.090  12.909
   44    HA   PHE   6           HA       PHE   6  -1.850 -40.789  15.150
   45   1HB   PHE   6          2HB       PHE   6  -1.904 -43.725  14.875
   46   2HB   PHE   6          1HB       PHE   6  -1.275 -43.137  16.410
   47    HD1  PHE   6           1HD      PHE   6  -2.708 -41.521  17.742
   48    HD2  PHE   6           2HD      PHE   6  -4.195 -43.795  14.468
   49    HE1  PHE   6           1HE      PHE   6  -5.005 -41.183  18.555
   50    HE2  PHE   6           2HE      PHE   6  -6.494 -43.460  15.273
   51    HZ   PHE   6           HZ       PHE   6  -6.903 -42.153  17.319
   52    H    ASN   7           H        ASN   7   0.467 -43.460  15.228
   53    HA   ASN   7           HA       ASN   7   2.393 -41.837  16.577
   54   1HB   ASN   7          2HB       ASN   7   3.799 -43.843  16.555
   55   2HB   ASN   7          1HB       ASN   7   2.160 -44.231  17.069
   56   1HD2  ASN   7          1HD2      ASN   7   4.630 -44.812  14.800
   57   2HD2  ASN   7          2HD2      ASN   7   3.780 -45.951  13.817
   58    H    ASP   8           H        ASP   8   1.961 -42.980  13.292
   59    HA   ASP   8           HA       ASP   8   4.552 -42.266  12.366
   60   1HB   ASP   8          2HB       ASP   8   2.047 -43.253  11.197
   61   2HB   ASP   8          1HB       ASP   8   2.965 -42.199  10.125
   62    H    HIS   9           H        HIS   9   1.375 -40.695  12.065
   63    HA   HIS   9           HA       HIS   9   0.811 -38.483  11.997
   64   1HB   HIS   9          2HB       HIS   9   3.789 -37.950  12.106
   65   2HB   HIS   9          1HB       HIS   9   2.540 -36.714  12.157
   66    HD1  HIS   9           1HD      HIS   9   0.650 -37.477  14.217
   67    HD2  HIS   9           2HD      HIS   9   4.685 -38.385  14.610
   68    HE1  HIS   9           1HE      HIS   9   1.026 -37.815  16.680
   69    HE2  HIS   9           2HE      HIS   9   3.467 -38.401  16.893
   70    H    LEU  10           H        LEU  10   1.467 -36.435  10.507
   71    HA   LEU  10           HA       LEU  10   1.709 -35.580   8.406
   72   1HB   LEU  10          2HB       LEU  10   2.727 -38.264   7.490
   73   2HB   LEU  10          1HB       LEU  10   2.968 -36.706   6.724
   74    HG   LEU  10           HG       LEU  10   4.191 -37.638   9.321
   75   1HD1  LEU  10          1HD1      LEU  10   6.299 -37.409   8.088
   76   2HD1  LEU  10          2HD1      LEU  10   5.394 -36.998   6.630
   77   3HD1  LEU  10          3HD1      LEU  10   5.230 -38.601   7.348
   78   1HD2  LEU  10          1HD2      LEU  10   5.432 -35.466   9.186
   79   2HD2  LEU  10          2HD2      LEU  10   3.717 -35.315   9.566
   80   3HD2  LEU  10          3HD2      LEU  10   4.294 -34.965   7.936
   81    H    ASN  11           H        ASN  11  -0.462 -35.317   8.073
   82    HA   ASN  11           HA       ASN  11  -2.221 -37.429   7.359
   83   1HB   ASN  11          2HB       ASN  11  -3.810 -35.598   6.796
   84   2HB   ASN  11          1HB       ASN  11  -3.100 -35.428   8.398
   85   1HD2  ASN  11          1HD2      ASN  11  -3.992 -33.748   5.784
   86   2HD2  ASN  11          2HD2      ASN  11  -2.896 -32.416   5.879
   87    H    THR  12           H        THR  12  -0.144 -35.302   5.563
   88    HA   THR  12           HA       THR  12   0.417 -35.173   3.375
   89    HB   THR  12           HB       THR  12  -0.853 -37.915   3.226
   90    HG1  THR  12           1HG      THR  12   1.737 -37.027   3.907
   91   1HG2  THR  12          1HG2      THR  12   1.109 -36.560   1.396
   92   2HG2  THR  12          2HG2      THR  12  -0.520 -37.104   0.999
   93   3HG2  THR  12          3HG2      THR  12   0.738 -38.283   1.369
   94    H    ASN  13           H        ASN  13  -2.161 -37.144   2.154
   95    HA   ASN  13           HA       ASN  13  -3.760 -36.592   0.604
   96   1HB   ASN  13          2HB       ASN  13  -4.616 -36.169   3.127
   97   2HB   ASN  13          1HB       ASN  13  -4.889 -34.573   2.440
   98   1HD2  ASN  13          1HD2      ASN  13  -5.923 -34.719   0.157
   99   2HD2  ASN  13          2HD2      ASN  13  -7.291 -35.767   0.050
  100    HA   PRO  14           HA       PRO  14  -1.683 -32.987  -1.308
  101   1HB   PRO  14          2HB       PRO  14  -3.349 -34.062  -3.534
  102   2HB   PRO  14          1HB       PRO  14  -1.656 -33.554  -3.536
  103   1HG   PRO  14          2HG       PRO  14  -2.299 -36.138  -3.544
  104   2HG   PRO  14          1HG       PRO  14  -0.919 -35.543  -2.602
  105   1HD   PRO  14          2HD       PRO  14  -3.627 -36.385  -1.679
  106   2HD   PRO  14          1HD       PRO  14  -2.051 -36.571  -0.882
  107    H    LYS  15           H        LYS  15  -5.102 -33.904  -1.715
  108    HA   LYS  15           HA       LYS  15  -6.088 -31.505  -2.659
  109   1HB   LYS  15          2HB       LYS  15  -7.189 -33.905  -1.877
  110   2HB   LYS  15          1HB       LYS  15  -7.880 -32.770  -0.725
  111   1HG   LYS  15          2HG       LYS  15  -9.431 -32.488  -2.321
  112   2HG   LYS  15          1HG       LYS  15  -8.231 -31.399  -3.018
  113   1HD   LYS  15          2HD       LYS  15  -7.407 -33.761  -4.042
  114   2HD   LYS  15          1HD       LYS  15  -9.145 -34.047  -3.929
  115   1HE   LYS  15          2HE       LYS  15  -9.131 -31.568  -4.989
  116   2HE   LYS  15          1HE       LYS  15  -7.630 -32.202  -5.660
  117   1HZ   LYS  15          1HZ       LYS  15 -10.361 -32.894  -6.280
  118   2HZ   LYS  15          2HZ       LYS  15  -9.347 -34.232  -6.077
  119   3HZ   LYS  15          3HZ       LYS  15  -8.963 -33.048  -7.223
  120    H    THR  16           H        THR  16  -5.742 -32.488   0.759
  121    HA   THR  16           HA       THR  16  -6.725 -29.988   1.728
  122    HB   THR  16           HB       THR  16  -6.791 -32.213   2.953
  123    HG1  THR  16           1HG      THR  16  -6.547 -31.171   4.967
  124   1HG2  THR  16          1HG2      THR  16  -3.918 -31.811   2.980
  125   2HG2  THR  16          2HG2      THR  16  -4.872 -33.242   3.352
  126   3HG2  THR  16          3HG2      THR  16  -4.598 -32.023   4.590
  127    H    ASN  17           H        ASN  17  -3.565 -31.216   0.912
  128    HA   ASN  17           HA       ASN  17  -1.999 -29.351   2.315
  129   1HB   ASN  17          2HB       ASN  17  -1.527 -31.001  -0.155
  130   2HB   ASN  17          1HB       ASN  17  -0.312 -29.862   0.420
  131   1HD2  ASN  17          1HD2      ASN  17  -0.231 -32.775   0.224
  132   2HD2  ASN  17          2HD2      ASN  17   0.112 -33.349   1.817
  133    H    LEU  18           H        LEU  18  -2.945 -29.339  -1.126
  134    HA   LEU  18           HA       LEU  18  -1.960 -26.764  -1.667
  135   1HB   LEU  18          2HB       LEU  18  -3.104 -28.818  -3.127
  136   2HB   LEU  18          1HB       LEU  18  -4.274 -27.520  -3.270
  137    HG   LEU  18           HG       LEU  18  -2.000 -26.162  -3.815
  138   1HD1  LEU  18          1HD1      LEU  18  -0.434 -27.399  -4.990
  139   2HD1  LEU  18          2HD1      LEU  18  -1.531 -28.761  -5.220
  140   3HD1  LEU  18          3HD1      LEU  18  -0.824 -28.457  -3.634
  141   1HD2  LEU  18          1HD2      LEU  18  -2.968 -25.861  -5.818
  142   2HD2  LEU  18          2HD2      LEU  18  -4.282 -26.817  -5.132
  143   3HD2  LEU  18          3HD2      LEU  18  -3.064 -27.590  -6.147
  144    H    ARG  19           H        ARG  19  -5.134 -27.899  -0.612
  145    HA   ARG  19           HA       ARG  19  -6.515 -25.472  -0.894
  146   1HB   ARG  19          2HB       ARG  19  -7.416 -27.847  -0.390
  147   2HB   ARG  19          1HB       ARG  19  -7.118 -27.442   1.295
  148   1HG   ARG  19          2HG       ARG  19  -8.631 -25.569   1.156
  149   2HG   ARG  19          1HG       ARG  19  -8.862 -25.848  -0.570
  150   1HD   ARG  19          2HD       ARG  19 -10.027 -27.858  -0.196
  151   2HD   ARG  19          1HD       ARG  19  -9.492 -27.949   1.482
  152    HE   ARG  19           HE       ARG  19 -10.925 -25.647   1.392
  153   1HH1  ARG  19          1HH1      ARG  19 -11.604 -28.946   0.473
  154   2HH1  ARG  19          2HH1      ARG  19 -13.301 -28.817   0.793
  155   1HH2  ARG  19          1HH2      ARG  19 -13.154 -25.475   1.813
  156   2HH2  ARG  19          2HH2      ARG  19 -14.182 -26.845   1.557
  157    H    LEU  20           H        LEU  20  -4.917 -26.877   1.960
  158    HA   LEU  20           HA       LEU  20  -5.424 -24.728   3.694
  159   1HB   LEU  20          2HB       LEU  20  -3.577 -27.047   3.655
  160   2HB   LEU  20          1HB       LEU  20  -3.158 -25.728   4.730
  161    HG   LEU  20           HG       LEU  20  -5.946 -26.408   5.036
  162   1HD1  LEU  20          1HD1      LEU  20  -5.964 -28.619   4.991
  163   2HD1  LEU  20          2HD1      LEU  20  -4.716 -28.654   6.236
  164   3HD1  LEU  20          3HD1      LEU  20  -4.262 -28.647   4.532
  165   1HD2  LEU  20          1HD2      LEU  20  -4.370 -25.183   6.601
  166   2HD2  LEU  20          2HD2      LEU  20  -3.716 -26.767   7.019
  167   3HD2  LEU  20          3HD2      LEU  20  -5.414 -26.405   7.328
  168    H    TRP  21           H        TRP  21  -2.746 -25.374   1.481
  169    HA   TRP  21           HA       TRP  21  -1.057 -23.288   2.301
  170   1HB   TRP  21          2HB       TRP  21  -0.979 -25.295   0.379
  171   2HB   TRP  21          1HB       TRP  21  -0.931 -23.807  -0.562
  172    HD1  TRP  21           HD       TRP  21   1.044 -21.976   0.426
  173    HE1  TRP  21           1HE      TRP  21   3.467 -22.544   1.080
  174    HE3  TRP  21           3HE      TRP  21   0.524 -27.006   1.177
  175    HZ2  TRP  21           2HZ      TRP  21   4.961 -24.823   1.818
  176    HZ3  TRP  21           3HZ      TRP  21   2.500 -28.307   1.855
  177    HH2  TRP  21           HH       TRP  21   4.672 -27.237   2.168
  178    H    VAL  22           H        VAL  22  -3.363 -23.380  -0.423
  179    HA   VAL  22           HA       VAL  22  -3.035 -20.690  -1.166
  180    HB   VAL  22           HB       VAL  22  -5.510 -22.379  -1.551
  181   1HG1  VAL  22          1HG1      VAL  22  -4.752 -19.695  -2.378
  182   2HG1  VAL  22          2HG1      VAL  22  -6.328 -20.485  -2.406
  183   3HG1  VAL  22          3HG1      VAL  22  -5.198 -20.725  -3.738
  184   1HG2  VAL  22          1HG2      VAL  22  -4.087 -22.339  -3.930
  185   2HG2  VAL  22          2HG2      VAL  22  -4.221 -23.694  -2.810
  186   3HG2  VAL  22          3HG2      VAL  22  -2.852 -22.589  -2.696
  187    H    ALA  23           H        ALA  23  -5.376 -22.248   1.005
  188    HA   ALA  23           HA       ALA  23  -6.947 -19.989   1.527
  189   1HB   ALA  23          1HB       ALA  23  -8.072 -21.331   2.922
  190   2HB   ALA  23          2HB       ALA  23  -6.620 -21.792   3.809
  191   3HB   ALA  23          3HB       ALA  23  -7.027 -22.605   2.299
  192    H    PHE  24           H        PHE  24  -4.182 -21.298   3.350
  193    HA   PHE  24           HA       PHE  24  -4.124 -19.287   5.311
  194   1HB   PHE  24          2HB       PHE  24  -2.785 -21.628   4.927
  195   2HB   PHE  24          1HB       PHE  24  -1.521 -20.458   4.564
  196    HD1  PHE  24           1HD      PHE  24  -1.155 -18.585   6.311
  197    HD2  PHE  24           2HD      PHE  24  -3.218 -22.219   7.115
  198    HE1  PHE  24           1HE      PHE  24  -0.749 -18.278   8.718
  199    HE2  PHE  24           2HE      PHE  24  -2.817 -21.917   9.524
  200    HZ   PHE  24           HZ       PHE  24  -1.581 -19.945  10.329
  201    H    GLN  25           H        GLN  25  -2.448 -19.569   2.202
  202    HA   GLN  25           HA       GLN  25  -0.843 -17.276   2.468
  203   1HB   GLN  25          2HB       GLN  25  -0.675 -19.157   0.739
  204   2HB   GLN  25          1HB       GLN  25  -1.922 -18.294  -0.151
  205   1HG   GLN  25          2HG       GLN  25  -0.221 -16.281   0.222
  206   2HG   GLN  25          1HG       GLN  25   0.924 -17.622   0.269
  207   1HE2  GLN  25          1HE2      GLN  25  -1.534 -16.031  -1.655
  208   2HE2  GLN  25          2HE2      GLN  25  -0.987 -16.616  -3.186
  209    H    MET  26           H        MET  26  -4.039 -17.724   0.992
  210    HA   MET  26           HA       MET  26  -4.334 -15.038   0.147
  211   1HB   MET  26          2HB       MET  26  -5.813 -17.444  -0.041
  212   2HB   MET  26          1HB       MET  26  -6.882 -16.244   0.671
  213   1HG   MET  26          2HG       MET  26  -7.290 -15.929  -1.550
  214   2HG   MET  26          1HG       MET  26  -6.017 -14.741  -1.276
  215   1HE   MET  26          1HE       MET  26  -4.334 -14.423  -3.042
  216   2HE   MET  26          2HE       MET  26  -3.231 -15.716  -3.516
  217   3HE   MET  26          3HE       MET  26  -3.403 -15.283  -1.815
  218    H    MET  27           H        MET  27  -5.416 -16.773   3.042
  219    HA   MET  27           HA       MET  27  -6.884 -14.640   4.153
  220   1HB   MET  27          2HB       MET  27  -5.614 -17.091   5.357
  221   2HB   MET  27          1HB       MET  27  -6.485 -15.919   6.338
  222   1HG   MET  27          2HG       MET  27  -8.362 -16.307   4.539
  223   2HG   MET  27          1HG       MET  27  -7.507 -17.830   4.307
  224   1HE   MET  27          1HE       MET  27 -10.110 -18.820   5.045
  225   2HE   MET  27          2HE       MET  27 -10.542 -17.130   5.305
  226   3HE   MET  27          3HE       MET  27 -10.837 -18.321   6.573
  227    H    LYS  28           H        LYS  28  -3.616 -15.820   4.978
  228    HA   LYS  28           HA       LYS  28  -3.030 -13.670   6.714
  229   1HB   LYS  28          2HB       LYS  28  -1.682 -16.014   5.727
  230   2HB   LYS  28          1HB       LYS  28  -0.595 -14.636   5.663
  231   1HG   LYS  28          2HG       LYS  28  -1.587 -14.298   8.127
  232   2HG   LYS  28          1HG       LYS  28  -1.732 -16.052   7.985
  233   1HD   LYS  28          2HD       LYS  28   0.555 -16.351   7.760
  234   2HD   LYS  28          1HD       LYS  28   0.820 -14.694   7.216
  235   1HE   LYS  28          2HE       LYS  28   0.765 -13.840   9.353
  236   2HE   LYS  28          1HE       LYS  28  -0.217 -15.168   9.971
  237   1HZ   LYS  28          1HZ       LYS  28   1.619 -16.561  10.112
  238   2HZ   LYS  28          2HZ       LYS  28   2.229 -15.075  10.637
  239   3HZ   LYS  28          3HZ       LYS  28   2.559 -15.617   9.069
  240    H    GLY  29           H        GLY  29  -2.055 -14.316   3.350
  241   1HA   GLY  29          2HA       GLY  29  -0.572 -11.989   2.942
  242   2HA   GLY  29          1HA       GLY  29  -1.380 -12.900   1.676
  243    H    ALA  30           H        ALA  30  -3.756 -12.454   1.425
  244    HA   ALA  30           HA       ALA  30  -4.176  -9.727   0.978
  245   1HB   ALA  30          1HB       ALA  30  -6.571 -10.374   0.646
  246   2HB   ALA  30          2HB       ALA  30  -6.140 -12.003   1.166
  247   3HB   ALA  30          3HB       ALA  30  -5.415 -11.320  -0.289
  248    H    GLY  31           H        GLY  31  -4.793 -11.703   3.788
  249   1HA   GLY  31          2HA       GLY  31  -6.646 -10.039   5.100
  250   2HA   GLY  31          1HA       GLY  31  -5.574 -11.185   5.886
  251    H    TRP  32           H        TRP  32  -3.341 -10.456   6.310
  252    HA   TRP  32           HA       TRP  32  -3.405  -7.861   7.503
  253   1HB   TRP  32          2HB       TRP  32  -1.674  -8.589   8.745
  254   2HB   TRP  32          1HB       TRP  32  -2.085 -10.156   8.071
  255    HD1  TRP  32           HD       TRP  32  -0.451 -11.115   6.128
  256    HE1  TRP  32           1HE      TRP  32   2.008 -10.601   5.588
  257    HE3  TRP  32           3HE      TRP  32   0.050  -6.754   8.741
  258    HZ2  TRP  32           2HZ      TRP  32   3.915  -8.611   6.197
  259    HZ3  TRP  32           3HZ      TRP  32   2.227  -5.608   8.714
  260    HH2  TRP  32           HH       TRP  32   4.120  -6.519   7.469
  261    H    ALA  33           H        ALA  33  -1.444  -9.258   4.860
  262    HA   ALA  33           HA       ALA  33  -0.019  -6.934   4.250
  263   1HB   ALA  33          1HB       ALA  33  -0.827  -8.767   2.043
  264   2HB   ALA  33          2HB       ALA  33   0.192  -9.393   3.339
  265   3HB   ALA  33          3HB       ALA  33   0.735  -8.020   2.375
  266    H    GLY  34           H        GLY  34  -3.180  -8.081   3.163
  267   1HA   GLY  34          2HA       GLY  34  -3.639  -6.024   1.272
  268   2HA   GLY  34          1HA       GLY  34  -4.877  -7.007   2.042
  269    H    GLY  35           H        GLY  35  -4.403  -6.320   4.732
  270   1HA   GLY  35          2HA       GLY  35  -5.922  -3.962   4.955
  271   2HA   GLY  35          1HA       GLY  35  -5.032  -4.723   6.266
  272    H    VAL  36           H        VAL  36  -2.452  -4.510   5.401
  273    HA   VAL  36           HA       VAL  36  -1.822  -1.828   6.067
  274    HB   VAL  36           HB       VAL  36   0.014  -3.911   4.874
  275   1HG1  VAL  36          1HG1      VAL  36   0.419  -1.268   6.184
  276   2HG1  VAL  36          2HG1      VAL  36   1.275  -2.000   4.826
  277   3HG1  VAL  36          3HG1      VAL  36   1.607  -2.540   6.472
  278   1HG2  VAL  36          1HG2      VAL  36   0.161  -3.547   7.752
  279   2HG2  VAL  36          2HG2      VAL  36   0.043  -5.028   6.802
  280   3HG2  VAL  36          3HG2      VAL  36  -1.417  -4.137   7.228
  281    H    PHE  37           H        PHE  37  -1.371  -3.680   3.059
  282    HA   PHE  37           HA       PHE  37  -0.355  -1.584   1.516
  283   1HB   PHE  37          2HB       PHE  37  -0.546  -4.163   1.041
  284   2HB   PHE  37          1HB       PHE  37  -2.057  -3.703   0.263
  285    HD1  PHE  37           2HD      PHE  37   1.594  -3.430   0.144
  286    HD2  PHE  37           1HD      PHE  37  -2.070  -2.442  -1.784
  287    HE1  PHE  37           2HE      PHE  37   2.834  -2.816  -1.890
  288    HE2  PHE  37           1HE      PHE  37  -0.836  -1.826  -3.822
  289    HZ   PHE  37           HZ       PHE  37   1.620  -2.012  -3.876
  290    H    PHE  38           H        PHE  38  -3.678  -2.902   1.464
  291    HA   PHE  38           HA       PHE  38  -4.711  -0.833  -0.141
  292   1HB   PHE  38          2HB       PHE  38  -5.703  -3.202   1.040
  293   2HB   PHE  38          1HB       PHE  38  -6.752  -1.900   1.584
  294    HD1  PHE  38           1HD      PHE  38  -4.982  -2.419  -1.650
  295    HD2  PHE  38           2HD      PHE  38  -8.706  -2.070   0.378
  296    HE1  PHE  38           1HE      PHE  38  -6.159  -2.484  -3.810
  297    HE2  PHE  38           2HE      PHE  38  -9.891  -2.135  -1.779
  298    HZ   PHE  38           HZ       PHE  38  -8.617  -2.343  -3.876
  299    H    GLY  39           H        GLY  39  -4.760  -1.311   3.386
  300   1HA   GLY  39          2HA       GLY  39  -6.229   0.999   4.014
  301   2HA   GLY  39          1HA       GLY  39  -5.131   0.166   5.102
  302    H    THR  40           H        THR  40  -2.722   0.593   4.536
  303    HA   THR  40           HA       THR  40  -2.120   3.222   5.067
  304    HB   THR  40           HB       THR  40  -0.320   1.348   3.531
  305    HG1  THR  40           1HG      THR  40  -0.326   1.521   6.329
  306   1HG2  THR  40          1HG2      THR  40   1.354   2.498   5.169
  307   2HG2  THR  40          2HG2      THR  40   0.148   3.784   5.170
  308   3HG2  THR  40          3HG2      THR  40   0.896   3.278   3.656
  309    H    LEU  41           H        LEU  41  -1.804   1.647   1.876
  310    HA   LEU  41           HA       LEU  41  -1.053   3.897   0.441
  311   1HB   LEU  41          2HB       LEU  41  -1.421   1.306  -0.178
  312   2HB   LEU  41          1HB       LEU  41  -2.840   1.993  -0.945
  313    HG   LEU  41           HG       LEU  41  -1.368   3.526  -2.220
  314   1HD1  LEU  41          1HD1      LEU  41   1.117   2.474  -2.165
  315   2HD1  LEU  41          2HD1      LEU  41   0.653   2.295  -0.472
  316   3HD1  LEU  41          3HD1      LEU  41   0.620   3.887  -1.232
  317   1HD2  LEU  41          1HD2      LEU  41  -0.086   1.127  -3.073
  318   2HD2  LEU  41          2HD2      LEU  41  -1.450   1.974  -3.803
  319   3HD2  LEU  41          3HD2      LEU  41  -1.734   0.744  -2.573
  320    H    LEU  42           H        LEU  42  -4.315   2.775   1.265
  321    HA   LEU  42           HA       LEU  42  -5.689   4.652  -0.346
  322   1HB   LEU  42          2HB       LEU  42  -6.419   2.551   1.312
  323   2HB   LEU  42          1HB       LEU  42  -7.098   3.954   2.102
  324    HG   LEU  42           HG       LEU  42  -8.714   2.906   0.606
  325   1HD1  LEU  42          1HD1      LEU  42  -7.786   5.555  -0.487
  326   2HD1  LEU  42          2HD1      LEU  42  -8.748   5.351   0.976
  327   3HD1  LEU  42          3HD1      LEU  42  -9.409   4.874  -0.588
  328   1HD2  LEU  42          1HD2      LEU  42  -6.773   2.183  -0.988
  329   2HD2  LEU  42          2HD2      LEU  42  -7.109   3.728  -1.769
  330   3HD2  LEU  42          3HD2      LEU  42  -8.381   2.513  -1.634
  331    H    LEU  43           H        LEU  43  -4.599   4.723   3.017
  332    HA   LEU  43           HA       LEU  43  -5.800   7.191   3.679
  333   1HB   LEU  43          2HB       LEU  43  -3.824   5.373   4.877
  334   2HB   LEU  43          1HB       LEU  43  -3.638   7.056   5.337
  335    HG   LEU  43           HG       LEU  43  -6.294   6.764   5.727
  336   1HD1  LEU  43          1HD1      LEU  43  -6.197   4.378   5.102
  337   2HD1  LEU  43          2HD1      LEU  43  -6.751   4.635   6.757
  338   3HD1  LEU  43          3HD1      LEU  43  -5.100   4.095   6.453
  339   1HD2  LEU  43          1HD2      LEU  43  -5.567   6.178   8.153
  340   2HD2  LEU  43          2HD2      LEU  43  -5.068   7.712   7.440
  341   3HD2  LEU  43          3HD2      LEU  43  -3.933   6.364   7.516
  342    H    ILE  44           H        ILE  44  -2.435   6.411   2.755
  343    HA   ILE  44           HA       ILE  44  -1.553   9.084   2.777
  344    HB   ILE  44           HB       ILE  44   0.260   8.222   1.188
  345   1HG1  ILE  44          2HG1      ILE  44  -0.081   5.465   1.879
  346   2HG1  ILE  44          1HG1      ILE  44  -1.535   6.020   1.059
  347   1HG2  ILE  44          1HG2      ILE  44   0.649   6.453   3.386
  348   2HG2  ILE  44          2HG2      ILE  44  -0.158   7.910   3.966
  349   3HG2  ILE  44          3HG2      ILE  44   1.370   8.036   3.095
  350   1HD1  ILE  44          1HD1      ILE  44  -0.470   5.673  -0.849
  351   2HD1  ILE  44          2HD1      ILE  44   1.062   5.413  -0.014
  352   3HD1  ILE  44          3HD1      ILE  44   0.560   7.048  -0.447
  353    H    GLY  45           H        GLY  45  -2.810   7.040   0.157
  354   1HA   GLY  45          2HA       GLY  45  -2.475   8.912  -1.921
  355   2HA   GLY  45          1HA       GLY  45  -3.613   7.574  -1.924
  356    H    PHE  46           H        PHE  46  -5.210   8.311   0.259
  357    HA   PHE  46           HA       PHE  46  -7.007  10.104  -0.965
  358   1HB   PHE  46          2HB       PHE  46  -7.079   8.352   1.205
  359   2HB   PHE  46          1HB       PHE  46  -7.355   9.933   1.919
  360    HD1  PHE  46           1HD      PHE  46  -8.434   8.190  -1.205
  361    HD2  PHE  46           2HD      PHE  46  -9.561  10.390   2.259
  362    HE1  PHE  46           1HE      PHE  46 -10.789   8.085  -1.909
  363    HE2  PHE  46           2HE      PHE  46 -11.917  10.288   1.562
  364    HZ   PHE  46           HZ       PHE  46 -12.534   9.134  -0.524
  365    H    PHE  47           H        PHE  47  -4.826  10.504   1.809
  366    HA   PHE  47           HA       PHE  47  -5.454  13.230   2.235
  367   1HB   PHE  47          2HB       PHE  47  -3.247  11.413   3.139
  368   2HB   PHE  47          1HB       PHE  47  -3.143  13.144   3.452
  369    HD1  PHE  47           1HD      PHE  47  -5.637  10.383   3.765
  370    HD2  PHE  47           2HD      PHE  47  -3.931  13.889   5.468
  371    HE1  PHE  47           1HE      PHE  47  -7.067  10.108   5.746
  372    HE2  PHE  47           2HE      PHE  47  -5.358  13.621   7.454
  373    HZ   PHE  47           HZ       PHE  47  -6.929  11.729   7.596
  374    H    ARG  48           H        ARG  48  -3.211  11.580   0.137
  375    HA   ARG  48           HA       ARG  48  -1.552  13.795  -0.453
  376   1HB   ARG  48          2HB       ARG  48  -1.712  11.075  -1.251
  377   2HB   ARG  48          1HB       ARG  48  -1.735  12.044  -2.714
  378   1HG   ARG  48          2HG       ARG  48   0.488  11.983  -2.539
  379   2HG   ARG  48          1HG       ARG  48   0.265  13.240  -1.321
  380   1HD   ARG  48          2HD       ARG  48   0.967  11.899   0.317
  381   2HD   ARG  48          1HD       ARG  48  -0.077  10.585  -0.213
  382    HE   ARG  48           HE       ARG  48   1.676   9.954  -1.783
  383   1HH1  ARG  48          1HH1      ARG  48   2.605  12.102   0.822
  384   2HH1  ARG  48          2HH1      ARG  48   4.273  11.653   0.751
  385   1HH2  ARG  48          1HH2      ARG  48   3.866   9.378  -1.867
  386   2HH2  ARG  48          2HH2      ARG  48   4.991  10.110  -0.773
  387    H    VAL  49           H        VAL  49  -4.350  12.393  -2.158
  388    HA   VAL  49           HA       VAL  49  -4.379  14.419  -4.163
  389    HB   VAL  49           HB       VAL  49  -5.327  12.211  -4.599
  390   1HG1  VAL  49          1HG1      VAL  49  -7.653  12.905  -2.835
  391   2HG1  VAL  49          2HG1      VAL  49  -6.268  11.992  -2.238
  392   3HG1  VAL  49          3HG1      VAL  49  -7.241  11.352  -3.561
  393   1HG2  VAL  49          1HG2      VAL  49  -6.150  14.356  -5.723
  394   2HG2  VAL  49          2HG2      VAL  49  -7.595  14.170  -4.728
  395   3HG2  VAL  49          3HG2      VAL  49  -7.152  12.913  -5.882
  396    H    VAL  50           H        VAL  50  -6.453  13.814  -1.314
  397    HA   VAL  50           HA       VAL  50  -8.022  16.147  -1.668
  398    HB   VAL  50           HB       VAL  50  -7.530  14.649   0.910
  399   1HG1  VAL  50          1HG1      VAL  50  -9.972  16.222   0.143
  400   2HG1  VAL  50          2HG1      VAL  50  -8.601  16.961   0.971
  401   3HG1  VAL  50          3HG1      VAL  50  -9.491  15.646   1.739
  402   1HG2  VAL  50          1HG2      VAL  50  -9.451  13.309   0.387
  403   2HG2  VAL  50          2HG2      VAL  50  -8.314  13.198  -0.956
  404   3HG2  VAL  50          3HG2      VAL  50  -9.742  14.223  -1.093
  405    H    GLY  51           H        GLY  51  -5.223  15.415   0.386
  406   1HA   GLY  51          2HA       GLY  51  -5.083  17.902   1.688
  407   2HA   GLY  51          1HA       GLY  51  -3.745  16.781   1.487
  408    H    ARG  52           H        ARG  52  -3.922  16.860  -1.449
  409    HA   ARG  52           HA       ARG  52  -2.291  19.211  -1.836
  410   1HB   ARG  52          2HB       ARG  52  -2.852  16.741  -3.319
  411   2HB   ARG  52          1HB       ARG  52  -2.649  18.151  -4.343
  412   1HG   ARG  52          2HG       ARG  52  -0.452  18.423  -3.780
  413   2HG   ARG  52          1HG       ARG  52  -0.642  17.644  -2.209
  414   1HD   ARG  52          2HD       ARG  52   0.484  15.997  -3.317
  415   2HD   ARG  52          1HD       ARG  52  -1.170  15.539  -3.714
  416    HE   ARG  52           HE       ARG  52  -0.136  17.316  -5.661
  417   1HH1  ARG  52          1HH1      ARG  52   0.079  14.004  -4.582
  418   2HH1  ARG  52          2HH1      ARG  52   0.521  13.394  -6.141
  419   1HH2  ARG  52          1HH2      ARG  52   0.445  16.513  -7.713
  420   2HH2  ARG  52          2HH2      ARG  52   0.730  14.817  -7.917
  421    H    MET  53           H        MET  53  -5.554  18.231  -2.475
  422    HA   MET  53           HA       MET  53  -6.100  20.266  -4.416
  423   1HB   MET  53          2HB       MET  53  -7.349  18.123  -4.304
  424   2HB   MET  53          1HB       MET  53  -8.039  18.634  -2.769
  425   1HG   MET  53          2HG       MET  53  -9.694  19.576  -3.883
  426   2HG   MET  53          1HG       MET  53  -8.539  20.727  -4.552
  427   1HE   MET  53          1HE       MET  53  -7.296  20.005  -7.338
  428   2HE   MET  53          2HE       MET  53  -8.346  21.217  -6.603
  429   3HE   MET  53          3HE       MET  53  -8.870  20.359  -8.053
  430    H    LEU  54           H        LEU  54  -6.211  20.026  -0.948
  431    HA   LEU  54           HA       LEU  54  -7.994  21.925  -0.162
  432   1HB   LEU  54          2HB       LEU  54  -5.350  21.056   0.877
  433   2HB   LEU  54          1HB       LEU  54  -6.040  22.515   1.561
  434    HG   LEU  54           HG       LEU  54  -7.416  19.828   1.509
  435   1HD1  LEU  54          1HD1      LEU  54  -5.355  20.826   3.216
  436   2HD1  LEU  54          2HD1      LEU  54  -6.200  19.280   3.279
  437   3HD1  LEU  54          3HD1      LEU  54  -6.852  20.675   4.137
  438   1HD2  LEU  54          1HD2      LEU  54  -8.173  22.162   3.221
  439   2HD2  LEU  54          2HD2      LEU  54  -9.145  20.778   2.722
  440   3HD2  LEU  54          3HD2      LEU  54  -8.758  22.047   1.562
  441    HA   PRO  55           HA       PRO  55  -4.868  25.545  -0.823
  442   1HB   PRO  55          2HB       PRO  55  -2.600  25.028  -2.228
  443   2HB   PRO  55          1HB       PRO  55  -2.699  24.875  -0.470
  444   1HG   PRO  55          2HG       PRO  55  -2.871  22.749  -2.570
  445   2HG   PRO  55          1HG       PRO  55  -2.005  22.727  -1.023
  446   1HD   PRO  55          2HD       PRO  55  -4.396  21.509  -1.368
  447   2HD   PRO  55          1HD       PRO  55  -3.907  22.227   0.180
  448    H    ILE  56           H        ILE  56  -6.761  25.760  -2.239
  449    HA   ILE  56           HA       ILE  56  -5.952  26.403  -4.924
  450    HB   ILE  56           HB       ILE  56  -6.492  24.007  -5.147
  451   1HG1  ILE  56          2HG1      ILE  56  -8.153  24.280  -7.017
  452   2HG1  ILE  56          1HG1      ILE  56  -8.357  25.955  -6.517
  453   1HG2  ILE  56          1HG2      ILE  56  -8.639  23.124  -4.762
  454   2HG2  ILE  56          2HG2      ILE  56  -9.350  24.725  -4.556
  455   3HG2  ILE  56          3HG2      ILE  56  -8.260  24.078  -3.328
  456   1HD1  ILE  56          1HD1      ILE  56  -5.897  26.258  -6.886
  457   2HD1  ILE  56          2HD1      ILE  56  -6.848  25.938  -8.336
  458   3HD1  ILE  56          3HD1      ILE  56  -5.884  24.651  -7.613
  459    H    GLN  57           H        GLN  57  -8.349  26.439  -2.399
  460    HA   GLN  57           HA       GLN  57  -9.361  28.953  -3.319
  461   1HB   GLN  57          2HB       GLN  57 -10.631  27.255  -4.679
  462   2HB   GLN  57          1HB       GLN  57 -11.319  26.660  -3.175
  463   1HG   GLN  57          2HG       GLN  57 -12.149  29.018  -2.783
  464   2HG   GLN  57          1HG       GLN  57 -11.703  29.345  -4.456
  465   1HE2  GLN  57          1HE2      GLN  57 -14.018  28.003  -2.356
  466   2HE2  GLN  57          2HE2      GLN  57 -15.114  27.419  -3.556
  467    H    GLU  58           H        GLU  58  -9.453  26.292  -1.031
  468    HA   GLU  58           HA       GLU  58 -11.086  27.490   0.919
  469   1HB   GLU  58          2HB       GLU  58  -9.645  25.084   0.630
  470   2HB   GLU  58          1HB       GLU  58  -9.055  25.828   2.111
  471   1HG   GLU  58          2HG       GLU  58 -11.989  25.609   1.612
  472   2HG   GLU  58          1HG       GLU  58 -11.077  24.215   2.191
  473    H    ASN  59           H        ASN  59  -7.899  28.192  -0.085
  474    HA   ASN  59           HA       ASN  59  -7.609  30.064   2.153
  475   1HB   ASN  59          2HB       ASN  59  -6.222  27.819   2.296
  476   2HB   ASN  59          1HB       ASN  59  -5.162  28.659   1.168
  477   1HD2  ASN  59          1HD2      ASN  59  -6.029  28.232   4.394
  478   2HD2  ASN  59          2HD2      ASN  59  -5.078  29.502   5.078
  479    H    GLN  60           H        GLN  60  -7.614  29.576  -1.155
  480    HA   GLN  60           HA       GLN  60  -5.778  31.777  -1.724
  481   1HB   GLN  60          2HB       GLN  60  -6.931  29.527  -3.283
  482   2HB   GLN  60          1HB       GLN  60  -6.621  31.012  -4.164
  483   1HG   GLN  60          2HG       GLN  60  -4.628  29.373  -2.623
  484   2HG   GLN  60          1HG       GLN  60  -4.730  29.561  -4.373
  485   1HE2  GLN  60          1HE2      GLN  60  -4.014  31.457  -5.324
  486   2HE2  GLN  60          2HE2      GLN  60  -3.039  32.606  -4.480
  487    H    ALA  61           H        ALA  61  -6.998  32.711  -4.090
  488    HA   ALA  61           HA       ALA  61  -8.722  33.957  -4.940
  489   1HB   ALA  61          1HB       ALA  61 -10.142  32.356  -3.346
  490   2HB   ALA  61          2HB       ALA  61 -10.848  33.726  -4.201
  491   3HB   ALA  61          3HB       ALA  61 -10.396  33.882  -2.506
  492    HA   PRO  62           HA       PRO  62  -7.129  37.754  -3.273
  493   1HB   PRO  62          2HB       PRO  62  -8.552  39.456  -4.871
  494   2HB   PRO  62          1HB       PRO  62  -7.102  38.591  -5.390
  495   1HG   PRO  62          2HG       PRO  62  -9.980  37.919  -5.858
  496   2HG   PRO  62          1HG       PRO  62  -8.611  37.833  -6.983
  497   1HD   PRO  62          2HD       PRO  62  -9.588  35.644  -5.763
  498   2HD   PRO  62          1HD       PRO  62  -7.857  35.829  -6.111
  499    H    ALA  63           H        ALA  63 -10.485  36.891  -3.169
  500    HA   ALA  63           HA       ALA  63 -11.373  39.278  -1.860
  501   1HB   ALA  63          1HB       ALA  63 -13.206  37.338  -1.181
  502   2HB   ALA  63          2HB       ALA  63 -12.563  36.771  -2.723
  503   3HB   ALA  63          3HB       ALA  63 -13.271  38.381  -2.602
  504    HA   PRO  64           HA       PRO  64 -11.202  36.714   2.198
  505   1HB   PRO  64          2HB       PRO  64 -10.363  34.164   2.147
  506   2HB   PRO  64          1HB       PRO  64 -12.028  34.605   1.746
  507   1HG   PRO  64          2HG       PRO  64  -9.730  34.028  -0.093
  508   2HG   PRO  64          1HG       PRO  64 -11.402  33.442  -0.183
  509   1HD   PRO  64          2HD       PRO  64 -10.499  35.531  -1.663
  510   2HD   PRO  64          1HD       PRO  64 -12.176  35.412  -1.092
  511    H    ASN  65           H        ASN  65  -9.603  37.228   3.552
  512    HA   ASN  65           HA       ASN  65  -7.554  37.461   4.500
  513   1HB   ASN  65          2HB       ASN  65  -7.293  35.055   2.895
  514   2HB   ASN  65          1HB       ASN  65  -5.762  35.912   3.037
  515   1HD2  ASN  65          1HD2      ASN  65  -4.588  35.463   4.745
  516   2HD2  ASN  65          2HD2      ASN  65  -5.162  34.791   6.229
  517    H    ILE  66           H        ILE  66  -7.381  37.404   0.940
  518    HA   ILE  66           HA       ILE  66  -5.061  39.022   0.804
  519    HB   ILE  66           HB       ILE  66  -7.136  38.692  -1.348
  520   1HG1  ILE  66          2HG1      ILE  66  -6.438  36.493  -0.497
  521   2HG1  ILE  66          1HG1      ILE  66  -5.841  36.770  -2.129
  522   1HG2  ILE  66          1HG2      ILE  66  -4.232  38.951  -1.883
  523   2HG2  ILE  66          2HG2      ILE  66  -5.118  40.395  -1.393
  524   3HG2  ILE  66          3HG2      ILE  66  -5.614  39.503  -2.832
  525   1HD1  ILE  66          1HD1      ILE  66  -3.891  36.072  -1.315
  526   2HD1  ILE  66          2HD1      ILE  66  -4.386  36.336   0.357
  527   3HD1  ILE  66          3HD1      ILE  66  -3.773  37.682  -0.604
  528    H    THR  67           H        THR  67  -8.488  39.756   1.009
  529    HA   THR  67           HA       THR  67  -8.011  42.413   1.772
  530    HB   THR  67           HB       THR  67  -9.377  43.181  -0.482
  531    HG1  THR  67           1HG      THR  67  -8.152  42.282  -2.205
  532   1HG2  THR  67          1HG2      THR  67  -6.570  43.381  -1.004
  533   2HG2  THR  67          2HG2      THR  67  -6.907  43.741   0.689
  534   3HG2  THR  67          3HG2      THR  67  -7.729  44.642  -0.584
  535    H    GLY  68           H        GLY  68 -10.683  41.827  -0.434
  536   1HA   GLY  68          2HA       GLY  68 -12.861  41.061   0.125
  537   2HA   GLY  68          1HA       GLY  68 -12.455  41.235   1.827
  538    H    ALA  69           H        ALA  69 -13.392  42.864   2.827
  539    HA   ALA  69           HA       ALA  69 -14.091  44.993   3.293
  540   1HB   ALA  69          1HB       ALA  69 -14.107  46.729   1.430
  541   2HB   ALA  69          2HB       ALA  69 -13.269  45.529   0.454
  542   3HB   ALA  69          3HB       ALA  69 -12.538  46.113   1.946
  543    H    LEU  70           H        LEU  70 -16.161  45.090   3.761
  544    HA   LEU  70           HA       LEU  70 -18.180  43.919   2.160
  545   1HB   LEU  70          2HB       LEU  70 -17.972  45.165   4.755
  546   2HB   LEU  70          1HB       LEU  70 -19.418  45.714   3.930
  547    HG   LEU  70           HG       LEU  70 -18.868  42.787   3.988
  548   1HD1  LEU  70          1HD1      LEU  70 -18.459  43.307   6.272
  549   2HD1  LEU  70          2HD1      LEU  70 -20.101  42.673   6.165
  550   3HD1  LEU  70          3HD1      LEU  70 -19.836  44.409   6.331
  551   1HD2  LEU  70          1HD2      LEU  70 -21.366  44.467   4.156
  552   2HD2  LEU  70          2HD2      LEU  70 -21.317  42.705   4.111
  553   3HD2  LEU  70          3HD2      LEU  70 -20.757  43.640   2.723
  554    H    GLU  71           H        GLU  71 -17.193  47.272   2.712
  555    HA   GLU  71           HA       GLU  71 -18.017  48.121   0.153
  556   1HB   GLU  71          2HB       GLU  71 -19.836  49.702   0.956
  557   2HB   GLU  71          1HB       GLU  71 -20.267  48.000   0.864
  558   1HG   GLU  71          2HG       GLU  71 -21.049  48.259   2.927
  559   2HG   GLU  71          1HG       GLU  71 -19.360  48.239   3.435
  560    H    HIS  72           H        HIS  72 -17.306  49.014   3.490
  561    HA   HIS  72           HA       HIS  72 -16.667  51.699   3.115
  562   1HB   HIS  72          2HB       HIS  72 -16.067  49.637   5.133
  563   2HB   HIS  72          1HB       HIS  72 -14.905  50.957   5.060
  564    HD1  HIS  72           1HD      HIS  72 -17.373  53.004   4.255
  565    HD2  HIS  72           2HD      HIS  72 -16.944  50.625   7.635
  566    HE1  HIS  72           1HE      HIS  72 -18.811  54.073   6.018
  567    HE2  HIS  72           2HE      HIS  72 -18.476  52.661   8.076
  568    H    HIS  73           H        HIS  73 -15.570  51.934   1.142
  569    HA   HIS  73           HA       HIS  73 -12.946  50.701   0.863
  570   1HB   HIS  73          2HB       HIS  73 -14.594  52.444  -0.972
  571   2HB   HIS  73          1HB       HIS  73 -12.965  51.905  -1.361
  572    HD1  HIS  73           1HD      HIS  73 -15.419  51.118  -3.083
  573    HD2  HIS  73           2HD      HIS  73 -13.814  48.773  -0.050
  574    HE1  HIS  73           1HE      HIS  73 -16.128  48.764  -3.607
  575    HE2  HIS  73           2HE      HIS  73 -15.165  47.363  -1.747
  576    H    HIS  74           H        HIS  74 -11.215  52.257  -0.095
  577    HA   HIS  74           HA       HIS  74 -11.163  54.686   1.574
  578   1HB   HIS  74          2HB       HIS  74  -9.534  52.642   2.006
  579   2HB   HIS  74          1HB       HIS  74  -8.625  53.384   0.693
  580    HD1  HIS  74           1HD      HIS  74  -6.690  54.320   1.999
  581    HD2  HIS  74           2HD      HIS  74 -10.374  55.427   3.572
  582    HE1  HIS  74           1HE      HIS  74  -6.177  56.021   3.779
  583    HE2  HIS  74           2HE      HIS  74  -8.415  56.614   4.773
  584    H    HIS  75           H        HIS  75 -12.220  54.616  -1.052
  585    HA   HIS  75           HA       HIS  75 -10.280  55.506  -2.945
  586   1HB   HIS  75          2HB       HIS  75 -12.573  54.463  -3.425
  587   2HB   HIS  75          1HB       HIS  75 -13.238  56.059  -3.095
  588    HD1  HIS  75           1HD      HIS  75 -12.736  54.216  -5.886
  589    HD2  HIS  75           2HD      HIS  75 -11.244  57.934  -4.785
  590    HE1  HIS  75           1HE      HIS  75 -12.087  55.344  -8.038
  591    HE2  HIS  75           2HE      HIS  75 -11.255  57.620  -7.352
  592    H    HIS  76           H        HIS  76 -12.875  57.213  -1.186
  593    HA   HIS  76           HA       HIS  76 -13.096  59.381  -0.536
  594   1HB   HIS  76          2HB       HIS  76 -10.213  58.849  -0.408
  595   2HB   HIS  76          1HB       HIS  76 -10.611  60.550  -0.588
  596    HD1  HIS  76           1HD      HIS  76 -12.221  61.560   1.302
  597    HD2  HIS  76           2HD      HIS  76 -10.526  57.855   2.117
  598    HE1  HIS  76           1HE      HIS  76 -12.478  61.234   3.782
  599    HE2  HIS  76           2HE      HIS  76 -11.346  59.037   4.267
  600    H    HIS  77           H        HIS  77 -13.221  61.528  -1.366
  601    HA   HIS  77           HA       HIS  77 -13.443  63.106  -2.990
  602   1HB   HIS  77          2HB       HIS  77 -11.168  61.614  -4.317
  603   2HB   HIS  77          1HB       HIS  77 -11.773  63.189  -4.816
  604    HD1  HIS  77           1HD      HIS  77 -10.546  65.115  -3.867
  605    HD2  HIS  77           2HD      HIS  77 -10.155  61.722  -1.513
  606    HE1  HIS  77           1HE      HIS  77  -8.961  65.755  -2.021
  607    HE2  HIS  77           2HE      HIS  77  -8.841  63.720  -0.541
  Start of MODEL    5
    1   1H    ALA   1          1HT       ALA   1 -21.691 -57.701  -1.671
    2   2H    ALA   1          2HT       ALA   1 -21.016 -56.124  -1.590
    3   3H    ALA   1          3HT       ALA   1 -20.677 -57.271  -0.359
    4    HA   ALA   1           HA       ALA   1 -19.393 -58.562  -1.742
    5   1HB   ALA   1          1HB       ALA   1 -19.240 -57.412  -4.220
    6   2HB   ALA   1          2HB       ALA   1 -20.947 -57.223  -3.824
    7   3HB   ALA   1          3HB       ALA   1 -20.211 -58.826  -3.809
    8    H    ASP   2           H        ASP   2 -18.488 -56.918  -0.001
    9    HA   ASP   2           HA       ASP   2 -17.002 -54.723  -1.174
   10   1HB   ASP   2          2HB       ASP   2 -17.805 -55.533   1.501
   11   2HB   ASP   2          1HB       ASP   2 -16.115 -55.041   1.448
   12    H    LYS   3           H        LYS   3 -16.449 -57.992  -0.121
   13    HA   LYS   3           HA       LYS   3 -13.695 -58.001   0.227
   14   1HB   LYS   3          2HB       LYS   3 -15.351 -60.209  -1.005
   15   2HB   LYS   3          1HB       LYS   3 -13.779 -60.386  -0.237
   16   1HG   LYS   3          2HG       LYS   3 -15.437 -59.126   1.648
   17   2HG   LYS   3          1HG       LYS   3 -16.386 -60.434   0.938
   18   1HD   LYS   3          2HD       LYS   3 -13.568 -60.931   1.809
   19   2HD   LYS   3          1HD       LYS   3 -14.870 -60.909   3.000
   20   1HE   LYS   3          2HE       LYS   3 -15.103 -63.079   2.490
   21   2HE   LYS   3          1HE       LYS   3 -15.933 -62.488   1.052
   22   1HZ   LYS   3          1HZ       LYS   3 -13.313 -62.411   0.345
   23   2HZ   LYS   3          2HZ       LYS   3 -14.407 -63.633  -0.068
   24   3HZ   LYS   3          3HZ       LYS   3 -13.402 -63.818   1.280
   25    H    THR   4           H        THR   4 -15.561 -57.773  -2.682
   26    HA   THR   4           HA       THR   4 -13.508 -58.577  -4.485
   27    HB   THR   4           HB       THR   4 -15.121 -57.027  -6.016
   28    HG1  THR   4           1HG      THR   4 -16.913 -56.580  -5.048
   29   1HG2  THR   4          1HG2      THR   4 -14.733 -59.432  -6.340
   30   2HG2  THR   4          2HG2      THR   4 -16.423 -58.976  -6.548
   31   3HG2  THR   4          3HG2      THR   4 -15.901 -59.770  -5.062
   32    H    ILE   5           H        ILE   5 -14.720 -55.419  -3.392
   33    HA   ILE   5           HA       ILE   5 -12.837 -53.932  -4.945
   34    HB   ILE   5           HB       ILE   5 -14.203 -52.846  -2.502
   35   1HG1  ILE   5          2HG1      ILE   5 -15.783 -52.304  -4.801
   36   2HG1  ILE   5          1HG1      ILE   5 -15.513 -54.044  -4.750
   37   1HG2  ILE   5          1HG2      ILE   5 -12.907 -51.772  -4.922
   38   2HG2  ILE   5          2HG2      ILE   5 -12.985 -51.117  -3.286
   39   3HG2  ILE   5          3HG2      ILE   5 -14.359 -50.933  -4.375
   40   1HD1  ILE   5          1HD1      ILE   5 -16.193 -53.015  -2.145
   41   2HD1  ILE   5          2HD1      ILE   5 -16.955 -54.287  -3.094
   42   3HD1  ILE   5          3HD1      ILE   5 -17.417 -52.607  -3.347
   43    H    PHE   6           H        PHE   6 -13.160 -54.267  -1.402
   44    HA   PHE   6           HA       PHE   6 -11.638 -54.196   0.282
   45   1HB   PHE   6          2HB       PHE   6 -10.463 -55.801  -1.796
   46   2HB   PHE   6          1HB       PHE   6  -9.198 -54.898  -0.968
   47    HD1  PHE   6           1HD      PHE   6 -10.074 -54.802   1.774
   48    HD2  PHE   6           2HD      PHE   6 -10.394 -57.973  -1.048
   49    HE1  PHE   6           1HE      PHE   6 -10.109 -56.433   3.615
   50    HE2  PHE   6           2HE      PHE   6 -10.432 -59.609   0.790
   51    HZ   PHE   6           HZ       PHE   6 -10.289 -58.840   3.125
   52    H    ASN   7           H        ASN   7  -9.173 -53.399   0.685
   53    HA   ASN   7           HA       ASN   7  -7.676 -51.684   0.706
   54   1HB   ASN   7          2HB       ASN   7  -8.914 -51.256  -1.969
   55   2HB   ASN   7          1HB       ASN   7  -8.025 -49.914  -1.259
   56   1HD2  ASN   7          1HD2      ASN   7  -7.794 -52.620  -3.139
   57   2HD2  ASN   7          2HD2      ASN   7  -6.088 -52.877  -3.049
   58    H    ASP   8           H        ASP   8 -10.598 -50.158  -0.648
   59    HA   ASP   8           HA       ASP   8 -11.838 -48.378   0.049
   60   1HB   ASP   8          2HB       ASP   8 -12.319 -50.113   1.852
   61   2HB   ASP   8          1HB       ASP   8 -11.161 -49.247   2.856
   62    H    HIS   9           H        HIS   9  -9.053 -47.905  -0.438
   63    HA   HIS   9           HA       HIS   9  -7.942 -46.238   1.576
   64   1HB   HIS   9          2HB       HIS   9  -7.272 -47.013  -1.186
   65   2HB   HIS   9          1HB       HIS   9  -6.721 -45.406  -0.726
   66    HD1  HIS   9           1HD      HIS   9  -6.790 -48.462   1.510
   67    HD2  HIS   9           2HD      HIS   9  -4.065 -45.923  -0.333
   68    HE1  HIS   9           1HE      HIS   9  -4.537 -49.125   2.410
   69    HE2  HIS   9           2HE      HIS   9  -2.897 -47.638   1.210
   70    H    LEU  10           H        LEU  10  -9.594 -45.529  -1.494
   71    HA   LEU  10           HA       LEU  10 -10.896 -43.763  -2.115
   72   1HB   LEU  10          2HB       LEU  10 -11.565 -43.783   0.364
   73   2HB   LEU  10          1HB       LEU  10 -10.423 -42.465   0.556
   74    HG   LEU  10           HG       LEU  10 -12.116 -41.830  -1.644
   75   1HD1  LEU  10          1HD1      LEU  10 -13.790 -42.208   0.796
   76   2HD1  LEU  10          2HD1      LEU  10 -13.575 -43.546  -0.334
   77   3HD1  LEU  10          3HD1      LEU  10 -14.278 -42.027  -0.889
   78   1HD2  LEU  10          1HD2      LEU  10 -10.923 -40.261  -0.162
   79   2HD2  LEU  10          2HD2      LEU  10 -12.033 -40.681   1.143
   80   3HD2  LEU  10          3HD2      LEU  10 -12.641 -39.888  -0.310
   81    H    ASN  11           H        ASN  11  -7.866 -43.121  -0.444
   82    HA   ASN  11           HA       ASN  11  -6.147 -41.708  -0.865
   83   1HB   ASN  11          2HB       ASN  11  -6.634 -42.848  -3.179
   84   2HB   ASN  11          1HB       ASN  11  -7.195 -41.243  -3.637
   85   1HD2  ASN  11          1HD2      ASN  11  -5.525 -41.086  -5.150
   86   2HD2  ASN  11          2HD2      ASN  11  -3.896 -40.761  -4.673
   87    H    THR  12           H        THR  12  -6.225 -39.438  -2.777
   88    HA   THR  12           HA       THR  12  -6.722 -37.233  -2.802
   89    HB   THR  12           HB       THR  12  -9.329 -37.704  -1.412
   90    HG1  THR  12           1HG      THR  12  -9.079 -39.456  -2.893
   91   1HG2  THR  12          1HG2      THR  12  -9.435 -35.579  -2.143
   92   2HG2  THR  12          2HG2      THR  12  -9.921 -36.367  -3.644
   93   3HG2  THR  12          3HG2      THR  12  -8.253 -35.849  -3.423
   94    H    ASN  13           H        ASN  13  -5.441 -38.496  -0.466
   95    HA   ASN  13           HA       ASN  13  -6.339 -37.154   1.885
   96   1HB   ASN  13          2HB       ASN  13  -3.601 -38.338   1.399
   97   2HB   ASN  13          1HB       ASN  13  -4.381 -38.046   2.951
   98   1HD2  ASN  13          1HD2      ASN  13  -4.732 -39.959   3.818
   99   2HD2  ASN  13          2HD2      ASN  13  -5.490 -41.300   3.036
  100    HA   PRO  14           HA       PRO  14  -2.316 -34.399   0.951
  101   1HB   PRO  14          2HB       PRO  14  -2.187 -33.998  -1.821
  102   2HB   PRO  14          1HB       PRO  14  -1.076 -34.973  -0.855
  103   1HG   PRO  14          2HG       PRO  14  -3.425 -35.824  -2.481
  104   2HG   PRO  14          1HG       PRO  14  -1.870 -36.642  -2.233
  105   1HD   PRO  14          2HD       PRO  14  -4.069 -37.475  -0.993
  106   2HD   PRO  14          1HD       PRO  14  -2.505 -37.481  -0.158
  107    H    LYS  15           H        LYS  15  -5.332 -34.509  -0.798
  108    HA   LYS  15           HA       LYS  15  -5.570 -31.860  -1.598
  109   1HB   LYS  15          2HB       LYS  15  -7.353 -34.127  -1.206
  110   2HB   LYS  15          1HB       LYS  15  -8.145 -32.593  -0.869
  111   1HG   LYS  15          2HG       LYS  15  -8.564 -32.868  -3.112
  112   2HG   LYS  15          1HG       LYS  15  -7.117 -31.858  -3.136
  113   1HD   LYS  15          2HD       LYS  15  -5.780 -33.552  -3.898
  114   2HD   LYS  15          1HD       LYS  15  -6.761 -34.810  -3.146
  115   1HE   LYS  15          2HE       LYS  15  -8.559 -34.092  -4.872
  116   2HE   LYS  15          1HE       LYS  15  -7.205 -33.350  -5.723
  117   1HZ   LYS  15          1HZ       LYS  15  -7.991 -35.913  -5.999
  118   2HZ   LYS  15          2HZ       LYS  15  -6.719 -36.067  -4.896
  119   3HZ   LYS  15          3HZ       LYS  15  -6.453 -35.327  -6.394
  120    H    THR  16           H        THR  16  -5.854 -33.254   1.579
  121    HA   THR  16           HA       THR  16  -7.260 -31.071   2.762
  122    HB   THR  16           HB       THR  16  -5.511 -33.127   4.120
  123    HG1  THR  16           1HG      THR  16  -7.627 -33.624   2.733
  124   1HG2  THR  16          1HG2      THR  16  -5.990 -31.916   5.927
  125   2HG2  THR  16          2HG2      THR  16  -7.589 -32.650   5.791
  126   3HG2  THR  16          3HG2      THR  16  -7.295 -31.043   5.123
  127    H    ASN  17           H        ASN  17  -3.836 -32.037   2.738
  128    HA   ASN  17           HA       ASN  17  -2.905 -29.877   4.289
  129   1HB   ASN  17          2HB       ASN  17  -1.555 -31.709   2.313
  130   2HB   ASN  17          1HB       ASN  17  -0.674 -30.448   3.170
  131   1HD2  ASN  17          1HD2      ASN  17  -1.132 -33.592   3.184
  132   2HD2  ASN  17          2HD2      ASN  17  -1.061 -33.943   4.874
  133    H    LEU  18           H        LEU  18  -3.012 -30.362   0.773
  134    HA   LEU  18           HA       LEU  18  -1.848 -27.931   0.034
  135   1HB   LEU  18          2HB       LEU  18  -2.852 -30.134  -1.283
  136   2HB   LEU  18          1HB       LEU  18  -3.949 -28.858  -1.776
  137    HG   LEU  18           HG       LEU  18  -2.220 -29.014  -3.414
  138   1HD1  LEU  18          1HD1      LEU  18  -2.256 -26.806  -3.581
  139   2HD1  LEU  18          2HD1      LEU  18  -0.962 -26.697  -2.387
  140   3HD1  LEU  18          3HD1      LEU  18  -2.646 -26.663  -1.869
  141   1HD2  LEU  18          1HD2      LEU  18  -0.021 -29.351  -3.017
  142   2HD2  LEU  18          2HD2      LEU  18  -0.628 -29.980  -1.486
  143   3HD2  LEU  18          3HD2      LEU  18  -0.010 -28.331  -1.580
  144    H    ARG  19           H        ARG  19  -5.245 -28.772   0.602
  145    HA   ARG  19           HA       ARG  19  -6.343 -26.306  -0.193
  146   1HB   ARG  19          2HB       ARG  19  -7.312 -28.746   0.800
  147   2HB   ARG  19          1HB       ARG  19  -7.881 -27.525   1.923
  148   1HG   ARG  19          2HG       ARG  19  -8.214 -26.821  -0.898
  149   2HG   ARG  19          1HG       ARG  19  -9.133 -28.235  -0.375
  150   1HD   ARG  19          2HD       ARG  19 -10.467 -27.028   1.000
  151   2HD   ARG  19          1HD       ARG  19  -9.184 -25.896   1.425
  152    HE   ARG  19           HE       ARG  19  -9.881 -24.529  -0.270
  153   1HH1  ARG  19          1HH1      ARG  19 -11.262 -27.700  -0.746
  154   2HH1  ARG  19          2HH1      ARG  19 -12.305 -27.186  -2.030
  155   1HH2  ARG  19          1HH2      ARG  19 -11.260 -23.857  -1.949
  156   2HH2  ARG  19          2HH2      ARG  19 -12.301 -25.010  -2.713
  157    H    LEU  20           H        LEU  20  -5.560 -27.507   3.075
  158    HA   LEU  20           HA       LEU  20  -6.302 -25.160   4.421
  159   1HB   LEU  20          2HB       LEU  20  -4.254 -27.241   5.187
  160   2HB   LEU  20          1HB       LEU  20  -4.877 -26.006   6.265
  161    HG   LEU  20           HG       LEU  20  -6.614 -28.093   4.951
  162   1HD1  LEU  20          1HD1      LEU  20  -4.701 -28.593   6.869
  163   2HD1  LEU  20          2HD1      LEU  20  -6.127 -29.577   6.540
  164   3HD1  LEU  20          3HD1      LEU  20  -6.174 -28.358   7.813
  165   1HD2  LEU  20          1HD2      LEU  20  -8.186 -26.643   5.627
  166   2HD2  LEU  20          2HD2      LEU  20  -7.078 -25.786   6.697
  167   3HD2  LEU  20          3HD2      LEU  20  -7.847 -27.277   7.239
  168    H    TRP  21           H        TRP  21  -3.205 -26.194   3.054
  169    HA   TRP  21           HA       TRP  21  -1.654 -24.055   4.015
  170   1HB   TRP  21          2HB       TRP  21  -0.957 -26.293   2.855
  171   2HB   TRP  21          1HB       TRP  21  -1.077 -25.349   1.375
  172    HD1  TRP  21           HD       TRP  21   0.537 -23.059   1.337
  173    HE1  TRP  21           1HE      TRP  21   2.921 -22.778   2.263
  174    HE3  TRP  21           3HE      TRP  21   0.627 -27.025   4.560
  175    HZ2  TRP  21           2HZ      TRP  21   4.618 -24.071   4.113
  176    HZ3  TRP  21           3HZ      TRP  21   2.669 -27.436   5.868
  177    HH2  TRP  21           HH       TRP  21   4.623 -25.989   5.647
  178    H    VAL  22           H        VAL  22  -3.227 -24.499   0.846
  179    HA   VAL  22           HA       VAL  22  -2.467 -22.036  -0.250
  180    HB   VAL  22           HB       VAL  22  -4.387 -22.326  -1.802
  181   1HG1  VAL  22          1HG1      VAL  22  -3.591 -24.828  -2.395
  182   2HG1  VAL  22          2HG1      VAL  22  -2.293 -24.340  -1.306
  183   3HG1  VAL  22          3HG1      VAL  22  -2.635 -23.389  -2.751
  184   1HG2  VAL  22          1HG2      VAL  22  -5.542 -24.618  -1.578
  185   2HG2  VAL  22          2HG2      VAL  22  -6.094 -23.293  -0.552
  186   3HG2  VAL  22          3HG2      VAL  22  -5.033 -24.534   0.105
  187    H    ALA  23           H        ALA  23  -5.466 -22.947   1.442
  188    HA   ALA  23           HA       ALA  23  -6.766 -20.482   1.239
  189   1HB   ALA  23          1HB       ALA  23  -7.138 -22.952   2.695
  190   2HB   ALA  23          2HB       ALA  23  -8.338 -21.810   2.090
  191   3HB   ALA  23          3HB       ALA  23  -7.595 -21.554   3.668
  192    H    PHE  24           H        PHE  24  -4.533 -21.705   3.701
  193    HA   PHE  24           HA       PHE  24  -4.756 -19.501   5.454
  194   1HB   PHE  24          2HB       PHE  24  -3.452 -21.932   5.516
  195   2HB   PHE  24          1HB       PHE  24  -2.122 -20.783   5.429
  196    HD1  PHE  24           1HD      PHE  24  -5.428 -20.530   7.119
  197    HD2  PHE  24           2HD      PHE  24  -1.197 -20.704   7.538
  198    HE1  PHE  24           1HE      PHE  24  -5.654 -20.095   9.530
  199    HE2  PHE  24           2HE      PHE  24  -1.414 -20.269   9.948
  200    HZ   PHE  24           HZ       PHE  24  -3.645 -19.964  10.948
  201    H    GLN  25           H        GLN  25  -2.550 -20.214   2.788
  202    HA   GLN  25           HA       GLN  25  -0.905 -17.944   3.096
  203   1HB   GLN  25          2HB       GLN  25  -0.484 -20.057   1.702
  204   2HB   GLN  25          1HB       GLN  25  -1.467 -19.290   0.462
  205   1HG   GLN  25          2HG       GLN  25   0.878 -18.923   0.028
  206   2HG   GLN  25          1HG       GLN  25   0.081 -17.397   0.409
  207   1HE2  GLN  25          1HE2      GLN  25   1.543 -20.045   2.272
  208   2HE2  GLN  25          2HE2      GLN  25   2.531 -19.029   3.261
  209    H    MET  26           H        MET  26  -3.851 -18.518   1.238
  210    HA   MET  26           HA       MET  26  -3.854 -16.070  -0.160
  211   1HB   MET  26          2HB       MET  26  -5.198 -18.017  -0.826
  212   2HB   MET  26          1HB       MET  26  -6.178 -17.834   0.622
  213   1HG   MET  26          2HG       MET  26  -7.537 -16.554  -0.546
  214   2HG   MET  26          1HG       MET  26  -6.259 -15.344  -0.612
  215   1HE   MET  26          1HE       MET  26  -8.294 -15.982  -4.031
  216   2HE   MET  26          2HE       MET  26  -8.724 -15.982  -2.322
  217   3HE   MET  26          3HE       MET  26  -8.552 -17.509  -3.188
  218    H    MET  27           H        MET  27  -5.452 -17.067   2.859
  219    HA   MET  27           HA       MET  27  -6.735 -14.589   3.312
  220   1HB   MET  27          2HB       MET  27  -6.556 -17.125   4.609
  221   2HB   MET  27          1HB       MET  27  -6.241 -15.873   5.802
  222   1HG   MET  27          2HG       MET  27  -8.346 -14.743   4.959
  223   2HG   MET  27          1HG       MET  27  -8.681 -16.245   4.097
  224   1HE   MET  27          1HE       MET  27  -9.480 -14.205   6.652
  225   2HE   MET  27          2HE       MET  27  -9.900 -15.110   8.106
  226   3HE   MET  27          3HE       MET  27 -10.912 -15.238   6.668
  227    H    LYS  28           H        LYS  28  -3.795 -15.982   4.771
  228    HA   LYS  28           HA       LYS  28  -3.148 -13.679   6.276
  229   1HB   LYS  28          2HB       LYS  28  -2.291 -15.960   6.760
  230   2HB   LYS  28          1HB       LYS  28  -1.289 -15.864   5.319
  231   1HG   LYS  28          2HG       LYS  28   0.006 -14.089   6.248
  232   2HG   LYS  28          1HG       LYS  28  -1.098 -13.933   7.617
  233   1HD   LYS  28          2HD       LYS  28  -0.249 -15.747   8.685
  234   2HD   LYS  28          1HD       LYS  28   0.118 -16.596   7.181
  235   1HE   LYS  28          2HE       LYS  28   1.858 -14.546   7.009
  236   2HE   LYS  28          1HE       LYS  28   1.763 -14.722   8.760
  237   1HZ   LYS  28          1HZ       LYS  28   2.747 -16.746   8.706
  238   2HZ   LYS  28          2HZ       LYS  28   3.448 -16.113   7.304
  239   3HZ   LYS  28          3HZ       LYS  28   2.122 -17.156   7.185
  240    H    GLY  29           H        GLY  29  -1.648 -14.973   3.312
  241   1HA   GLY  29          2HA       GLY  29   0.074 -12.828   2.827
  242   2HA   GLY  29          1HA       GLY  29  -0.496 -13.959   1.619
  243    H    ALA  30           H        ALA  30  -2.908 -13.512   0.989
  244    HA   ALA  30           HA       ALA  30  -2.953 -11.022  -0.302
  245   1HB   ALA  30          1HB       ALA  30  -5.413 -12.654   0.227
  246   2HB   ALA  30          2HB       ALA  30  -4.181 -13.165  -0.928
  247   3HB   ALA  30          3HB       ALA  30  -5.038 -11.642  -1.166
  248    H    GLY  31           H        GLY  31  -4.448 -12.111   2.704
  249   1HA   GLY  31          2HA       GLY  31  -6.119  -9.894   3.137
  250   2HA   GLY  31          1HA       GLY  31  -5.491 -10.954   4.390
  251    H    TRP  32           H        TRP  32  -2.875 -10.531   4.497
  252    HA   TRP  32           HA       TRP  32  -2.658  -8.045   5.780
  253   1HB   TRP  32          2HB       TRP  32  -0.526  -8.689   6.376
  254   2HB   TRP  32          1HB       TRP  32  -1.277 -10.237   6.033
  255    HD1  TRP  32           HD       TRP  32  -0.075 -11.754   4.328
  256    HE1  TRP  32           1HE      TRP  32   1.927 -11.490   2.739
  257    HE3  TRP  32           3HE      TRP  32   0.711  -6.737   4.857
  258    HZ2  TRP  32           2HZ      TRP  32   3.629  -9.425   1.838
  259    HZ3  TRP  32           3HZ      TRP  32   2.551  -5.693   3.603
  260    HH2  TRP  32           HH       TRP  32   3.981  -7.011   2.126
  261    H    ALA  33           H        ALA  33  -1.327  -9.092   2.634
  262    HA   ALA  33           HA       ALA  33  -0.061  -6.713   1.955
  263   1HB   ALA  33          1HB       ALA  33  -0.119  -9.023   0.755
  264   2HB   ALA  33          2HB       ALA  33   0.123  -7.552  -0.186
  265   3HB   ALA  33          3HB       ALA  33  -1.466  -8.314  -0.138
  266    H    GLY  34           H        GLY  34  -3.383  -7.755   1.185
  267   1HA   GLY  34          2HA       GLY  34  -4.141  -5.381  -0.124
  268   2HA   GLY  34          1HA       GLY  34  -5.242  -6.551   0.593
  269    H    GLY  35           H        GLY  35  -4.256  -6.353   3.278
  270   1HA   GLY  35          2HA       GLY  35  -5.825  -4.196   4.201
  271   2HA   GLY  35          1HA       GLY  35  -4.704  -5.136   5.175
  272    H    VAL  36           H        VAL  36  -2.295  -4.599   4.184
  273    HA   VAL  36           HA       VAL  36  -1.717  -2.030   5.192
  274    HB   VAL  36           HB       VAL  36   0.080  -3.771   3.498
  275   1HG1  VAL  36          1HG1      VAL  36   0.892  -1.485   3.809
  276   2HG1  VAL  36          2HG1      VAL  36   1.888  -2.635   4.702
  277   3HG1  VAL  36          3HG1      VAL  36   0.701  -1.647   5.553
  278   1HG2  VAL  36          1HG2      VAL  36  -0.429  -5.230   5.186
  279   2HG2  VAL  36          2HG2      VAL  36  -0.757  -3.950   6.350
  280   3HG2  VAL  36          3HG2      VAL  36   0.907  -4.356   5.929
  281    H    PHE  37           H        PHE  37  -1.660  -3.315   1.870
  282    HA   PHE  37           HA       PHE  37  -0.835  -0.945   0.622
  283   1HB   PHE  37          2HB       PHE  37  -2.113  -3.472  -0.263
  284   2HB   PHE  37          1HB       PHE  37  -2.262  -2.092  -1.346
  285    HD1  PHE  37           2HD      PHE  37   0.098  -0.745  -1.539
  286    HD2  PHE  37           1HD      PHE  37  -0.383  -4.896  -0.727
  287    HE1  PHE  37           2HE      PHE  37   2.360  -1.174  -2.410
  288    HE2  PHE  37           1HE      PHE  37   1.878  -5.331  -1.596
  289    HZ   PHE  37           HZ       PHE  37   3.252  -3.469  -2.439
  290    H    PHE  38           H        PHE  38  -4.106  -2.245   1.148
  291    HA   PHE  38           HA       PHE  38  -5.463  -0.100  -0.090
  292   1HB   PHE  38          2HB       PHE  38  -6.292  -2.473   0.674
  293   2HB   PHE  38          1HB       PHE  38  -6.704  -1.631   2.164
  294    HD1  PHE  38           1HD      PHE  38  -7.128  -1.316  -1.522
  295    HD2  PHE  38           2HD      PHE  38  -8.806  -0.690   2.339
  296    HE1  PHE  38           1HE      PHE  38  -9.229  -0.569  -2.561
  297    HE2  PHE  38           2HE      PHE  38 -10.911   0.059   1.306
  298    HZ   PHE  38           HZ       PHE  38 -11.124   0.119  -1.147
  299    H    GLY  39           H        GLY  39  -4.722  -0.743   3.334
  300   1HA   GLY  39          2HA       GLY  39  -5.981   1.544   4.379
  301   2HA   GLY  39          1HA       GLY  39  -4.694   0.642   5.164
  302    H    THR  40           H        THR  40  -2.515   1.020   3.737
  303    HA   THR  40           HA       THR  40  -1.643   3.571   4.392
  304    HB   THR  40           HB       THR  40  -0.478   1.794   2.239
  305    HG1  THR  40           1HG      THR  40  -0.826   1.025   4.591
  306   1HG2  THR  40          1HG2      THR  40   0.558   4.153   3.716
  307   2HG2  THR  40          2HG2      THR  40   0.800   3.670   2.037
  308   3HG2  THR  40          3HG2      THR  40   1.668   2.838   3.327
  309    H    LEU  41           H        LEU  41  -2.867   2.349   1.295
  310    HA   LEU  41           HA       LEU  41  -2.326   4.672  -0.202
  311   1HB   LEU  41          2HB       LEU  41  -3.764   2.191  -0.579
  312   2HB   LEU  41          1HB       LEU  41  -4.637   3.530  -1.296
  313    HG   LEU  41           HG       LEU  41  -3.251   2.570  -2.984
  314   1HD1  LEU  41          1HD1      LEU  41  -3.079   4.702  -3.618
  315   2HD1  LEU  41          2HD1      LEU  41  -1.434   4.623  -2.989
  316   3HD1  LEU  41          3HD1      LEU  41  -2.734   5.260  -1.983
  317   1HD2  LEU  41          1HD2      LEU  41  -1.608   1.755  -1.030
  318   2HD2  LEU  41          2HD2      LEU  41  -0.695   3.143  -1.618
  319   3HD2  LEU  41          3HD2      LEU  41  -1.127   1.841  -2.724
  320    H    LEU  42           H        LEU  42  -5.025   3.742   1.835
  321    HA   LEU  42           HA       LEU  42  -6.750   5.864   1.069
  322   1HB   LEU  42          2HB       LEU  42  -7.399   3.702   2.209
  323   2HB   LEU  42          1HB       LEU  42  -6.768   4.388   3.694
  324    HG   LEU  42           HG       LEU  42  -8.495   6.349   2.849
  325   1HD1  LEU  42          1HD1      LEU  42 -10.205   5.565   1.653
  326   2HD1  LEU  42          2HD1      LEU  42 -10.306   4.085   2.607
  327   3HD1  LEU  42          3HD1      LEU  42  -9.162   4.196   1.269
  328   1HD2  LEU  42          1HD2      LEU  42  -9.257   6.019   4.912
  329   2HD2  LEU  42          2HD2      LEU  42  -8.188   4.621   5.016
  330   3HD2  LEU  42          3HD2      LEU  42  -9.860   4.415   4.498
  331    H    LEU  43           H        LEU  43  -4.503   5.423   3.785
  332    HA   LEU  43           HA       LEU  43  -5.075   7.917   5.012
  333   1HB   LEU  43          2HB       LEU  43  -3.296   5.682   5.438
  334   2HB   LEU  43          1HB       LEU  43  -2.455   7.197   5.703
  335    HG   LEU  43           HG       LEU  43  -4.941   7.409   7.037
  336   1HD1  LEU  43          1HD1      LEU  43  -4.623   4.788   6.773
  337   2HD1  LEU  43          2HD1      LEU  43  -5.269   5.513   8.246
  338   3HD1  LEU  43          3HD1      LEU  43  -3.573   5.036   8.168
  339   1HD2  LEU  43          1HD2      LEU  43  -2.889   8.522   7.697
  340   2HD2  LEU  43          2HD2      LEU  43  -2.142   6.969   8.071
  341   3HD2  LEU  43          3HD2      LEU  43  -3.506   7.544   9.030
  342    H    ILE  44           H        ILE  44  -2.255   6.849   3.104
  343    HA   ILE  44           HA       ILE  44  -1.064   9.395   2.956
  344    HB   ILE  44           HB       ILE  44  -0.749   7.153   0.955
  345   1HG1  ILE  44          2HG1      ILE  44  -0.330   6.239   3.147
  346   2HG1  ILE  44          1HG1      ILE  44   1.221   6.501   2.358
  347   1HG2  ILE  44          1HG2      ILE  44   1.252   9.253   1.753
  348   2HG2  ILE  44          2HG2      ILE  44   0.146   9.444   0.391
  349   3HG2  ILE  44          3HG2      ILE  44   1.329   8.135   0.390
  350   1HD1  ILE  44          1HD1      ILE  44   0.291   7.479   4.858
  351   2HD1  ILE  44          2HD1      ILE  44   0.619   8.848   3.796
  352   3HD1  ILE  44          3HD1      ILE  44   1.880   7.658   4.117
  353    H    GLY  45           H        GLY  45  -3.218   7.658   0.733
  354   1HA   GLY  45          2HA       GLY  45  -3.209   9.579  -1.320
  355   2HA   GLY  45          1HA       GLY  45  -4.482   8.403  -1.033
  356    H    PHE  46           H        PHE  46  -5.349   9.217   1.492
  357    HA   PHE  46           HA       PHE  46  -7.114  11.303   0.815
  358   1HB   PHE  46          2HB       PHE  46  -7.471   9.495   2.558
  359   2HB   PHE  46          1HB       PHE  46  -6.430  10.431   3.625
  360    HD1  PHE  46           2HD      PHE  46  -9.521  10.712   1.579
  361    HD2  PHE  46           1HD      PHE  46  -7.351  12.071   4.978
  362    HE1  PHE  46           2HE      PHE  46 -11.468  12.038   2.286
  363    HE2  PHE  46           1HE      PHE  46  -9.296  13.399   5.693
  364    HZ   PHE  46           HZ       PHE  46 -11.356  13.385   4.345
  365    H    PHE  47           H        PHE  47  -4.295  11.272   2.994
  366    HA   PHE  47           HA       PHE  47  -4.432  14.007   3.667
  367   1HB   PHE  47          2HB       PHE  47  -2.721  11.785   4.238
  368   2HB   PHE  47          1HB       PHE  47  -1.719  13.156   3.775
  369    HD1  PHE  47           2HD      PHE  47  -3.189  15.427   4.835
  370    HD2  PHE  47           1HD      PHE  47  -2.537  11.583   6.532
  371    HE1  PHE  47           2HE      PHE  47  -3.456  16.383   7.083
  372    HE2  PHE  47           1HE      PHE  47  -2.801  12.531   8.787
  373    HZ   PHE  47           HZ       PHE  47  -3.260  14.935   9.064
  374    H    ARG  48           H        ARG  48  -3.131  12.327   0.933
  375    HA   ARG  48           HA       ARG  48  -1.432  14.387  -0.027
  376   1HB   ARG  48          2HB       ARG  48  -2.594  11.880  -1.165
  377   2HB   ARG  48          1HB       ARG  48  -1.877  13.055  -2.258
  378   1HG   ARG  48          2HG       ARG  48   0.080  12.894  -0.436
  379   2HG   ARG  48          1HG       ARG  48  -0.600  11.274  -0.289
  380   1HD   ARG  48          2HD       ARG  48   0.449  10.660  -2.140
  381   2HD   ARG  48          1HD       ARG  48  -0.422  11.892  -3.048
  382    HE   ARG  48           HE       ARG  48   1.395  13.426  -2.516
  383   1HH1  ARG  48          1HH1      ARG  48   2.036  10.010  -2.099
  384   2HH1  ARG  48          2HH1      ARG  48   3.751  10.198  -2.228
  385   1HH2  ARG  48          1HH2      ARG  48   3.646  13.659  -2.673
  386   2HH2  ARG  48          2HH2      ARG  48   4.664  12.264  -2.553
  387    H    VAL  49           H        VAL  49  -4.587  13.230  -1.212
  388    HA   VAL  49           HA       VAL  49  -4.970  15.546  -2.846
  389    HB   VAL  49           HB       VAL  49  -5.915  13.392  -3.514
  390   1HG1  VAL  49          1HG1      VAL  49  -6.462  12.670  -1.153
  391   2HG1  VAL  49          2HG1      VAL  49  -7.672  12.298  -2.380
  392   3HG1  VAL  49          3HG1      VAL  49  -7.913  13.659  -1.284
  393   1HG2  VAL  49          1HG2      VAL  49  -7.656  15.764  -3.122
  394   2HG2  VAL  49          2HG2      VAL  49  -8.407  14.269  -3.680
  395   3HG2  VAL  49          3HG2      VAL  49  -7.097  14.999  -4.610
  396    H    VAL  50           H        VAL  50  -6.636  14.328   0.067
  397    HA   VAL  50           HA       VAL  50  -8.156  16.714   0.386
  398    HB   VAL  50           HB       VAL  50  -7.678  14.566   2.445
  399   1HG1  VAL  50          1HG1      VAL  50 -10.015  16.440   2.135
  400   2HG1  VAL  50          2HG1      VAL  50  -8.660  16.727   3.226
  401   3HG1  VAL  50          3HG1      VAL  50  -9.701  15.322   3.462
  402   1HG2  VAL  50          1HG2      VAL  50  -8.515  13.391   0.611
  403   2HG2  VAL  50          2HG2      VAL  50  -9.576  14.716   0.130
  404   3HG2  VAL  50          3HG2      VAL  50  -9.950  13.767   1.563
  405    H    GLY  51           H        GLY  51  -5.350  15.366   2.104
  406   1HA   GLY  51          2HA       GLY  51  -5.119  17.406   4.009
  407   2HA   GLY  51          1HA       GLY  51  -3.800  16.392   3.455
  408    H    ARG  52           H        ARG  52  -4.811  17.692   0.688
  409    HA   ARG  52           HA       ARG  52  -4.253  19.467  -0.616
  410   1HB   ARG  52          2HB       ARG  52  -4.468  20.637   1.951
  411   2HB   ARG  52          1HB       ARG  52  -2.981  21.257   1.244
  412   1HG   ARG  52          2HG       ARG  52  -4.070  22.484  -0.294
  413   2HG   ARG  52          1HG       ARG  52  -5.307  21.253  -0.551
  414   1HD   ARG  52          2HD       ARG  52  -6.402  23.126   0.408
  415   2HD   ARG  52          1HD       ARG  52  -6.273  21.909   1.676
  416    HE   ARG  52           HE       ARG  52  -4.060  23.469   2.002
  417   1HH1  ARG  52          1HH1      ARG  52  -7.497  24.093   1.883
  418   2HH1  ARG  52          2HH1      ARG  52  -7.411  25.446   2.961
  419   1HH2  ARG  52          1HH2      ARG  52  -3.951  25.235   3.421
  420   2HH2  ARG  52          2HH2      ARG  52  -5.398  26.091   3.839
  421    H    MET  53           H        MET  53  -2.610  17.313  -0.338
  422    HA   MET  53           HA       MET  53  -0.470  16.544  -0.602
  423   1HB   MET  53          2HB       MET  53   0.802  17.695  -2.301
  424   2HB   MET  53          1HB       MET  53  -0.902  17.740  -2.728
  425   1HG   MET  53          2HG       MET  53  -1.081  20.025  -2.098
  426   2HG   MET  53          1HG       MET  53   0.523  20.011  -1.369
  427   1HE   MET  53          1HE       MET  53  -0.512  21.899  -4.857
  428   2HE   MET  53          2HE       MET  53   0.774  22.508  -3.814
  429   3HE   MET  53          3HE       MET  53  -0.748  21.965  -3.109
  430    H    LEU  54           H        LEU  54  -0.924  18.136   1.836
  431    HA   LEU  54           HA       LEU  54   1.094  19.917   2.438
  432   1HB   LEU  54          2HB       LEU  54  -0.898  19.235   3.860
  433   2HB   LEU  54          1HB       LEU  54   0.059  17.867   4.384
  434    HG   LEU  54           HG       LEU  54   0.041  19.767   5.985
  435   1HD1  LEU  54          1HD1      LEU  54   2.067  19.176   6.717
  436   2HD1  LEU  54          2HD1      LEU  54   2.863  19.668   5.223
  437   3HD1  LEU  54          3HD1      LEU  54   2.080  18.091   5.324
  438   1HD2  LEU  54          1HD2      LEU  54   1.692  21.639   5.301
  439   2HD2  LEU  54          2HD2      LEU  54   0.021  21.716   4.742
  440   3HD2  LEU  54          3HD2      LEU  54   1.288  21.159   3.655
  441    HA   PRO  55           HA       PRO  55   3.666  15.923   4.016
  442   1HB   PRO  55          2HB       PRO  55   2.813  14.339   1.624
  443   2HB   PRO  55          1HB       PRO  55   3.286  13.778   3.234
  444   1HG   PRO  55          2HG       PRO  55   0.722  13.870   2.552
  445   2HG   PRO  55          1HG       PRO  55   1.242  14.349   4.178
  446   1HD   PRO  55          2HD       PRO  55   0.366  16.044   1.894
  447   2HD   PRO  55          1HD       PRO  55   0.165  16.299   3.637
  448    H    ILE  56           H        ILE  56   5.505  16.997   3.534
  449    HA   ILE  56           HA       ILE  56   7.397  17.586   2.410
  450    HB   ILE  56           HB       ILE  56   6.425  15.863   0.133
  451   1HG1  ILE  56          2HG1      ILE  56   6.396  14.598   2.254
  452   2HG1  ILE  56          1HG1      ILE  56   7.649  14.017   1.161
  453   1HG2  ILE  56          1HG2      ILE  56   9.113  16.925   0.957
  454   2HG2  ILE  56          2HG2      ILE  56   8.262  17.160  -0.569
  455   3HG2  ILE  56          3HG2      ILE  56   8.929  15.578  -0.168
  456   1HD1  ILE  56          1HD1      ILE  56   8.581  16.081   2.989
  457   2HD1  ILE  56          2HD1      ILE  56   9.275  14.508   2.596
  458   3HD1  ILE  56          3HD1      ILE  56   7.990  14.629   3.799
  459    H    GLN  57           H        GLN  57   8.186  18.841   0.553
  460    HA   GLN  57           HA       GLN  57   8.026  20.386  -1.121
  461   1HB   GLN  57          2HB       GLN  57   6.036  18.857  -1.879
  462   2HB   GLN  57          1HB       GLN  57   5.044  20.165  -1.250
  463   1HG   GLN  57          2HG       GLN  57   5.278  20.629  -3.523
  464   2HG   GLN  57          1HG       GLN  57   6.416  21.711  -2.723
  465   1HE2  GLN  57          1HE2      GLN  57   6.136  18.677  -4.480
  466   2HE2  GLN  57          2HE2      GLN  57   7.750  18.671  -5.096
  467    H    GLU  58           H        GLU  58   5.561  20.484   1.406
  468    HA   GLU  58           HA       GLU  58   5.137  23.279   1.290
  469   1HB   GLU  58          2HB       GLU  58   4.068  21.089   2.712
  470   2HB   GLU  58          1HB       GLU  58   4.644  22.230   3.921
  471   1HG   GLU  58          2HG       GLU  58   2.674  22.759   1.713
  472   2HG   GLU  58          1HG       GLU  58   2.355  22.705   3.444
  473    H    ASN  59           H        ASN  59   7.034  21.265   3.548
  474    HA   ASN  59           HA       ASN  59   8.848  21.729   4.842
  475   1HB   ASN  59          2HB       ASN  59   9.057  23.946   2.822
  476   2HB   ASN  59          1HB       ASN  59  10.172  23.858   4.181
  477   1HD2  ASN  59          1HD2      ASN  59  11.659  23.707   2.280
  478   2HD2  ASN  59          2HD2      ASN  59  12.025  22.124   1.692
  479    H    GLN  60           H        GLN  60   6.058  23.256   5.076
  480    HA   GLN  60           HA       GLN  60   5.071  24.668   6.555
  481   1HB   GLN  60          2HB       GLN  60   7.119  23.215   7.967
  482   2HB   GLN  60          1HB       GLN  60   6.923  24.813   8.672
  483   1HG   GLN  60          2HG       GLN  60   4.722  22.806   8.229
  484   2HG   GLN  60          1HG       GLN  60   5.514  23.151   9.766
  485   1HE2  GLN  60          1HE2      GLN  60   5.631  25.779   9.938
  486   2HE2  GLN  60          2HE2      GLN  60   4.064  26.501   9.868
  487    H    ALA  61           H        ALA  61   7.101  25.738   4.619
  488    HA   ALA  61           HA       ALA  61   7.946  27.771   4.047
  489   1HB   ALA  61          1HB       ALA  61   6.133  28.473   6.300
  490   2HB   ALA  61          2HB       ALA  61   6.087  28.978   4.612
  491   3HB   ALA  61          3HB       ALA  61   7.261  29.696   5.715
  492    HA   PRO  62           HA       PRO  62  11.844  28.415   5.981
  493   1HB   PRO  62          2HB       PRO  62  11.307  31.340   6.027
  494   2HB   PRO  62          1HB       PRO  62  12.660  30.454   5.315
  495   1HG   PRO  62          2HG       PRO  62  10.741  31.484   3.777
  496   2HG   PRO  62          1HG       PRO  62  11.475  29.914   3.402
  497   1HD   PRO  62          2HD       PRO  62   8.812  30.514   4.610
  498   2HD   PRO  62          1HD       PRO  62   9.274  29.234   3.477
  499    H    ALA  63           H        ALA  63   9.041  29.909   7.363
  500    HA   ALA  63           HA       ALA  63   8.370  29.773   9.575
  501   1HB   ALA  63          1HB       ALA  63  10.872  30.052  10.990
  502   2HB   ALA  63          2HB       ALA  63  10.879  28.643   9.930
  503   3HB   ALA  63          3HB       ALA  63   9.617  28.830  11.140
  504    HA   PRO  64           HA       PRO  64  10.162  33.993  10.889
  505   1HB   PRO  64          2HB       PRO  64  12.542  34.533   9.269
  506   2HB   PRO  64          1HB       PRO  64  12.351  34.577  11.023
  507   1HG   PRO  64          2HG       PRO  64  13.799  32.671   9.788
  508   2HG   PRO  64          1HG       PRO  64  12.879  32.350  11.269
  509   1HD   PRO  64          2HD       PRO  64  12.165  31.721   8.424
  510   2HD   PRO  64          1HD       PRO  64  12.003  30.718   9.877
  511    H    ASN  65           H        ASN  65   8.361  33.578   8.952
  512    HA   ASN  65           HA       ASN  65   8.913  35.234   6.642
  513   1HB   ASN  65          2HB       ASN  65   6.834  33.313   7.451
  514   2HB   ASN  65          1HB       ASN  65   6.240  34.683   6.513
  515   1HD2  ASN  65          1HD2      ASN  65   8.916  32.360   6.518
  516   2HD2  ASN  65          2HD2      ASN  65   8.932  32.124   4.808
  517    H    ILE  66           H        ILE  66   7.229  35.422   9.678
  518    HA   ILE  66           HA       ILE  66   6.535  37.259  10.854
  519    HB   ILE  66           HB       ILE  66   6.898  38.967   8.395
  520   1HG1  ILE  66          2HG1      ILE  66   8.940  38.586  10.587
  521   2HG1  ILE  66          1HG1      ILE  66   9.000  37.688   9.075
  522   1HG2  ILE  66          1HG2      ILE  66   7.171  39.832  11.245
  523   2HG2  ILE  66          2HG2      ILE  66   5.585  39.708  10.489
  524   3HG2  ILE  66          3HG2      ILE  66   6.798  40.796   9.817
  525   1HD1  ILE  66          1HD1      ILE  66  10.421  39.801   9.300
  526   2HD1  ILE  66          2HD1      ILE  66   8.905  40.676   9.092
  527   3HD1  ILE  66          3HD1      ILE  66   9.476  39.587   7.827
  528    H    THR  67           H        THR  67   4.523  38.132  11.219
  529    HA   THR  67           HA       THR  67   2.364  37.020   9.826
  530    HB   THR  67           HB       THR  67   2.007  37.629  12.090
  531    HG1  THR  67           1HG      THR  67   0.249  39.148  11.897
  532   1HG2  THR  67          1HG2      THR  67   2.609  40.492  11.391
  533   2HG2  THR  67          2HG2      THR  67   3.686  39.413  12.276
  534   3HG2  THR  67          3HG2      THR  67   2.131  39.866  12.969
  535    H    GLY  68           H        GLY  68   3.933  40.162   9.564
  536   1HA   GLY  68          2HA       GLY  68   3.011  40.539   6.906
  537   2HA   GLY  68          1HA       GLY  68   2.073  41.521   8.021
  538    H    ALA  69           H        ALA  69   3.048  43.211   6.595
  539    HA   ALA  69           HA       ALA  69   4.279  45.142   6.672
  540   1HB   ALA  69          1HB       ALA  69   6.583  44.554   8.200
  541   2HB   ALA  69          2HB       ALA  69   5.199  43.888   9.064
  542   3HB   ALA  69          3HB       ALA  69   5.224  45.592   8.623
  543    H    LEU  70           H        LEU  70   6.487  42.351   6.903
  544    HA   LEU  70           HA       LEU  70   8.060  41.539   5.482
  545   1HB   LEU  70          2HB       LEU  70   6.247  42.997   3.655
  546   2HB   LEU  70          1HB       LEU  70   7.852  42.660   3.038
  547    HG   LEU  70           HG       LEU  70   6.215  40.943   2.389
  548   1HD1  LEU  70          1HD1      LEU  70   8.665  40.462   2.789
  549   2HD1  LEU  70          2HD1      LEU  70   7.580  39.073   2.828
  550   3HD1  LEU  70          3HD1      LEU  70   8.178  39.765   4.334
  551   1HD2  LEU  70          1HD2      LEU  70   4.628  40.667   3.995
  552   2HD2  LEU  70          2HD2      LEU  70   5.773  40.870   5.321
  553   3HD2  LEU  70          3HD2      LEU  70   5.700  39.341   4.445
  554    H    GLU  71           H        GLU  71   9.910  42.289   6.315
  555    HA   GLU  71           HA       GLU  71  11.917  43.380   6.231
  556   1HB   GLU  71          2HB       GLU  71  10.543  45.226   4.270
  557   2HB   GLU  71          1HB       GLU  71  12.210  45.407   4.785
  558   1HG   GLU  71          2HG       GLU  71  11.474  42.750   3.755
  559   2HG   GLU  71          1HG       GLU  71  11.461  44.070   2.585
  560    H    HIS  72           H        HIS  72  12.755  45.726   6.747
  561    HA   HIS  72           HA       HIS  72  10.983  46.784   8.848
  562   1HB   HIS  72          2HB       HIS  72  13.675  45.879   8.943
  563   2HB   HIS  72          1HB       HIS  72  13.701  47.619   9.205
  564    HD1  HIS  72           1HD      HIS  72  12.745  48.496  11.406
  565    HD2  HIS  72           2HD      HIS  72  12.342  44.387  10.939
  566    HE1  HIS  72           1HE      HIS  72  12.051  47.628  13.662
  567    HE2  HIS  72           2HE      HIS  72  11.906  45.129  13.377
  568    H    HIS  73           H        HIS  73  11.239  49.119   9.322
  569    HA   HIS  73           HA       HIS  73  10.934  50.669   6.989
  570   1HB   HIS  73          2HB       HIS  73  11.568  51.766   9.730
  571   2HB   HIS  73          1HB       HIS  73  10.682  52.556   8.431
  572    HD1  HIS  73           1HD      HIS  73   9.277  52.494  11.037
  573    HD2  HIS  73           2HD      HIS  73   9.016  49.353   8.328
  574    HE1  HIS  73           1HE      HIS  73   7.159  51.272  11.626
  575    HE2  HIS  73           2HE      HIS  73   7.052  49.342  10.011
  576    H    HIS  74           H        HIS  74  13.368  51.331   9.508
  577    HA   HIS  74           HA       HIS  74  15.536  52.000   9.396
  578   1HB   HIS  74          2HB       HIS  74  15.468  49.880   7.768
  579   2HB   HIS  74          1HB       HIS  74  15.866  51.112   6.575
  580    HD1  HIS  74           1HD      HIS  74  18.203  52.195   6.723
  581    HD2  HIS  74           2HD      HIS  74  17.486  49.328   9.644
  582    HE1  HIS  74           1HE      HIS  74  20.442  51.723   7.767
  583    HE2  HIS  74           2HE      HIS  74  19.993  49.946   9.496
  584    H    HIS  75           H        HIS  75  13.643  53.913   8.874
  585    HA   HIS  75           HA       HIS  75  15.021  55.583   6.883
  586   1HB   HIS  75          2HB       HIS  75  12.261  54.771   6.909
  587   2HB   HIS  75          1HB       HIS  75  12.361  56.518   7.091
  588    HD1  HIS  75           1HD      HIS  75  15.146  56.287   5.200
  589    HD2  HIS  75           2HD      HIS  75  11.195  55.362   4.304
  590    HE1  HIS  75           1HE      HIS  75  14.987  56.382   2.695
  591    HE2  HIS  75           2HE      HIS  75  12.616  55.711   2.172
  592    H    HIS  76           H        HIS  76  16.246  56.704   8.355
  593    HA   HIS  76           HA       HIS  76  14.853  58.755   9.838
  594   1HB   HIS  76          2HB       HIS  76  15.925  56.406  11.166
  595   2HB   HIS  76          1HB       HIS  76  16.694  57.879  11.749
  596    HD1  HIS  76           1HD      HIS  76  13.791  55.822  12.269
  597    HD2  HIS  76           2HD      HIS  76  14.658  59.871  12.611
  598    HE1  HIS  76           1HE      HIS  76  11.986  56.773  13.739
  599    HE2  HIS  76           2HE      HIS  76  12.568  59.212  13.985
  600    H    HIS  77           H        HIS  77  16.213  60.506  10.440
  601    HA   HIS  77           HA       HIS  77  19.014  60.501  10.004
  602   1HB   HIS  77          2HB       HIS  77  18.985  62.060   8.023
  603   2HB   HIS  77          1HB       HIS  77  18.515  60.402   7.669
  604    HD1  HIS  77           1HD      HIS  77  15.599  60.294   8.156
  605    HD2  HIS  77           2HD      HIS  77  17.410  63.664   6.538
  606    HE1  HIS  77           1HE      HIS  77  13.767  61.534   6.973
  607    HE2  HIS  77           2HE      HIS  77  14.860  63.633   6.110
  Start of MODEL    6
    1   1H    ALA   1          1HT       ALA   1 -10.375 -57.056   4.435
    2   2H    ALA   1          2HT       ALA   1  -9.133 -56.785   3.288
    3   3H    ALA   1          3HT       ALA   1 -10.199 -55.514   3.713
    4    HA   ALA   1           HA       ALA   1  -9.158 -55.024   5.557
    5   1HB   ALA   1          1HB       ALA   1  -7.913 -56.860   6.879
    6   2HB   ALA   1          2HB       ALA   1  -8.805 -57.976   5.844
    7   3HB   ALA   1          3HB       ALA   1  -9.677 -56.842   6.876
    8    H    ASP   2           H        ASP   2  -7.556 -57.040   3.174
    9    HA   ASP   2           HA       ASP   2  -4.901 -56.271   3.888
   10   1HB   ASP   2          2HB       ASP   2  -6.188 -57.955   1.897
   11   2HB   ASP   2          1HB       ASP   2  -4.847 -57.047   1.208
   12    H    LYS   3           H        LYS   3  -6.262 -53.930   3.845
   13    HA   LYS   3           HA       LYS   3  -4.814 -52.423   1.898
   14   1HB   LYS   3          2HB       LYS   3  -7.112 -53.305   0.871
   15   2HB   LYS   3          1HB       LYS   3  -7.741 -51.905   1.728
   16   1HG   LYS   3          2HG       LYS   3  -6.882 -50.467   0.251
   17   2HG   LYS   3          1HG       LYS   3  -5.348 -51.335   0.158
   18   1HD   LYS   3          2HD       LYS   3  -6.457 -53.022  -1.291
   19   2HD   LYS   3          1HD       LYS   3  -7.909 -52.019  -1.279
   20   1HE   LYS   3          2HE       LYS   3  -6.076 -50.189  -2.013
   21   2HE   LYS   3          1HE       LYS   3  -5.347 -51.642  -2.695
   22   1HZ   LYS   3          1HZ       LYS   3  -7.318 -52.066  -3.945
   23   2HZ   LYS   3          2HZ       LYS   3  -6.866 -50.462  -4.228
   24   3HZ   LYS   3          3HZ       LYS   3  -8.152 -50.805  -3.186
   25    H    THR   4           H        THR   4  -3.950 -51.273   3.561
   26    HA   THR   4           HA       THR   4  -5.467 -50.214   5.718
   27    HB   THR   4           HB       THR   4  -3.194 -48.669   5.618
   28    HG1  THR   4           1HG      THR   4  -2.328 -51.208   4.775
   29   1HG2  THR   4          1HG2      THR   4  -3.352 -49.642   7.633
   30   2HG2  THR   4          2HG2      THR   4  -2.221 -50.797   6.928
   31   3HG2  THR   4          3HG2      THR   4  -3.946 -51.166   6.976
   32    H    ILE   5           H        ILE   5  -6.483 -48.296   5.954
   33    HA   ILE   5           HA       ILE   5  -7.666 -46.471   5.219
   34    HB   ILE   5           HB       ILE   5  -5.361 -45.707   6.024
   35   1HG1  ILE   5          2HG1      ILE   5  -5.793 -43.368   5.462
   36   2HG1  ILE   5          1HG1      ILE   5  -6.894 -43.856   4.184
   37   1HG2  ILE   5          1HG2      ILE   5  -4.953 -45.264   3.077
   38   2HG2  ILE   5          2HG2      ILE   5  -4.021 -46.311   4.144
   39   3HG2  ILE   5          3HG2      ILE   5  -3.961 -44.562   4.353
   40   1HD1  ILE   5          1HD1      ILE   5  -7.676 -43.172   6.649
   41   2HD1  ILE   5          2HD1      ILE   5  -7.491 -44.912   6.862
   42   3HD1  ILE   5          3HD1      ILE   5  -8.571 -44.286   5.617
   43    H    PHE   6           H        PHE   6  -6.836 -44.664   2.987
   44    HA   PHE   6           HA       PHE   6  -7.295 -44.378   0.785
   45   1HB   PHE   6          2HB       PHE   6  -6.384 -47.255   0.584
   46   2HB   PHE   6          1HB       PHE   6  -6.559 -46.140  -0.766
   47    HD1  PHE   6           1HD      PHE   6  -5.314 -43.734  -0.054
   48    HD2  PHE   6           2HD      PHE   6  -4.192 -47.683   1.068
   49    HE1  PHE   6           1HE      PHE   6  -2.992 -42.980   0.265
   50    HE2  PHE   6           2HE      PHE   6  -1.869 -46.937   1.388
   51    HZ   PHE   6           HZ       PHE   6  -1.267 -44.583   0.986
   52    H    ASN   7           H        ASN   7  -8.729 -45.104  -1.022
   53    HA   ASN   7           HA       ASN   7 -10.786 -45.699  -1.785
   54   1HB   ASN   7          2HB       ASN   7  -9.677 -48.006  -0.640
   55   2HB   ASN   7          1HB       ASN   7 -11.331 -47.947  -0.040
   56   1HD2  ASN   7          1HD2      ASN   7 -12.909 -48.623  -1.327
   57   2HD2  ASN   7          2HD2      ASN   7 -12.743 -48.984  -3.009
   58    H    ASP   8           H        ASP   8 -10.768 -43.724   0.141
   59    HA   ASP   8           HA       ASP   8 -13.462 -43.830   1.067
   60   1HB   ASP   8          2HB       ASP   8 -11.893 -45.129   2.774
   61   2HB   ASP   8          1HB       ASP   8 -11.558 -43.496   3.339
   62    H    HIS   9           H        HIS   9 -14.156 -41.844   0.704
   63    HA   HIS   9           HA       HIS   9 -12.438 -39.630   0.312
   64   1HB   HIS   9          2HB       HIS   9 -15.435 -39.791   0.659
   65   2HB   HIS   9          1HB       HIS   9 -14.577 -38.316   0.227
   66    HD1  HIS   9           1HD      HIS   9 -16.270 -38.633  -1.922
   67    HD2  HIS   9           2HD      HIS   9 -13.017 -41.204  -1.641
   68    HE1  HIS   9           1HE      HIS   9 -15.964 -39.585  -4.229
   69    HE2  HIS   9           2HE      HIS   9 -13.940 -41.075  -4.053
   70    H    LEU  10           H        LEU  10 -13.057 -37.464   1.454
   71    HA   LEU  10           HA       LEU  10 -13.055 -36.167   3.321
   72   1HB   LEU  10          2HB       LEU  10 -14.619 -38.463   4.110
   73   2HB   LEU  10          1HB       LEU  10 -13.678 -37.873   5.465
   74    HG   LEU  10           HG       LEU  10 -15.856 -36.850   5.507
   75   1HD1  LEU  10          1HD1      LEU  10 -14.512 -35.250   6.374
   76   2HD1  LEU  10          2HD1      LEU  10 -15.025 -34.375   4.930
   77   3HD1  LEU  10          3HD1      LEU  10 -13.467 -35.200   4.955
   78   1HD2  LEU  10          1HD2      LEU  10 -16.590 -37.032   3.266
   79   2HD2  LEU  10          2HD2      LEU  10 -15.236 -36.073   2.668
   80   3HD2  LEU  10          3HD2      LEU  10 -16.508 -35.307   3.619
   81    H    ASN  11           H        ASN  11 -12.177 -39.318   4.717
   82    HA   ASN  11           HA       ASN  11 -10.064 -38.386   6.266
   83   1HB   ASN  11          2HB       ASN  11  -9.329 -40.756   6.356
   84   2HB   ASN  11          1HB       ASN  11 -11.055 -40.568   6.648
   85   1HD2  ASN  11          1HD2      ASN  11  -8.662 -42.021   4.736
   86   2HD2  ASN  11          2HD2      ASN  11  -9.704 -42.801   3.600
   87    H    THR  12           H        THR  12  -7.978 -37.916   5.896
   88    HA   THR  12           HA       THR  12  -6.047 -37.475   4.785
   89    HB   THR  12           HB       THR  12  -6.553 -39.708   2.863
   90    HG1  THR  12           1HG      THR  12  -6.179 -40.004   5.653
   91   1HG2  THR  12          1HG2      THR  12  -4.375 -38.730   2.767
   92   2HG2  THR  12          2HG2      THR  12  -4.238 -40.319   3.519
   93   3HG2  THR  12          3HG2      THR  12  -4.186 -38.864   4.514
   94    H    ASN  13           H        ASN  13  -5.901 -38.339   1.769
   95    HA   ASN  13           HA       ASN  13  -6.320 -37.460  -0.273
   96   1HB   ASN  13          2HB       ASN  13  -8.693 -36.363   1.199
   97   2HB   ASN  13          1HB       ASN  13  -8.327 -35.799  -0.426
   98   1HD2  ASN  13          1HD2      ASN  13  -7.587 -37.884  -1.810
   99   2HD2  ASN  13          2HD2      ASN  13  -8.788 -39.125  -1.821
  100    HA   PRO  14           HA       PRO  14  -3.709 -33.878   0.140
  101   1HB   PRO  14          2HB       PRO  14  -3.686 -33.194  -2.525
  102   2HB   PRO  14          1HB       PRO  14  -2.655 -34.436  -1.809
  103   1HG   PRO  14          2HG       PRO  14  -5.228 -34.739  -3.303
  104   2HG   PRO  14          1HG       PRO  14  -3.750 -35.714  -3.407
  105   1HD   PRO  14          2HD       PRO  14  -5.895 -36.559  -2.033
  106   2HD   PRO  14          1HD       PRO  14  -4.242 -36.893  -1.472
  107    H    LYS  15           H        LYS  15  -6.842 -33.882  -1.397
  108    HA   LYS  15           HA       LYS  15  -7.282 -31.271  -2.053
  109   1HB   LYS  15          2HB       LYS  15  -8.936 -33.533  -1.263
  110   2HB   LYS  15          1HB       LYS  15  -9.656 -31.996  -0.801
  111   1HG   LYS  15          2HG       LYS  15 -10.067 -31.392  -2.931
  112   2HG   LYS  15          1HG       LYS  15  -8.593 -32.143  -3.544
  113   1HD   LYS  15          2HD       LYS  15  -9.717 -34.373  -3.151
  114   2HD   LYS  15          1HD       LYS  15 -11.209 -33.474  -2.869
  115   1HE   LYS  15          2HE       LYS  15 -11.286 -34.097  -5.133
  116   2HE   LYS  15          1HE       LYS  15 -10.808 -32.400  -5.138
  117   1HZ   LYS  15          1HZ       LYS  15  -8.745 -34.499  -5.168
  118   2HZ   LYS  15          2HZ       LYS  15  -8.666 -32.914  -5.752
  119   3HZ   LYS  15          3HZ       LYS  15  -9.539 -34.084  -6.605
  120    H    THR  16           H        THR  16  -7.344 -32.679   1.188
  121    HA   THR  16           HA       THR  16  -8.245 -30.302   2.478
  122    HB   THR  16           HB       THR  16  -7.681 -31.450   4.559
  123    HG1  THR  16           1HG      THR  16  -6.601 -33.401   4.526
  124   1HG2  THR  16          1HG2      THR  16  -8.653 -33.852   3.382
  125   2HG2  THR  16          2HG2      THR  16  -9.455 -32.473   2.633
  126   3HG2  THR  16          3HG2      THR  16  -9.506 -32.677   4.383
  127    H    ASN  17           H        ASN  17  -5.062 -31.770   1.949
  128    HA   ASN  17           HA       ASN  17  -3.587 -29.921   3.487
  129   1HB   ASN  17          2HB       ASN  17  -2.797 -32.173   2.604
  130   2HB   ASN  17          1HB       ASN  17  -2.543 -31.370   1.056
  131   1HD2  ASN  17          1HD2      ASN  17  -1.743 -31.064   4.492
  132   2HD2  ASN  17          2HD2      ASN  17  -0.147 -30.450   4.243
  133    H    LEU  18           H        LEU  18  -4.457 -29.995   0.058
  134    HA   LEU  18           HA       LEU  18  -3.010 -27.659  -0.636
  135   1HB   LEU  18          2HB       LEU  18  -5.238 -29.197  -1.927
  136   2HB   LEU  18          1HB       LEU  18  -4.713 -27.663  -2.596
  137    HG   LEU  18           HG       LEU  18  -2.881 -30.022  -2.158
  138   1HD1  LEU  18          1HD1      LEU  18  -4.683 -29.312  -4.390
  139   2HD1  LEU  18          2HD1      LEU  18  -4.092 -30.886  -3.861
  140   3HD1  LEU  18          3HD1      LEU  18  -3.053 -29.831  -4.817
  141   1HD2  LEU  18          1HD2      LEU  18  -2.567 -27.307  -3.380
  142   2HD2  LEU  18          2HD2      LEU  18  -1.551 -28.653  -3.896
  143   3HD2  LEU  18          3HD2      LEU  18  -1.536 -28.132  -2.212
  144    H    ARG  19           H        ARG  19  -6.269 -28.258   0.527
  145    HA   ARG  19           HA       ARG  19  -7.339 -25.702   0.058
  146   1HB   ARG  19          2HB       ARG  19  -8.687 -27.701   0.629
  147   2HB   ARG  19          1HB       ARG  19  -8.057 -27.633   2.270
  148   1HG   ARG  19          2HG       ARG  19  -9.013 -25.235   2.292
  149   2HG   ARG  19          1HG       ARG  19  -9.955 -25.774   0.900
  150   1HD   ARG  19          2HD       ARG  19 -11.374 -26.879   2.206
  151   2HD   ARG  19          1HD       ARG  19 -10.056 -27.730   3.009
  152    HE   ARG  19           HE       ARG  19 -10.430 -25.020   3.908
  153   1HH1  ARG  19          1HH1      ARG  19 -11.369 -28.352   4.346
  154   2HH1  ARG  19          2HH1      ARG  19 -11.867 -28.126   5.988
  155   1HH2  ARG  19          1HH2      ARG  19 -11.084 -24.721   6.068
  156   2HH2  ARG  19          2HH2      ARG  19 -11.707 -26.064   6.966
  157    H    LEU  20           H        LEU  20  -5.903 -27.063   3.042
  158    HA   LEU  20           HA       LEU  20  -6.097 -24.697   4.540
  159   1HB   LEU  20          2HB       LEU  20  -4.439 -25.683   6.039
  160   2HB   LEU  20          1HB       LEU  20  -5.686 -26.836   5.608
  161    HG   LEU  20           HG       LEU  20  -3.849 -27.452   3.745
  162   1HD1  LEU  20          1HD1      LEU  20  -2.310 -25.718   4.729
  163   2HD1  LEU  20          2HD1      LEU  20  -1.639 -27.343   4.577
  164   3HD1  LEU  20          3HD1      LEU  20  -2.186 -26.756   6.150
  165   1HD2  LEU  20          1HD2      LEU  20  -4.745 -29.175   5.012
  166   2HD2  LEU  20          2HD2      LEU  20  -4.250 -28.441   6.539
  167   3HD2  LEU  20          3HD2      LEU  20  -3.044 -29.180   5.484
  168    H    TRP  21           H        TRP  21  -3.582 -25.888   2.360
  169    HA   TRP  21           HA       TRP  21  -1.622 -23.974   2.969
  170   1HB   TRP  21          2HB       TRP  21  -1.305 -26.049   1.563
  171   2HB   TRP  21          1HB       TRP  21  -2.086 -25.187   0.241
  172    HD1  TRP  21           HD       TRP  21  -0.372 -24.235  -1.389
  173    HE1  TRP  21           1HE      TRP  21   2.008 -23.270  -1.229
  174    HE3  TRP  21           3HE      TRP  21   0.353 -24.678   3.655
  175    HZ2  TRP  21           2HZ      TRP  21   3.937 -22.763   0.765
  176    HZ3  TRP  21           3HZ      TRP  21   2.494 -23.929   4.607
  177    HH2  TRP  21           HH       TRP  21   4.249 -22.992   3.191
  178    H    VAL  22           H        VAL  22  -4.007 -23.971   0.305
  179    HA   VAL  22           HA       VAL  22  -3.386 -21.402  -0.636
  180    HB   VAL  22           HB       VAL  22  -6.063 -22.795  -0.818
  181   1HG1  VAL  22          1HG1      VAL  22  -4.910 -20.788  -2.735
  182   2HG1  VAL  22          2HG1      VAL  22  -5.921 -20.315  -1.370
  183   3HG1  VAL  22          3HG1      VAL  22  -6.570 -21.371  -2.623
  184   1HG2  VAL  22          1HG2      VAL  22  -3.492 -23.255  -2.170
  185   2HG2  VAL  22          2HG2      VAL  22  -4.896 -23.156  -3.233
  186   3HG2  VAL  22          3HG2      VAL  22  -4.860 -24.340  -1.929
  187    H    ALA  23           H        ALA  23  -5.861 -22.470   1.687
  188    HA   ALA  23           HA       ALA  23  -7.095 -19.997   2.075
  189   1HB   ALA  23          1HB       ALA  23  -7.153 -21.373   4.539
  190   2HB   ALA  23          2HB       ALA  23  -7.193 -22.587   3.263
  191   3HB   ALA  23          3HB       ALA  23  -8.403 -21.304   3.297
  192    H    PHE  24           H        PHE  24  -4.562 -21.518   4.082
  193    HA   PHE  24           HA       PHE  24  -4.205 -19.333   5.802
  194   1HB   PHE  24          2HB       PHE  24  -3.204 -21.900   5.624
  195   2HB   PHE  24          1HB       PHE  24  -1.780 -20.901   5.350
  196    HD1  PHE  24           2HD      PHE  24  -2.052 -18.652   7.055
  197    HD2  PHE  24           1HD      PHE  24  -3.229 -22.678   7.777
  198    HE1  PHE  24           2HE      PHE  24  -1.851 -18.272   9.477
  199    HE2  PHE  24           1HE      PHE  24  -3.032 -22.306  10.201
  200    HZ   PHE  24           HZ       PHE  24  -2.341 -20.101  11.054
  201    H    GLN  25           H        GLN  25  -2.483 -20.226   2.825
  202    HA   GLN  25           HA       GLN  25  -0.567 -18.168   2.933
  203   1HB   GLN  25          2HB       GLN  25  -0.868 -20.310   1.361
  204   2HB   GLN  25          1HB       GLN  25  -1.528 -19.094   0.276
  205   1HG   GLN  25          2HG       GLN  25   0.645 -19.012  -0.357
  206   2HG   GLN  25          1HG       GLN  25   0.689 -17.821   0.942
  207   1HE2  GLN  25          1HE2      GLN  25   2.990 -19.010   0.163
  208   2HE2  GLN  25          2HE2      GLN  25   3.542 -20.106   1.379
  209    H    MET  26           H        MET  26  -3.732 -18.323   1.333
  210    HA   MET  26           HA       MET  26  -3.591 -15.768   0.140
  211   1HB   MET  26          2HB       MET  26  -5.304 -17.880  -0.048
  212   2HB   MET  26          1HB       MET  26  -6.276 -16.739   0.868
  213   1HG   MET  26          2HG       MET  26  -6.757 -16.457  -1.443
  214   2HG   MET  26          1HG       MET  26  -5.846 -15.049  -0.895
  215   1HE   MET  26          1HE       MET  26  -5.418 -14.201  -2.831
  216   2HE   MET  26          2HE       MET  26  -4.874 -14.993  -4.311
  217   3HE   MET  26          3HE       MET  26  -3.695 -14.322  -3.184
  218    H    MET  27           H        MET  27  -4.748 -16.893   3.262
  219    HA   MET  27           HA       MET  27  -6.039 -14.516   4.058
  220   1HB   MET  27          2HB       MET  27  -4.881 -16.854   5.545
  221   2HB   MET  27          1HB       MET  27  -5.527 -15.469   6.413
  222   1HG   MET  27          2HG       MET  27  -7.694 -15.802   5.408
  223   2HG   MET  27          1HG       MET  27  -7.064 -17.119   4.420
  224   1HE   MET  27          1HE       MET  27  -8.120 -16.581   8.599
  225   2HE   MET  27          2HE       MET  27  -6.721 -15.812   7.854
  226   3HE   MET  27          3HE       MET  27  -6.508 -17.255   8.842
  227    H    LYS  28           H        LYS  28  -2.790 -15.756   4.830
  228    HA   LYS  28           HA       LYS  28  -1.964 -13.479   6.279
  229   1HB   LYS  28          2HB       LYS  28  -0.477 -15.729   4.947
  230   2HB   LYS  28          1HB       LYS  28   0.372 -14.419   5.758
  231   1HG   LYS  28          2HG       LYS  28  -1.278 -15.069   7.725
  232   2HG   LYS  28          1HG       LYS  28  -1.251 -16.624   6.890
  233   1HD   LYS  28          2HD       LYS  28   1.332 -15.234   7.430
  234   2HD   LYS  28          1HD       LYS  28   0.513 -16.054   8.760
  235   1HE   LYS  28          2HE       LYS  28   0.689 -17.610   6.278
  236   2HE   LYS  28          1HE       LYS  28   2.243 -17.241   7.027
  237   1HZ   LYS  28          1HZ       LYS  28   0.815 -19.340   7.707
  238   2HZ   LYS  28          2HZ       LYS  28   0.117 -18.224   8.771
  239   3HZ   LYS  28          3HZ       LYS  28   1.783 -18.516   8.825
  240    H    GLY  29           H        GLY  29  -1.193 -14.507   2.955
  241   1HA   GLY  29          2HA       GLY  29   0.340 -12.252   2.283
  242   2HA   GLY  29          1HA       GLY  29  -0.434 -13.334   1.141
  243    H    ALA  30           H        ALA  30  -2.906 -12.962   0.986
  244    HA   ALA  30           HA       ALA  30  -3.311 -10.401  -0.054
  245   1HB   ALA  30          1HB       ALA  30  -5.823 -11.591   0.627
  246   2HB   ALA  30          2HB       ALA  30  -4.724 -12.826   0.014
  247   3HB   ALA  30          3HB       ALA  30  -5.072 -11.395  -0.956
  248    H    GLY  31           H        GLY  31  -4.311 -11.774   3.063
  249   1HA   GLY  31          2HA       GLY  31  -5.881  -9.627   3.929
  250   2HA   GLY  31          1HA       GLY  31  -5.061 -10.765   4.984
  251    H    TRP  32           H        TRP  32  -2.562 -10.330   5.019
  252    HA   TRP  32           HA       TRP  32  -2.187  -7.860   6.288
  253   1HB   TRP  32          2HB       TRP  32  -0.836 -10.125   6.375
  254   2HB   TRP  32          1HB       TRP  32   0.143  -9.332   5.144
  255    HD1  TRP  32           HD       TRP  32  -0.695  -9.189   8.854
  256    HE1  TRP  32           1HE      TRP  32   0.966  -7.607  10.022
  257    HE3  TRP  32           3HE      TRP  32   1.613  -7.248   4.729
  258    HZ2  TRP  32           2HZ      TRP  32   2.987  -5.778   9.291
  259    HZ3  TRP  32           3HZ      TRP  32   3.398  -5.585   5.048
  260    HH2  TRP  32           HH       TRP  32   4.070  -4.865   7.283
  261    H    ALA  33           H        ALA  33  -0.732  -8.959   3.214
  262    HA   ALA  33           HA       ALA  33   0.419  -6.537   2.499
  263   1HB   ALA  33          1HB       ALA  33  -0.617  -8.171   0.276
  264   2HB   ALA  33          2HB       ALA  33   0.430  -9.001   1.427
  265   3HB   ALA  33          3HB       ALA  33   1.011  -7.566   0.583
  266    H    GLY  34           H        GLY  34  -2.741  -7.831   1.464
  267   1HA   GLY  34          2HA       GLY  34  -3.485  -5.600  -0.073
  268   2HA   GLY  34          1HA       GLY  34  -4.594  -6.775   0.618
  269    H    GLY  35           H        GLY  35  -4.182  -6.392   3.325
  270   1HA   GLY  35          2HA       GLY  35  -5.836  -4.188   3.852
  271   2HA   GLY  35          1HA       GLY  35  -4.914  -5.075   5.056
  272    H    VAL  36           H        VAL  36  -2.358  -4.568   4.520
  273    HA   VAL  36           HA       VAL  36  -1.996  -1.944   5.481
  274    HB   VAL  36           HB       VAL  36   0.136  -3.652   4.206
  275   1HG1  VAL  36          1HG1      VAL  36   0.637  -1.904   6.543
  276   2HG1  VAL  36          2HG1      VAL  36   0.364  -1.113   4.990
  277   3HG1  VAL  36          3HG1      VAL  36   1.672  -2.284   5.165
  278   1HG2  VAL  36          1HG2      VAL  36  -1.451  -4.482   6.271
  279   2HG2  VAL  36          2HG2      VAL  36  -0.105  -3.725   7.122
  280   3HG2  VAL  36          3HG2      VAL  36   0.200  -5.029   5.975
  281    H    PHE  37           H        PHE  37  -1.192  -3.369   2.309
  282    HA   PHE  37           HA       PHE  37  -0.195  -1.056   1.124
  283   1HB   PHE  37          2HB       PHE  37   0.081  -3.266   0.122
  284   2HB   PHE  37          1HB       PHE  37  -1.650  -3.365  -0.182
  285    HD1  PHE  37           1HD      PHE  37   0.832  -0.637  -0.755
  286    HD2  PHE  37           2HD      PHE  37  -1.994  -3.329  -2.453
  287    HE1  PHE  37           1HE      PHE  37   1.169   0.406  -2.958
  288    HE2  PHE  37           2HE      PHE  37  -1.661  -2.289  -4.660
  289    HZ   PHE  37           HZ       PHE  37  -0.078  -0.420  -4.913
  290    H    PHE  38           H        PHE  38  -3.485  -2.407   0.732
  291    HA   PHE  38           HA       PHE  38  -4.477  -0.154  -0.657
  292   1HB   PHE  38          2HB       PHE  38  -5.419  -2.675  -0.112
  293   2HB   PHE  38          1HB       PHE  38  -6.472  -1.667   0.875
  294    HD1  PHE  38           1HD      PHE  38  -7.809   0.138  -0.220
  295    HD2  PHE  38           2HD      PHE  38  -5.648  -2.770  -2.448
  296    HE1  PHE  38           1HE      PHE  38  -9.151   0.673  -2.212
  297    HE2  PHE  38           2HE      PHE  38  -6.983  -2.241  -4.445
  298    HZ   PHE  38           HZ       PHE  38  -8.739  -0.517  -4.329
  299    H    GLY  39           H        GLY  39  -4.374  -0.992   2.757
  300   1HA   GLY  39          2HA       GLY  39  -6.138   0.982   3.710
  301   2HA   GLY  39          1HA       GLY  39  -4.859   0.219   4.644
  302    H    THR  40           H        THR  40  -2.567   1.053   3.643
  303    HA   THR  40           HA       THR  40  -2.401   3.745   4.486
  304    HB   THR  40           HB       THR  40  -0.557   2.083   4.706
  305    HG1  THR  40           1HG      THR  40   0.234   4.351   3.209
  306   1HG2  THR  40          1HG2      THR  40  -0.557   0.999   2.568
  307   2HG2  THR  40          2HG2      THR  40   0.989   1.810   2.799
  308   3HG2  THR  40          3HG2      THR  40  -0.233   2.522   1.747
  309    H    LEU  41           H        LEU  41  -2.319   2.236   1.285
  310    HA   LEU  41           HA       LEU  41  -1.649   4.488  -0.214
  311   1HB   LEU  41          2HB       LEU  41  -1.848   2.060  -0.970
  312   2HB   LEU  41          1HB       LEU  41  -3.566   2.365  -1.144
  313    HG   LEU  41           HG       LEU  41  -2.721   4.378  -2.636
  314   1HD1  LEU  41          1HD1      LEU  41  -0.651   2.700  -3.702
  315   2HD1  LEU  41          2HD1      LEU  41  -0.300   3.107  -2.024
  316   3HD1  LEU  41          3HD1      LEU  41  -0.577   4.389  -3.203
  317   1HD2  LEU  41          1HD2      LEU  41  -2.873   1.485  -3.462
  318   2HD2  LEU  41          2HD2      LEU  41  -2.808   2.829  -4.602
  319   3HD2  LEU  41          3HD2      LEU  41  -4.166   2.683  -3.487
  320    H    LEU  42           H        LEU  42  -4.875   3.245   0.624
  321    HA   LEU  42           HA       LEU  42  -6.239   5.424  -0.608
  322   1HB   LEU  42          2HB       LEU  42  -6.950   2.930   0.369
  323   2HB   LEU  42          1HB       LEU  42  -7.746   4.045   1.465
  324    HG   LEU  42           HG       LEU  42  -8.757   5.175  -0.531
  325   1HD1  LEU  42          1HD1      LEU  42  -7.953   4.714  -2.544
  326   2HD1  LEU  42          2HD1      LEU  42  -8.630   3.091  -2.404
  327   3HD1  LEU  42          3HD1      LEU  42  -6.967   3.401  -1.901
  328   1HD2  LEU  42          1HD2      LEU  42 -10.247   3.796   0.570
  329   2HD2  LEU  42          2HD2      LEU  42  -9.325   2.336   0.214
  330   3HD2  LEU  42          3HD2      LEU  42 -10.263   3.120  -1.058
  331    H    LEU  43           H        LEU  43  -5.437   4.630   2.765
  332    HA   LEU  43           HA       LEU  43  -6.749   6.883   3.874
  333   1HB   LEU  43          2HB       LEU  43  -4.569   5.091   4.924
  334   2HB   LEU  43          1HB       LEU  43  -5.265   6.394   5.870
  335    HG   LEU  43           HG       LEU  43  -6.833   4.068   4.754
  336   1HD1  LEU  43          1HD1      LEU  43  -5.316   4.438   7.259
  337   2HD1  LEU  43          2HD1      LEU  43  -5.725   2.963   6.381
  338   3HD1  LEU  43          3HD1      LEU  43  -6.928   3.738   7.411
  339   1HD2  LEU  43          1HD2      LEU  43  -7.751   6.533   5.515
  340   2HD2  LEU  43          2HD2      LEU  43  -7.906   5.597   7.002
  341   3HD2  LEU  43          3HD2      LEU  43  -8.695   5.043   5.523
  342    H    ILE  44           H        ILE  44  -3.245   6.269   3.578
  343    HA   ILE  44           HA       ILE  44  -2.489   8.914   4.179
  344    HB   ILE  44           HB       ILE  44  -0.883   6.941   2.555
  345   1HG1  ILE  44          2HG1      ILE  44  -1.640   5.857   4.611
  346   2HG1  ILE  44          1HG1      ILE  44   0.082   6.213   4.713
  347   1HG2  ILE  44          1HG2      ILE  44  -0.249   9.462   2.883
  348   2HG2  ILE  44          2HG2      ILE  44   0.975   8.202   3.022
  349   3HG2  ILE  44          3HG2      ILE  44   0.269   8.907   4.474
  350   1HD1  ILE  44          1HD1      ILE  44  -2.179   7.311   6.256
  351   2HD1  ILE  44          2HD1      ILE  44  -0.867   8.422   5.860
  352   3HD1  ILE  44          3HD1      ILE  44  -0.529   6.941   6.756
  353    H    GLY  45           H        GLY  45  -3.097   7.267   1.114
  354   1HA   GLY  45          2HA       GLY  45  -2.141   9.274  -0.607
  355   2HA   GLY  45          1HA       GLY  45  -3.341   8.061  -1.024
  356    H    PHE  46           H        PHE  46  -5.464   8.669   0.537
  357    HA   PHE  46           HA       PHE  46  -6.604  10.869  -0.807
  358   1HB   PHE  46          2HB       PHE  46  -7.559   8.761   0.723
  359   2HB   PHE  46          1HB       PHE  46  -7.973  10.181   1.673
  360    HD1  PHE  46           2HD      PHE  46  -8.465   8.441  -1.516
  361    HD2  PHE  46           1HD      PHE  46  -9.618  11.741   0.910
  362    HE1  PHE  46           2HE      PHE  46 -10.403   8.833  -2.981
  363    HE2  PHE  46           1HE      PHE  46 -11.561  12.138  -0.548
  364    HZ   PHE  46           HZ       PHE  46 -11.955  10.683  -2.496
  365    H    PHE  47           H        PHE  47  -5.449  10.500   2.534
  366    HA   PHE  47           HA       PHE  47  -6.146  13.106   3.368
  367   1HB   PHE  47          2HB       PHE  47  -4.893  10.819   4.507
  368   2HB   PHE  47          1HB       PHE  47  -3.839  12.198   4.798
  369    HD1  PHE  47           1HD      PHE  47  -7.361  11.073   5.143
  370    HD2  PHE  47           2HD      PHE  47  -4.289  13.665   6.537
  371    HE1  PHE  47           1HE      PHE  47  -8.803  11.769   7.010
  372    HE2  PHE  47           2HE      PHE  47  -5.724  14.364   8.410
  373    HZ   PHE  47           HZ       PHE  47  -7.986  13.415   8.648
  374    H    ARG  48           H        ARG  48  -3.336  11.784   1.764
  375    HA   ARG  48           HA       ARG  48  -1.633  14.011   2.109
  376   1HB   ARG  48          2HB       ARG  48  -0.839  11.749   1.496
  377   2HB   ARG  48          1HB       ARG  48  -1.592  11.931  -0.083
  378   1HG   ARG  48          2HG       ARG  48  -0.124  13.894  -0.489
  379   2HG   ARG  48          1HG       ARG  48   0.692  13.541   1.036
  380   1HD   ARG  48          2HD       ARG  48   2.070  12.354  -0.304
  381   2HD   ARG  48          1HD       ARG  48   0.821  11.123  -0.118
  382    HE   ARG  48           HE       ARG  48   0.582  12.971  -2.363
  383   1HH1  ARG  48          1HH1      ARG  48   1.410   9.765  -1.233
  384   2HH1  ARG  48          2HH1      ARG  48   1.304   9.056  -2.807
  385   1HH2  ARG  48          1HH2      ARG  48   0.447  12.029  -4.425
  386   2HH2  ARG  48          2HH2      ARG  48   0.763  10.337  -4.616
  387    H    VAL  49           H        VAL  49  -3.699  13.008  -0.627
  388    HA   VAL  49           HA       VAL  49  -3.078  15.331  -2.159
  389    HB   VAL  49           HB       VAL  49  -4.912  14.646  -3.639
  390   1HG1  VAL  49          1HG1      VAL  49  -2.557  13.520  -3.488
  391   2HG1  VAL  49          2HG1      VAL  49  -3.804  12.838  -4.533
  392   3HG1  VAL  49          3HG1      VAL  49  -3.483  12.117  -2.955
  393   1HG2  VAL  49          1HG2      VAL  49  -5.949  12.351  -3.034
  394   2HG2  VAL  49          2HG2      VAL  49  -6.610  13.816  -2.306
  395   3HG2  VAL  49          3HG2      VAL  49  -5.522  12.785  -1.378
  396    H    VAL  50           H        VAL  50  -5.982  14.374  -0.310
  397    HA   VAL  50           HA       VAL  50  -7.353  16.809  -0.754
  398    HB   VAL  50           HB       VAL  50  -7.740  14.891   1.550
  399   1HG1  VAL  50          1HG1      VAL  50  -9.723  16.778   0.292
  400   2HG1  VAL  50          2HG1      VAL  50  -8.782  17.163   1.734
  401   3HG1  VAL  50          3HG1      VAL  50  -9.926  15.820   1.760
  402   1HG2  VAL  50          1HG2      VAL  50  -8.013  14.325  -1.149
  403   2HG2  VAL  50          2HG2      VAL  50  -9.652  14.701  -0.623
  404   3HG2  VAL  50          3HG2      VAL  50  -8.735  13.432   0.188
  405    H    GLY  51           H        GLY  51  -5.522  15.588   2.049
  406   1HA   GLY  51          2HA       GLY  51  -5.800  17.886   3.642
  407   2HA   GLY  51          1HA       GLY  51  -4.533  16.680   3.806
  408    H    ARG  52           H        ARG  52  -3.776  17.283   0.907
  409    HA   ARG  52           HA       ARG  52  -1.825  19.294   1.567
  410   1HB   ARG  52          2HB       ARG  52  -1.607  17.211  -0.006
  411   2HB   ARG  52          1HB       ARG  52  -2.235  18.307  -1.225
  412   1HG   ARG  52          2HG       ARG  52  -0.110  18.878  -1.555
  413   2HG   ARG  52          1HG       ARG  52  -0.253  19.787  -0.048
  414   1HD   ARG  52          2HD       ARG  52   0.682  16.931  -0.299
  415   2HD   ARG  52          1HD       ARG  52   1.722  18.333  -0.053
  416    HE   ARG  52           HE       ARG  52  -0.310  18.073   1.950
  417   1HH1  ARG  52          1HH1      ARG  52   2.871  17.016   0.984
  418   2HH1  ARG  52          2HH1      ARG  52   3.367  16.629   2.597
  419   1HH2  ARG  52          1HH2      ARG  52   0.340  17.571   4.071
  420   2HH2  ARG  52          2HH2      ARG  52   1.931  16.946   4.352
  421    H    MET  53           H        MET  53  -4.938  19.303   0.084
  422    HA   MET  53           HA       MET  53  -4.695  22.165  -0.341
  423   1HB   MET  53          2HB       MET  53  -4.874  20.184  -2.538
  424   2HB   MET  53          1HB       MET  53  -5.883  21.614  -2.686
  425   1HG   MET  53          2HG       MET  53  -3.993  23.054  -2.606
  426   2HG   MET  53          1HG       MET  53  -2.927  21.721  -2.168
  427   1HE   MET  53          1HE       MET  53  -3.092  19.433  -3.857
  428   2HE   MET  53          2HE       MET  53  -1.590  20.357  -3.877
  429   3HE   MET  53          3HE       MET  53  -2.314  19.818  -5.392
  430    H    LEU  54           H        LEU  54  -6.227  20.606   1.502
  431    HA   LEU  54           HA       LEU  54  -8.921  20.394   0.588
  432   1HB   LEU  54          2HB       LEU  54  -8.039  19.075   2.476
  433   2HB   LEU  54          1HB       LEU  54  -7.864  20.542   3.413
  434    HG   LEU  54           HG       LEU  54 -10.576  20.116   2.383
  435   1HD1  LEU  54          1HD1      LEU  54 -10.622  18.457   4.582
  436   2HD1  LEU  54          2HD1      LEU  54  -9.177  17.942   3.713
  437   3HD1  LEU  54          3HD1      LEU  54 -10.740  17.954   2.896
  438   1HD2  LEU  54          1HD2      LEU  54 -11.032  20.560   4.853
  439   2HD2  LEU  54          2HD2      LEU  54 -10.278  21.857   3.926
  440   3HD2  LEU  54          3HD2      LEU  54  -9.298  20.856   4.998
  441    HA   PRO  55           HA       PRO  55  -9.526  24.582   2.897
  442   1HB   PRO  55          2HB       PRO  55  -7.367  25.960   3.714
  443   2HB   PRO  55          1HB       PRO  55  -8.079  24.675   4.698
  444   1HG   PRO  55          2HG       PRO  55  -5.687  24.572   2.894
  445   2HG   PRO  55          1HG       PRO  55  -5.882  23.915   4.531
  446   1HD   PRO  55          2HD       PRO  55  -6.106  22.399   2.288
  447   2HD   PRO  55          1HD       PRO  55  -6.990  22.051   3.786
  448    H    ILE  56           H        ILE  56  -6.698  24.302   0.821
  449    HA   ILE  56           HA       ILE  56  -6.990  26.939  -0.297
  450    HB   ILE  56           HB       ILE  56  -5.316  24.667  -1.363
  451   1HG1  ILE  56          2HG1      ILE  56  -3.619  26.403  -0.035
  452   2HG1  ILE  56          1HG1      ILE  56  -5.014  26.320   1.035
  453   1HG2  ILE  56          1HG2      ILE  56  -4.783  27.608  -1.631
  454   2HG2  ILE  56          2HG2      ILE  56  -5.817  26.748  -2.772
  455   3HG2  ILE  56          3HG2      ILE  56  -4.130  26.272  -2.580
  456   1HD1  ILE  56          1HD1      ILE  56  -4.819  23.886   1.093
  457   2HD1  ILE  56          2HD1      ILE  56  -3.340  24.674   1.641
  458   3HD1  ILE  56          3HD1      ILE  56  -3.422  23.975   0.023
  459    H    GLN  57           H        GLN  57  -7.762  23.639  -1.295
  460    HA   GLN  57           HA       GLN  57  -9.193  22.827  -2.859
  461   1HB   GLN  57          2HB       GLN  57 -10.083  25.682  -2.750
  462   2HB   GLN  57          1HB       GLN  57 -10.700  24.637  -4.021
  463   1HG   GLN  57          2HG       GLN  57 -11.650  23.142  -2.416
  464   2HG   GLN  57          1HG       GLN  57 -10.880  24.005  -1.086
  465   1HE2  GLN  57          1HE2      GLN  57 -13.490  23.634  -0.870
  466   2HE2  GLN  57          2HE2      GLN  57 -14.369  25.092  -1.166
  467    H    GLU  58           H        GLU  58  -6.784  22.834  -3.747
  468    HA   GLU  58           HA       GLU  58  -5.650  22.568  -5.711
  469   1HB   GLU  58          2HB       GLU  58  -8.055  22.576  -6.718
  470   2HB   GLU  58          1HB       GLU  58  -7.651  24.213  -7.218
  471   1HG   GLU  58          2HG       GLU  58  -6.612  23.409  -8.990
  472   2HG   GLU  58          1HG       GLU  58  -5.476  22.566  -7.937
  473    H    ASN  59           H        ASN  59  -3.916  23.654  -6.412
  474    HA   ASN  59           HA       ASN  59  -3.639  26.402  -5.567
  475   1HB   ASN  59          2HB       ASN  59  -1.284  26.100  -6.488
  476   2HB   ASN  59          1HB       ASN  59  -1.735  25.062  -5.141
  477   1HD2  ASN  59          1HD2      ASN  59   0.071  23.774  -5.914
  478   2HD2  ASN  59          2HD2      ASN  59  -0.197  22.632  -7.181
  479    H    GLN  60           H        GLN  60  -4.524  27.901  -6.809
  480    HA   GLN  60           HA       GLN  60  -3.691  28.079  -9.592
  481   1HB   GLN  60          2HB       GLN  60  -6.474  27.571  -8.697
  482   2HB   GLN  60          1HB       GLN  60  -6.264  28.774  -9.963
  483   1HG   GLN  60          2HG       GLN  60  -4.918  27.039 -11.210
  484   2HG   GLN  60          1HG       GLN  60  -5.498  25.872 -10.022
  485   1HE2  GLN  60          1HE2      GLN  60  -8.079  26.732  -9.659
  486   2HE2  GLN  60          2HE2      GLN  60  -8.973  26.514 -11.121
  487    H    ALA  61           H        ALA  61  -2.633  29.648  -7.788
  488    HA   ALA  61           HA       ALA  61  -4.085  31.991  -7.131
  489   1HB   ALA  61          1HB       ALA  61  -1.148  32.184  -7.336
  490   2HB   ALA  61          2HB       ALA  61  -1.775  30.942  -6.254
  491   3HB   ALA  61          3HB       ALA  61  -2.229  32.628  -6.015
  492    HA   PRO  62           HA       PRO  62  -4.196  33.914 -11.170
  493   1HB   PRO  62          2HB       PRO  62  -4.335  36.362  -9.472
  494   2HB   PRO  62          1HB       PRO  62  -5.361  35.870 -10.825
  495   1HG   PRO  62          2HG       PRO  62  -6.231  35.657  -8.321
  496   2HG   PRO  62          1HG       PRO  62  -6.602  34.406  -9.521
  497   1HD   PRO  62          2HD       PRO  62  -4.625  34.364  -7.287
  498   2HD   PRO  62          1HD       PRO  62  -5.618  33.046  -7.943
  499    H    ALA  63           H        ALA  63  -2.013  33.492 -11.724
  500    HA   ALA  63           HA       ALA  63   0.183  34.911 -10.671
  501   1HB   ALA  63          1HB       ALA  63  -0.011  32.742 -12.205
  502   2HB   ALA  63          2HB       ALA  63   1.458  33.716 -12.121
  503   3HB   ALA  63          3HB       ALA  63   0.332  33.931 -13.462
  504    HA   PRO  64           HA       PRO  64  -0.660  38.965 -12.388
  505   1HB   PRO  64          2HB       PRO  64   2.046  39.725 -12.306
  506   2HB   PRO  64          1HB       PRO  64   0.833  40.018 -11.058
  507   1HG   PRO  64          2HG       PRO  64   2.878  37.860 -11.245
  508   2HG   PRO  64          1HG       PRO  64   2.260  38.704  -9.817
  509   1HD   PRO  64          2HD       PRO  64   1.486  36.216 -10.374
  510   2HD   PRO  64          1HD       PRO  64   0.329  37.404  -9.732
  511    H    ASN  65           H        ASN  65   2.522  37.709 -13.425
  512    HA   ASN  65           HA       ASN  65   2.086  38.743 -16.083
  513   1HB   ASN  65          2HB       ASN  65   4.321  38.423 -14.599
  514   2HB   ASN  65          1HB       ASN  65   4.396  36.964 -15.583
  515   1HD2  ASN  65          1HD2      ASN  65   5.448  40.015 -15.412
  516   2HD2  ASN  65          2HD2      ASN  65   5.663  40.367 -17.090
  517    H    ILE  66           H        ILE  66   0.691  37.655 -17.308
  518    HA   ILE  66           HA       ILE  66   1.374  35.119 -18.339
  519    HB   ILE  66           HB       ILE  66   0.443  34.324 -16.201
  520   1HG1  ILE  66          2HG1      ILE  66  -1.195  32.723 -17.176
  521   2HG1  ILE  66          1HG1      ILE  66  -1.218  33.687 -18.648
  522   1HG2  ILE  66          1HG2      ILE  66  -1.549  36.278 -16.711
  523   2HG2  ILE  66          2HG2      ILE  66  -1.352  35.249 -15.296
  524   3HG2  ILE  66          3HG2      ILE  66  -2.332  34.701 -16.652
  525   1HD1  ILE  66          1HD1      ILE  66   0.222  31.652 -18.725
  526   2HD1  ILE  66          2HD1      ILE  66   1.269  32.422 -17.535
  527   3HD1  ILE  66          3HD1      ILE  66   1.047  33.159 -19.121
  528    H    THR  67           H        THR  67  -1.031  37.629 -17.900
  529    HA   THR  67           HA       THR  67  -1.478  37.973 -20.642
  530    HB   THR  67           HB       THR  67  -4.099  37.185 -19.962
  531    HG1  THR  67           1HG      THR  67  -3.173  34.787 -19.744
  532   1HG2  THR  67          1HG2      THR  67  -4.033  35.965 -21.877
  533   2HG2  THR  67          2HG2      THR  67  -2.400  35.371 -21.578
  534   3HG2  THR  67          3HG2      THR  67  -2.647  37.019 -22.155
  535    H    GLY  68           H        GLY  68  -4.027  39.023 -20.697
  536   1HA   GLY  68          2HA       GLY  68  -3.642  41.509 -19.388
  537   2HA   GLY  68          1HA       GLY  68  -5.093  41.008 -20.243
  538    H    ALA  69           H        ALA  69  -3.378  40.337 -17.181
  539    HA   ALA  69           HA       ALA  69  -5.660  39.428 -15.797
  540   1HB   ALA  69          1HB       ALA  69  -3.437  40.752 -14.325
  541   2HB   ALA  69          2HB       ALA  69  -3.096  39.283 -15.238
  542   3HB   ALA  69          3HB       ALA  69  -4.308  39.264 -13.956
  543    H    LEU  70           H        LEU  70  -3.906  42.466 -15.163
  544    HA   LEU  70           HA       LEU  70  -4.670  44.604 -14.874
  545   1HB   LEU  70          2HB       LEU  70  -6.616  43.762 -16.415
  546   2HB   LEU  70          1HB       LEU  70  -7.533  43.742 -14.924
  547    HG   LEU  70           HG       LEU  70  -6.126  46.253 -15.228
  548   1HD1  LEU  70          1HD1      LEU  70  -6.398  45.644 -17.640
  549   2HD1  LEU  70          2HD1      LEU  70  -7.218  47.127 -17.152
  550   3HD1  LEU  70          3HD1      LEU  70  -8.143  45.641 -17.379
  551   1HD2  LEU  70          1HD2      LEU  70  -8.454  45.293 -14.079
  552   2HD2  LEU  70          2HD2      LEU  70  -9.020  46.321 -15.395
  553   3HD2  LEU  70          3HD2      LEU  70  -7.942  46.978 -14.165
  554    H    GLU  71           H        GLU  71  -7.277  42.690 -13.396
  555    HA   GLU  71           HA       GLU  71  -8.225  43.026 -11.305
  556   1HB   GLU  71          2HB       GLU  71  -6.518  42.020  -9.591
  557   2HB   GLU  71          1HB       GLU  71  -7.192  41.020 -10.869
  558   1HG   GLU  71          2HG       GLU  71  -5.110  41.571 -12.206
  559   2HG   GLU  71          1HG       GLU  71  -4.448  42.233 -10.716
  560    H    HIS  72           H        HIS  72  -5.063  43.549  -9.920
  561    HA   HIS  72           HA       HIS  72  -5.543  46.391  -9.544
  562   1HB   HIS  72          2HB       HIS  72  -5.023  46.073  -7.056
  563   2HB   HIS  72          1HB       HIS  72  -6.631  45.605  -7.599
  564    HD1  HIS  72           1HD      HIS  72  -3.512  44.253  -6.126
  565    HD2  HIS  72           2HD      HIS  72  -7.095  42.795  -7.642
  566    HE1  HIS  72           1HE      HIS  72  -3.628  41.854  -5.383
  567    HE2  HIS  72           2HE      HIS  72  -5.844  41.015  -6.241
  568    H    HIS  73           H        HIS  73  -3.445  43.609  -9.452
  569    HA   HIS  73           HA       HIS  73  -1.204  43.385  -9.720
  570   1HB   HIS  73          2HB       HIS  73  -1.782  45.669 -11.129
  571   2HB   HIS  73          1HB       HIS  73  -0.547  46.231 -10.008
  572    HD1  HIS  73           1HD      HIS  73  -1.065  44.039 -12.973
  573    HD2  HIS  73           2HD      HIS  73   2.012  45.109 -10.392
  574    HE1  HIS  73           1HE      HIS  73   1.047  43.218 -14.067
  575    HE2  HIS  73           2HE      HIS  73   2.899  43.902 -12.500
  576    H    HIS  74           H        HIS  74   0.829  43.767  -8.619
  577    HA   HIS  74           HA       HIS  74   0.435  44.240  -5.839
  578   1HB   HIS  74          2HB       HIS  74   2.988  43.826  -7.407
  579   2HB   HIS  74          1HB       HIS  74   2.861  43.795  -5.651
  580    HD1  HIS  74           1HD      HIS  74   2.813  41.618  -8.507
  581    HD2  HIS  74           2HD      HIS  74   0.990  41.634  -4.773
  582    HE1  HIS  74           1HE      HIS  74   2.053  39.254  -8.114
  583    HE2  HIS  74           2HE      HIS  74   0.851  39.315  -5.906
  584    H    HIS  75           H        HIS  75   1.446  46.197  -8.498
  585    HA   HIS  75           HA       HIS  75   1.901  48.413  -8.675
  586   1HB   HIS  75          2HB       HIS  75   0.004  48.574  -7.010
  587   2HB   HIS  75          1HB       HIS  75   1.222  48.660  -5.743
  588    HD1  HIS  75           1HD      HIS  75   0.809  50.487  -9.064
  589    HD2  HIS  75           2HD      HIS  75   1.510  51.241  -5.039
  590    HE1  HIS  75           1HE      HIS  75   1.068  52.981  -8.884
  591    HE2  HIS  75           2HE      HIS  75   1.581  53.405  -6.453
  592    H    HIS  76           H        HIS  76   2.899  47.870  -5.292
  593    HA   HIS  76           HA       HIS  76   4.908  48.075  -4.249
  594   1HB   HIS  76          2HB       HIS  76   5.720  47.205  -6.993
  595   2HB   HIS  76          1HB       HIS  76   6.965  47.739  -5.867
  596    HD1  HIS  76           1HD      HIS  76   6.391  44.754  -6.992
  597    HD2  HIS  76           2HD      HIS  76   5.578  46.241  -3.197
  598    HE1  HIS  76           1HE      HIS  76   6.307  42.742  -5.485
  599    HE2  HIS  76           2HE      HIS  76   5.777  43.662  -3.199
  600    H    HIS  77           H        HIS  77   4.898  50.173  -3.612
  601    HA   HIS  77           HA       HIS  77   5.555  52.343  -3.477
  602   1HB   HIS  77          2HB       HIS  77   7.662  51.053  -4.692
  603   2HB   HIS  77          1HB       HIS  77   7.327  52.370  -5.811
  604    HD1  HIS  77           1HD      HIS  77   7.031  52.600  -2.049
  605    HD2  HIS  77           2HD      HIS  77   9.425  54.008  -5.141
  606    HE1  HIS  77           1HE      HIS  77   8.552  54.306  -0.999
  607    HE2  HIS  77           2HE      HIS  77   9.932  55.206  -2.904
  Start of MODEL    7
    1   1H    ALA   1          1HT       ALA   1   0.068 -52.994   5.544
    2   2H    ALA   1          2HT       ALA   1   0.618 -54.619   5.554
    3   3H    ALA   1          3HT       ALA   1   0.806 -53.640   6.952
    4    HA   ALA   1           HA       ALA   1  -1.772 -54.408   5.764
    5   1HB   ALA   1          1HB       ALA   1  -0.728 -55.505   8.334
    6   2HB   ALA   1          2HB       ALA   1  -0.224 -56.231   6.808
    7   3HB   ALA   1          3HB       ALA   1  -1.934 -56.172   7.233
    8    H    ASP   2           H        ASP   2  -0.462 -51.854   6.954
    9    HA   ASP   2           HA       ASP   2  -1.656 -51.379   9.458
   10   1HB   ASP   2          2HB       ASP   2   0.071 -50.002   7.780
   11   2HB   ASP   2          1HB       ASP   2  -1.367 -48.987   7.810
   12    H    LYS   3           H        LYS   3  -3.819 -51.933   9.507
   13    HA   LYS   3           HA       LYS   3  -5.729 -51.278   7.565
   14   1HB   LYS   3          2HB       LYS   3  -7.405 -51.690   9.329
   15   2HB   LYS   3          1HB       LYS   3  -6.179 -52.948   9.270
   16   1HG   LYS   3          2HG       LYS   3  -5.522 -52.554  11.358
   17   2HG   LYS   3          1HG       LYS   3  -5.494 -50.808  11.113
   18   1HD   LYS   3          2HD       LYS   3  -7.395 -50.593  12.249
   19   2HD   LYS   3          1HD       LYS   3  -8.211 -51.695  11.138
   20   1HE   LYS   3          2HE       LYS   3  -8.448 -52.994  12.954
   21   2HE   LYS   3          1HE       LYS   3  -6.771 -53.434  12.640
   22   1HZ   LYS   3          1HZ       LYS   3  -7.434 -51.111  14.337
   23   2HZ   LYS   3          2HZ       LYS   3  -6.007 -52.019  14.292
   24   3HZ   LYS   3          3HZ       LYS   3  -7.404 -52.677  14.981
   25    H    THR   4           H        THR   4  -6.399 -49.344   6.924
   26    HA   THR   4           HA       THR   4  -6.892 -47.122   6.894
   27    HB   THR   4           HB       THR   4  -7.463 -47.131   9.824
   28    HG1  THR   4           1HG      THR   4  -9.440 -48.252   9.342
   29   1HG2  THR   4          1HG2      THR   4  -8.370 -45.687   7.496
   30   2HG2  THR   4          2HG2      THR   4  -8.558 -45.308   9.207
   31   3HG2  THR   4          3HG2      THR   4  -9.715 -46.372   8.407
   32    H    ILE   5           H        ILE   5  -4.192 -47.861   7.363
   33    HA   ILE   5           HA       ILE   5  -2.195 -47.167   8.269
   34    HB   ILE   5           HB       ILE   5  -2.694 -45.638   6.373
   35   1HG1  ILE   5          2HG1      ILE   5  -0.999 -43.936   6.963
   36   2HG1  ILE   5          1HG1      ILE   5  -1.119 -44.408   8.651
   37   1HG2  ILE   5          1HG2      ILE   5  -3.564 -43.479   6.666
   38   2HG2  ILE   5          2HG2      ILE   5  -3.411 -43.568   8.420
   39   3HG2  ILE   5          3HG2      ILE   5  -4.629 -44.533   7.593
   40   1HD1  ILE   5          1HD1      ILE   5   0.730 -45.573   8.027
   41   2HD1  ILE   5          2HD1      ILE   5   0.166 -45.803   6.373
   42   3HD1  ILE   5          3HD1      ILE   5  -0.510 -46.777   7.678
   43    H    PHE   6           H        PHE   6  -4.146 -47.465  10.332
   44    HA   PHE   6           HA       PHE   6  -4.590 -46.909  12.496
   45   1HB   PHE   6          2HB       PHE   6  -1.732 -46.731  12.052
   46   2HB   PHE   6          1HB       PHE   6  -2.239 -45.667  13.359
   47    HD1  PHE   6           2HD      PHE   6  -3.278 -49.093  12.268
   48    HD2  PHE   6           1HD      PHE   6  -1.811 -46.601  15.391
   49    HE1  PHE   6           2HE      PHE   6  -3.327 -51.007  13.815
   50    HE2  PHE   6           1HE      PHE   6  -1.856 -48.510  16.942
   51    HZ   PHE   6           HZ       PHE   6  -2.615 -50.717  16.156
   52    H    ASN   7           H        ASN   7  -5.044 -44.759  10.414
   53    HA   ASN   7           HA       ASN   7  -4.486 -42.271  11.712
   54   1HB   ASN   7          2HB       ASN   7  -5.565 -43.144   9.185
   55   2HB   ASN   7          1HB       ASN   7  -6.585 -41.885   9.876
   56   1HD2  ASN   7          1HD2      ASN   7  -5.970 -39.846   9.661
   57   2HD2  ASN   7          2HD2      ASN   7  -4.416 -39.318   9.122
   58    H    ASP   8           H        ASP   8  -7.347 -44.322  11.356
   59    HA   ASP   8           HA       ASP   8  -9.214 -44.533  12.636
   60   1HB   ASP   8          2HB       ASP   8  -7.774 -42.605  14.461
   61   2HB   ASP   8          1HB       ASP   8  -9.329 -43.334  14.839
   62    H    HIS   9           H        HIS   9 -10.602 -43.722  11.150
   63    HA   HIS   9           HA       HIS   9 -12.369 -42.410  10.556
   64   1HB   HIS   9          2HB       HIS   9 -11.388 -40.900  12.872
   65   2HB   HIS   9          1HB       HIS   9 -12.134 -39.893  11.641
   66    HD1  HIS   9           1HD      HIS   9 -14.654 -40.066  11.353
   67    HD2  HIS   9           2HD      HIS   9 -13.117 -42.768  14.109
   68    HE1  HIS   9           1HE      HIS   9 -16.654 -41.026  12.536
   69    HE2  HIS   9           2HE      HIS   9 -15.694 -42.594  14.261
   70    H    LEU  10           H        LEU  10  -9.113 -41.133  10.547
   71    HA   LEU  10           HA       LEU  10  -7.941 -39.962   8.991
   72   1HB   LEU  10          2HB       LEU  10  -9.742 -41.625   7.554
   73   2HB   LEU  10          1HB       LEU  10  -9.706 -40.074   6.737
   74    HG   LEU  10           HG       LEU  10  -7.239 -41.683   7.397
   75   1HD1  LEU  10          1HD1      LEU  10  -7.637 -42.961   5.634
   76   2HD1  LEU  10          2HD1      LEU  10  -7.741 -41.532   4.606
   77   3HD1  LEU  10          3HD1      LEU  10  -9.189 -42.158   5.394
   78   1HD2  LEU  10          1HD2      LEU  10  -7.725 -39.021   6.317
   79   2HD2  LEU  10          2HD2      LEU  10  -6.687 -40.012   5.293
   80   3HD2  LEU  10          3HD2      LEU  10  -6.252 -39.727   6.977
   81    H    ASN  11           H        ASN  11  -7.932 -37.839   9.539
   82    HA   ASN  11           HA       ASN  11 -10.325 -36.261   8.891
   83   1HB   ASN  11          2HB       ASN  11  -9.198 -34.540  10.453
   84   2HB   ASN  11          1HB       ASN  11  -9.929 -35.969  11.177
   85   1HD2  ASN  11          1HD2      ASN  11  -7.359 -34.015  11.327
   86   2HD2  ASN  11          2HD2      ASN  11  -6.167 -35.101  11.952
   87    H    THR  12           H        THR  12  -7.224 -34.739   9.432
   88    HA   THR  12           HA       THR  12  -7.386 -33.497   6.832
   89    HB   THR  12           HB       THR  12  -6.872 -32.146   8.820
   90    HG1  THR  12           1HG      THR  12  -5.616 -30.938   7.654
   91   1HG2  THR  12          1HG2      THR  12  -5.121 -32.433  10.222
   92   2HG2  THR  12          2HG2      THR  12  -4.115 -33.202   8.993
   93   3HG2  THR  12          3HG2      THR  12  -5.396 -34.119   9.786
   94    H    ASN  13           H        ASN  13  -6.475 -34.398   5.110
   95    HA   ASN  13           HA       ASN  13  -3.757 -35.188   5.101
   96   1HB   ASN  13          2HB       ASN  13  -4.766 -37.200   6.164
   97   2HB   ASN  13          1HB       ASN  13  -5.708 -37.453   4.703
   98   1HD2  ASN  13          1HD2      ASN  13  -2.694 -37.835   6.231
   99   2HD2  ASN  13          2HD2      ASN  13  -1.867 -38.606   4.927
  100    HA   PRO  14           HA       PRO  14  -5.724 -35.990   0.654
  101   1HB   PRO  14          2HB       PRO  14  -8.383 -34.764   1.198
  102   2HB   PRO  14          1HB       PRO  14  -7.967 -36.123   0.149
  103   1HG   PRO  14          2HG       PRO  14  -9.150 -36.549   2.485
  104   2HG   PRO  14          1HG       PRO  14  -7.855 -37.623   1.920
  105   1HD   PRO  14          2HD       PRO  14  -7.757 -35.453   3.978
  106   2HD   PRO  14          1HD       PRO  14  -6.964 -37.038   3.967
  107    H    LYS  15           H        LYS  15  -6.153 -33.335   2.819
  108    HA   LYS  15           HA       LYS  15  -5.726 -31.458   0.614
  109   1HB   LYS  15          2HB       LYS  15  -6.821 -29.768   2.046
  110   2HB   LYS  15          1HB       LYS  15  -7.884 -31.094   1.620
  111   1HG   LYS  15          2HG       LYS  15  -6.476 -31.439   4.171
  112   2HG   LYS  15          1HG       LYS  15  -7.597 -30.085   4.120
  113   1HD   LYS  15          2HD       LYS  15  -9.318 -31.689   3.223
  114   2HD   LYS  15          1HD       LYS  15  -8.181 -32.990   3.580
  115   1HE   LYS  15          2HE       LYS  15  -9.013 -33.047   5.641
  116   2HE   LYS  15          1HE       LYS  15  -8.286 -31.465   5.912
  117   1HZ   LYS  15          1HZ       LYS  15 -10.411 -30.919   6.359
  118   2HZ   LYS  15          2HZ       LYS  15 -11.065 -32.170   5.427
  119   3HZ   LYS  15          3HZ       LYS  15 -10.523 -30.754   4.680
  120    H    THR  16           H        THR  16  -5.043 -31.996   4.068
  121    HA   THR  16           HA       THR  16  -3.460 -30.944   5.410
  122    HB   THR  16           HB       THR  16  -1.828 -32.493   3.396
  123    HG1  THR  16           1HG      THR  16  -2.455 -33.668   5.783
  124   1HG2  THR  16          1HG2      THR  16  -0.137 -31.631   4.625
  125   2HG2  THR  16          2HG2      THR  16  -0.584 -32.960   5.696
  126   3HG2  THR  16          3HG2      THR  16  -1.161 -31.326   6.029
  127    H    ASN  17           H        ASN  17  -1.166 -30.930   2.786
  128    HA   ASN  17           HA       ASN  17  -0.336 -28.292   3.324
  129   1HB   ASN  17          2HB       ASN  17   0.344 -30.371   1.307
  130   2HB   ASN  17          1HB       ASN  17   0.813 -28.712   0.951
  131   1HD2  ASN  17          1HD2      ASN  17   3.000 -29.122   1.131
  132   2HD2  ASN  17          2HD2      ASN  17   3.767 -29.452   2.644
  133    H    LEU  18           H        LEU  18  -2.429 -29.653   0.820
  134    HA   LEU  18           HA       LEU  18  -2.589 -27.347  -0.789
  135   1HB   LEU  18          2HB       LEU  18  -3.491 -29.870  -1.041
  136   2HB   LEU  18          1HB       LEU  18  -4.985 -29.072  -0.585
  137    HG   LEU  18           HG       LEU  18  -3.253 -28.285  -2.930
  138   1HD1  LEU  18          1HD1      LEU  18  -5.672 -30.024  -2.685
  139   2HD1  LEU  18          2HD1      LEU  18  -4.201 -30.276  -3.623
  140   3HD1  LEU  18          3HD1      LEU  18  -5.392 -29.091  -4.155
  141   1HD2  LEU  18          1HD2      LEU  18  -6.029 -27.365  -2.216
  142   2HD2  LEU  18          2HD2      LEU  18  -4.993 -26.766  -3.514
  143   3HD2  LEU  18          3HD2      LEU  18  -4.564 -26.462  -1.829
  144    H    ARG  19           H        ARG  19  -4.861 -28.553   1.682
  145    HA   ARG  19           HA       ARG  19  -6.604 -26.366   1.602
  146   1HB   ARG  19          2HB       ARG  19  -7.052 -28.553   2.721
  147   2HB   ARG  19          1HB       ARG  19  -5.982 -28.065   4.020
  148   1HG   ARG  19          2HG       ARG  19  -7.965 -27.469   4.931
  149   2HG   ARG  19          1HG       ARG  19  -7.602 -25.978   4.063
  150   1HD   ARG  19          2HD       ARG  19  -9.033 -26.634   2.240
  151   2HD   ARG  19          1HD       ARG  19  -9.291 -28.222   2.962
  152    HE   ARG  19           HE       ARG  19 -10.930 -27.293   4.241
  153   1HH1  ARG  19          1HH1      ARG  19  -8.745 -24.756   3.259
  154   2HH1  ARG  19          2HH1      ARG  19  -9.695 -23.491   3.962
  155   1HH2  ARG  19          1HH2      ARG  19 -12.182 -25.627   5.174
  156   2HH2  ARG  19          2HH2      ARG  19 -11.648 -23.984   5.042
  157    H    LEU  20           H        LEU  20  -3.800 -26.979   3.686
  158    HA   LEU  20           HA       LEU  20  -4.041 -24.646   5.235
  159   1HB   LEU  20          2HB       LEU  20  -2.582 -26.794   5.533
  160   2HB   LEU  20          1HB       LEU  20  -1.384 -25.880   4.637
  161    HG   LEU  20           HG       LEU  20  -1.791 -24.048   6.415
  162   1HD1  LEU  20          1HD1      LEU  20  -2.807 -26.456   7.900
  163   2HD1  LEU  20          2HD1      LEU  20  -3.775 -25.069   7.401
  164   3HD1  LEU  20          3HD1      LEU  20  -2.487 -24.865   8.590
  165   1HD2  LEU  20          1HD2      LEU  20   0.020 -26.172   6.204
  166   2HD2  LEU  20          2HD2      LEU  20  -0.428 -26.078   7.905
  167   3HD2  LEU  20          3HD2      LEU  20   0.229 -24.663   7.087
  168    H    TRP  21           H        TRP  21  -2.279 -25.293   2.234
  169    HA   TRP  21           HA       TRP  21  -0.898 -22.846   2.075
  170   1HB   TRP  21          2HB       TRP  21  -1.307 -25.148   0.405
  171   2HB   TRP  21          1HB       TRP  21  -1.497 -23.693  -0.562
  172    HD1  TRP  21           HD       TRP  21   0.731 -23.702  -1.874
  173    HE1  TRP  21           1HE      TRP  21   3.218 -23.594  -1.222
  174    HE3  TRP  21           3HE      TRP  21   0.266 -24.324   3.176
  175    HZ2  TRP  21           2HZ      TRP  21   4.779 -23.750   1.133
  176    HZ3  TRP  21           3HZ      TRP  21   2.301 -24.332   4.558
  177    HH2  TRP  21           HH       TRP  21   4.510 -24.051   3.557
  178    H    VAL  22           H        VAL  22  -3.961 -23.867   0.570
  179    HA   VAL  22           HA       VAL  22  -4.539 -21.433  -0.689
  180    HB   VAL  22           HB       VAL  22  -6.557 -23.423   0.360
  181   1HG1  VAL  22          1HG1      VAL  22  -8.084 -22.527  -1.194
  182   2HG1  VAL  22          2HG1      VAL  22  -6.828 -21.613  -2.026
  183   3HG1  VAL  22          3HG1      VAL  22  -7.347 -21.131  -0.411
  184   1HG2  VAL  22          1HG2      VAL  22  -6.361 -24.025  -2.240
  185   2HG2  VAL  22          2HG2      VAL  22  -5.400 -24.818  -0.997
  186   3HG2  VAL  22          3HG2      VAL  22  -4.703 -23.503  -1.943
  187    H    ALA  23           H        ALA  23  -5.676 -22.671   2.460
  188    HA   ALA  23           HA       ALA  23  -7.244 -20.466   3.147
  189   1HB   ALA  23          1HB       ALA  23  -7.621 -21.579   5.052
  190   2HB   ALA  23          2HB       ALA  23  -5.902 -21.765   5.401
  191   3HB   ALA  23          3HB       ALA  23  -6.703 -22.874   4.287
  192    H    PHE  24           H        PHE  24  -3.880 -21.168   4.126
  193    HA   PHE  24           HA       PHE  24  -3.511 -18.779   5.560
  194   1HB   PHE  24          2HB       PHE  24  -1.712 -20.879   4.469
  195   2HB   PHE  24          1HB       PHE  24  -0.985 -19.336   4.898
  196    HD1  PHE  24           1HD      PHE  24  -1.953 -18.427   7.274
  197    HD2  PHE  24           2HD      PHE  24  -1.589 -22.485   6.077
  198    HE1  PHE  24           1HE      PHE  24  -1.862 -19.109   9.636
  199    HE2  PHE  24           2HE      PHE  24  -1.502 -23.183   8.438
  200    HZ   PHE  24           HZ       PHE  24  -1.638 -21.490  10.223
  201    H    GLN  25           H        GLN  25  -2.538 -19.619   2.239
  202    HA   GLN  25           HA       GLN  25  -1.335 -17.167   1.640
  203   1HB   GLN  25          2HB       GLN  25  -1.331 -19.431   0.355
  204   2HB   GLN  25          1HB       GLN  25  -2.749 -18.775  -0.454
  205   1HG   GLN  25          2HG       GLN  25  -1.349 -16.761  -1.021
  206   2HG   GLN  25          1HG       GLN  25   0.043 -17.674  -0.442
  207   1HE2  GLN  25          1HE2      GLN  25   1.042 -17.721  -2.424
  208   2HE2  GLN  25          2HE2      GLN  25   0.459 -18.667  -3.748
  209    H    MET  26           H        MET  26  -4.681 -18.252   1.132
  210    HA   MET  26           HA       MET  26  -5.530 -15.902  -0.192
  211   1HB   MET  26          2HB       MET  26  -6.655 -18.277   0.079
  212   2HB   MET  26          1HB       MET  26  -7.432 -17.505   1.451
  213   1HG   MET  26          2HG       MET  26  -7.485 -16.288  -1.288
  214   2HG   MET  26          1HG       MET  26  -8.669 -17.485  -0.765
  215   1HE   MET  26          1HE       MET  26  -9.867 -17.273   1.545
  216   2HE   MET  26          2HE       MET  26 -10.272 -15.745   2.326
  217   3HE   MET  26          3HE       MET  26  -8.658 -16.430   2.511
  218    H    MET  27           H        MET  27  -6.020 -16.950   3.192
  219    HA   MET  27           HA       MET  27  -7.226 -14.525   3.989
  220   1HB   MET  27          2HB       MET  27  -7.079 -16.950   5.100
  221   2HB   MET  27          1HB       MET  27  -5.794 -16.164   6.008
  222   1HG   MET  27          2HG       MET  27  -7.762 -15.945   7.278
  223   2HG   MET  27          1HG       MET  27  -7.439 -14.359   6.578
  224   1HE   MET  27          1HE       MET  27 -10.540 -17.133   6.727
  225   2HE   MET  27          2HE       MET  27 -11.279 -15.568   7.062
  226   3HE   MET  27          3HE       MET  27  -9.791 -16.033   7.886
  227    H    LYS  28           H        LYS  28  -4.034 -15.786   4.959
  228    HA   LYS  28           HA       LYS  28  -3.150 -13.334   6.025
  229   1HB   LYS  28          2HB       LYS  28  -2.285 -15.817   6.307
  230   2HB   LYS  28          1HB       LYS  28  -1.175 -15.332   5.030
  231   1HG   LYS  28          2HG       LYS  28  -0.081 -13.824   6.362
  232   2HG   LYS  28          1HG       LYS  28  -1.479 -13.573   7.412
  233   1HD   LYS  28          2HD       LYS  28  -1.151 -15.931   8.229
  234   2HD   LYS  28          1HD       LYS  28   0.375 -15.945   7.344
  235   1HE   LYS  28          2HE       LYS  28  -0.140 -13.682   9.194
  236   2HE   LYS  28          1HE       LYS  28   0.233 -15.254   9.900
  237   1HZ   LYS  28          1HZ       LYS  28   2.121 -15.065   8.025
  238   2HZ   LYS  28          2HZ       LYS  28   2.337 -14.568   9.627
  239   3HZ   LYS  28          3HZ       LYS  28   1.942 -13.432   8.436
  240    H    GLY  29           H        GLY  29  -2.581 -14.845   2.857
  241   1HA   GLY  29          2HA       GLY  29  -0.711 -12.973   1.914
  242   2HA   GLY  29          1HA       GLY  29  -1.748 -13.965   0.900
  243    H    ALA  30           H        ALA  30  -4.117 -13.156   0.860
  244    HA   ALA  30           HA       ALA  30  -4.118 -10.577  -0.264
  245   1HB   ALA  30          1HB       ALA  30  -6.106 -12.660   0.283
  246   2HB   ALA  30          2HB       ALA  30  -5.883 -11.647  -1.144
  247   3HB   ALA  30          3HB       ALA  30  -6.752 -11.019   0.256
  248    H    GLY  31           H        GLY  31  -4.920 -11.743   2.956
  249   1HA   GLY  31          2HA       GLY  31  -6.208  -9.453   3.939
  250   2HA   GLY  31          1HA       GLY  31  -5.360 -10.637   4.917
  251    H    TRP  32           H        TRP  32  -2.855 -10.416   4.697
  252    HA   TRP  32           HA       TRP  32  -2.154  -7.933   5.789
  253   1HB   TRP  32          2HB       TRP  32  -0.901 -10.032   6.184
  254   2HB   TRP  32          1HB       TRP  32  -0.314  -9.969   4.525
  255    HD1  TRP  32           HD       TRP  32   0.418  -8.703   7.967
  256    HE1  TRP  32           1HE      TRP  32   2.461  -7.140   7.919
  257    HE3  TRP  32           3HE      TRP  32   0.884  -8.110   2.909
  258    HZ2  TRP  32           2HZ      TRP  32   4.051  -5.821   5.996
  259    HZ3  TRP  32           3HZ      TRP  32   2.684  -6.675   2.047
  260    HH2  TRP  32           HH       TRP  32   4.237  -5.556   3.560
  261    H    ALA  33           H        ALA  33  -1.347  -9.283   2.589
  262    HA   ALA  33           HA       ALA  33  -0.002  -7.075   1.576
  263   1HB   ALA  33          1HB       ALA  33  -0.521  -9.518   0.616
  264   2HB   ALA  33          2HB       ALA  33   0.042  -8.185  -0.394
  265   3HB   ALA  33          3HB       ALA  33  -1.676  -8.584  -0.334
  266    H    GLY  34           H        GLY  34  -3.315  -7.947   0.577
  267   1HA   GLY  34          2HA       GLY  34  -3.903  -5.446  -0.523
  268   2HA   GLY  34          1HA       GLY  34  -5.096  -6.626  -0.006
  269    H    GLY  35           H        GLY  35  -4.412  -6.677   2.744
  270   1HA   GLY  35          2HA       GLY  35  -6.011  -4.577   3.691
  271   2HA   GLY  35          1HA       GLY  35  -5.008  -5.619   4.686
  272    H    VAL  36           H        VAL  36  -2.587  -5.053   4.536
  273    HA   VAL  36           HA       VAL  36  -2.241  -2.469   5.573
  274    HB   VAL  36           HB       VAL  36  -0.056  -4.249   4.489
  275   1HG1  VAL  36          1HG1      VAL  36  -0.142  -1.838   6.230
  276   2HG1  VAL  36          2HG1      VAL  36   1.047  -2.316   5.017
  277   3HG1  VAL  36          3HG1      VAL  36   1.045  -3.088   6.602
  278   1HG2  VAL  36          1HG2      VAL  36  -0.192  -4.585   7.243
  279   2HG2  VAL  36          2HG2      VAL  36  -0.695  -5.745   6.014
  280   3HG2  VAL  36          3HG2      VAL  36  -1.873  -4.636   6.713
  281    H    PHE  37           H        PHE  37  -1.285  -3.783   2.386
  282    HA   PHE  37           HA       PHE  37  -0.012  -1.481   1.450
  283   1HB   PHE  37          2HB       PHE  37  -0.782  -3.999   0.372
  284   2HB   PHE  37          1HB       PHE  37  -1.286  -2.754  -0.760
  285    HD1  PHE  37           1HD      PHE  37   1.689  -2.982   1.476
  286    HD2  PHE  37           2HD      PHE  37   0.209  -2.787  -2.509
  287    HE1  PHE  37           1HE      PHE  37   3.996  -2.842   0.630
  288    HE2  PHE  37           2HE      PHE  37   2.512  -2.647  -3.362
  289    HZ   PHE  37           HZ       PHE  37   4.409  -2.674  -1.792
  290    H    PHE  38           H        PHE  38  -3.386  -2.514   0.811
  291    HA   PHE  38           HA       PHE  38  -4.079  -0.144  -0.567
  292   1HB   PHE  38          2HB       PHE  38  -5.576  -2.429   0.595
  293   2HB   PHE  38          1HB       PHE  38  -6.483  -0.958   0.296
  294    HD1  PHE  38           1HD      PHE  38  -6.669  -0.065  -1.992
  295    HD2  PHE  38           2HD      PHE  38  -4.846  -3.823  -1.185
  296    HE1  PHE  38           1HE      PHE  38  -6.901  -0.682  -4.362
  297    HE2  PHE  38           2HE      PHE  38  -5.074  -4.447  -3.554
  298    HZ   PHE  38           HZ       PHE  38  -6.103  -2.875  -5.146
  299    H    GLY  39           H        GLY  39  -4.317  -1.091   2.831
  300   1HA   GLY  39          2HA       GLY  39  -5.861   1.067   3.734
  301   2HA   GLY  39          1HA       GLY  39  -4.719   0.160   4.717
  302    H    THR  40           H        THR  40  -2.319   0.723   4.014
  303    HA   THR  40           HA       THR  40  -1.827   3.332   4.850
  304    HB   THR  40           HB       THR  40   0.107   1.792   3.134
  305    HG1  THR  40           1HG      THR  40   0.702   0.719   5.093
  306   1HG2  THR  40          1HG2      THR  40   0.893   3.081   5.669
  307   2HG2  THR  40          2HG2      THR  40   0.487   4.145   4.322
  308   3HG2  THR  40          3HG2      THR  40   1.764   2.942   4.142
  309    H    LEU  41           H        LEU  41  -1.587   1.987   1.553
  310    HA   LEU  41           HA       LEU  41  -0.869   4.289   0.206
  311   1HB   LEU  41          2HB       LEU  41  -1.112   1.905  -0.682
  312   2HB   LEU  41          1HB       LEU  41  -2.807   2.281  -0.916
  313    HG   LEU  41           HG       LEU  41  -2.220   4.067  -2.481
  314   1HD1  LEU  41          1HD1      LEU  41   0.306   3.905  -1.259
  315   2HD1  LEU  41          2HD1      LEU  41  -0.205   4.979  -2.560
  316   3HD1  LEU  41          3HD1      LEU  41   0.530   3.421  -2.940
  317   1HD2  LEU  41          1HD2      LEU  41  -0.592   1.994  -3.691
  318   2HD2  LEU  41          2HD2      LEU  41  -2.185   2.594  -4.153
  319   3HD2  LEU  41          3HD2      LEU  41  -2.037   1.338  -2.922
  320    H    LEU  42           H        LEU  42  -4.192   3.092   0.724
  321    HA   LEU  42           HA       LEU  42  -5.483   5.288  -0.462
  322   1HB   LEU  42          2HB       LEU  42  -6.293   2.893   0.623
  323   2HB   LEU  42          1HB       LEU  42  -6.949   4.059   1.755
  324    HG   LEU  42           HG       LEU  42  -7.915   5.231  -0.329
  325   1HD1  LEU  42          1HD1      LEU  42  -6.494   3.769  -1.855
  326   2HD1  LEU  42          2HD1      LEU  42  -8.190   3.980  -2.291
  327   3HD1  LEU  42          3HD1      LEU  42  -7.657   2.487  -1.517
  328   1HD2  LEU  42          1HD2      LEU  42  -9.904   4.220   0.097
  329   2HD2  LEU  42          2HD2      LEU  42  -8.995   3.601   1.475
  330   3HD2  LEU  42          3HD2      LEU  42  -9.220   2.595   0.042
  331    H    LEU  43           H        LEU  43  -4.310   4.731   2.797
  332    HA   LEU  43           HA       LEU  43  -5.623   6.918   4.016
  333   1HB   LEU  43          2HB       LEU  43  -3.576   4.980   4.751
  334   2HB   LEU  43          1HB       LEU  43  -3.259   6.564   5.433
  335    HG   LEU  43           HG       LEU  43  -5.408   6.578   6.544
  336   1HD1  LEU  43          1HD1      LEU  43  -7.116   5.431   5.721
  337   2HD1  LEU  43          2HD1      LEU  43  -6.329   3.934   6.223
  338   3HD1  LEU  43          3HD1      LEU  43  -6.046   4.579   4.605
  339   1HD2  LEU  43          1HD2      LEU  43  -4.053   5.616   8.069
  340   2HD2  LEU  43          2HD2      LEU  43  -3.480   4.386   6.943
  341   3HD2  LEU  43          3HD2      LEU  43  -5.041   4.191   7.743
  342    H    ILE  44           H        ILE  44  -2.314   6.570   2.747
  343    HA   ILE  44           HA       ILE  44  -1.500   9.209   3.258
  344    HB   ILE  44           HB       ILE  44  -0.503   7.398   1.054
  345   1HG1  ILE  44          2HG1      ILE  44  -0.396   6.252   3.210
  346   2HG1  ILE  44          1HG1      ILE  44   1.219   6.684   2.666
  347   1HG2  ILE  44          1HG2      ILE  44   0.795   9.117   0.524
  348   2HG2  ILE  44          2HG2      ILE  44   1.586   8.928   2.090
  349   3HG2  ILE  44          3HG2      ILE  44   0.232  10.046   1.914
  350   1HD1  ILE  44          1HD1      ILE  44   1.154   8.638   4.175
  351   2HD1  ILE  44          2HD1      ILE  44   1.027   7.093   5.017
  352   3HD1  ILE  44          3HD1      ILE  44  -0.411   8.083   4.770
  353    H    GLY  45           H        GLY  45  -3.138   7.729   0.512
  354   1HA   GLY  45          2HA       GLY  45  -2.930   9.915  -1.264
  355   2HA   GLY  45          1HA       GLY  45  -4.132   8.638  -1.347
  356    H    PHE  46           H        PHE  46  -5.695   8.893   0.733
  357    HA   PHE  46           HA       PHE  46  -7.247  11.182   0.164
  358   1HB   PHE  46          2HB       PHE  46  -7.758   8.770   1.301
  359   2HB   PHE  46          1HB       PHE  46  -7.758   9.800   2.729
  360    HD1  PHE  46           2HD      PHE  46  -9.427  11.546   2.999
  361    HD2  PHE  46           1HD      PHE  46  -9.472   8.972  -0.393
  362    HE1  PHE  46           2HE      PHE  46 -11.719  12.275   2.480
  363    HE2  PHE  46           1HE      PHE  46 -11.766   9.701  -0.917
  364    HZ   PHE  46           HZ       PHE  46 -12.889  11.355   0.519
  365    H    PHE  47           H        PHE  47  -5.036  10.406   2.807
  366    HA   PHE  47           HA       PHE  47  -5.604  12.715   4.364
  367   1HB   PHE  47          2HB       PHE  47  -3.582  10.555   4.393
  368   2HB   PHE  47          1HB       PHE  47  -3.130  12.054   5.190
  369    HD1  PHE  47           1HD      PHE  47  -4.691  12.975   6.966
  370    HD2  PHE  47           2HD      PHE  47  -4.970   9.007   5.459
  371    HE1  PHE  47           1HE      PHE  47  -5.976  12.311   8.956
  372    HE2  PHE  47           2HE      PHE  47  -6.255   8.336   7.441
  373    HZ   PHE  47           HZ       PHE  47  -6.761   9.989   9.194
  374    H    ARG  48           H        ARG  48  -3.211  12.013   1.846
  375    HA   ARG  48           HA       ARG  48  -1.720  14.397   2.220
  376   1HB   ARG  48          2HB       ARG  48  -0.614  13.890   0.147
  377   2HB   ARG  48          1HB       ARG  48  -0.838  12.392   1.033
  378   1HG   ARG  48          2HG       ARG  48  -2.843  11.951  -0.379
  379   2HG   ARG  48          1HG       ARG  48  -2.403  13.356  -1.350
  380   1HD   ARG  48          2HD       ARG  48  -0.269  11.368  -0.874
  381   2HD   ARG  48          1HD       ARG  48  -1.600  10.836  -1.892
  382    HE   ARG  48           HE       ARG  48   0.381  12.856  -2.517
  383   1HH1  ARG  48          1HH1      ARG  48  -2.673  11.390  -3.386
  384   2HH1  ARG  48          2HH1      ARG  48  -2.607  11.938  -5.026
  385   1HH2  ARG  48          1HH2      ARG  48   0.465  13.561  -4.679
  386   2HH2  ARG  48          2HH2      ARG  48  -0.832  13.165  -5.761
  387    H    VAL  49           H        VAL  49  -4.452  13.567   0.109
  388    HA   VAL  49           HA       VAL  49  -4.424  16.087  -1.235
  389    HB   VAL  49           HB       VAL  49  -6.858  15.450  -1.823
  390   1HG1  VAL  49          1HG1      VAL  49  -6.076  13.878  -3.543
  391   2HG1  VAL  49          2HG1      VAL  49  -4.536  13.736  -2.693
  392   3HG1  VAL  49          3HG1      VAL  49  -5.023  15.284  -3.387
  393   1HG2  VAL  49          1HG2      VAL  49  -6.477  12.656  -1.555
  394   2HG2  VAL  49          2HG2      VAL  49  -7.748  13.663  -0.858
  395   3HG2  VAL  49          3HG2      VAL  49  -6.257  13.382   0.034
  396    H    VAL  50           H        VAL  50  -6.696  14.771   1.203
  397    HA   VAL  50           HA       VAL  50  -7.993  17.254   1.658
  398    HB   VAL  50           HB       VAL  50  -7.842  14.888   3.523
  399   1HG1  VAL  50          1HG1      VAL  50  -8.882  16.368   4.859
  400   2HG1  VAL  50          2HG1      VAL  50 -10.292  15.982   3.871
  401   3HG1  VAL  50          3HG1      VAL  50  -9.331  17.420   3.517
  402   1HG2  VAL  50          1HG2      VAL  50  -9.234  13.738   2.211
  403   2HG2  VAL  50          2HG2      VAL  50  -8.847  14.902   0.942
  404   3HG2  VAL  50          3HG2      VAL  50 -10.270  15.142   1.954
  405    H    GLY  51           H        GLY  51  -5.285  15.632   3.125
  406   1HA   GLY  51          2HA       GLY  51  -5.020  17.310   5.397
  407   2HA   GLY  51          1HA       GLY  51  -3.774  16.260   4.739
  408    H    ARG  52           H        ARG  52  -3.815  17.498   2.116
  409    HA   ARG  52           HA       ARG  52  -2.010  19.656   2.721
  410   1HB   ARG  52          2HB       ARG  52  -1.609  17.973   0.914
  411   2HB   ARG  52          1HB       ARG  52  -2.939  18.693   0.016
  412   1HG   ARG  52          2HG       ARG  52  -1.361  19.950  -0.934
  413   2HG   ARG  52          1HG       ARG  52  -1.396  20.873   0.570
  414   1HD   ARG  52          2HD       ARG  52   0.307  18.472   0.597
  415   2HD   ARG  52          1HD       ARG  52   0.833  19.753  -0.490
  416    HE   ARG  52           HE       ARG  52   0.850  19.795   2.392
  417   1HH1  ARG  52          1HH1      ARG  52   0.911  21.730  -0.517
  418   2HH1  ARG  52          2HH1      ARG  52   1.631  23.099   0.264
  419   1HH2  ARG  52          1HH2      ARG  52   1.802  21.593   3.409
  420   2HH2  ARG  52          2HH2      ARG  52   2.137  23.021   2.487
  421    H    MET  53           H        MET  53  -4.885  19.424   0.604
  422    HA   MET  53           HA       MET  53  -5.877  21.927   1.581
  423   1HB   MET  53          2HB       MET  53  -4.032  22.032  -0.533
  424   2HB   MET  53          1HB       MET  53  -5.607  22.291  -1.269
  425   1HG   MET  53          2HG       MET  53  -5.692  24.365  -0.512
  426   2HG   MET  53          1HG       MET  53  -5.377  23.831   1.139
  427   1HE   MET  53          1HE       MET  53  -4.232  25.980  -1.635
  428   2HE   MET  53          2HE       MET  53  -2.838  26.675  -0.809
  429   3HE   MET  53          3HE       MET  53  -4.414  26.662  -0.018
  430    H    LEU  54           H        LEU  54  -6.026  19.473  -0.965
  431    HA   LEU  54           HA       LEU  54  -8.782  20.051  -1.564
  432   1HB   LEU  54          2HB       LEU  54  -7.083  17.710  -2.411
  433   2HB   LEU  54          1HB       LEU  54  -8.631  18.167  -3.102
  434    HG   LEU  54           HG       LEU  54  -6.164  19.905  -3.207
  435   1HD1  LEU  54          1HD1      LEU  54  -5.902  19.199  -5.496
  436   2HD1  LEU  54          2HD1      LEU  54  -7.313  18.148  -5.369
  437   3HD1  LEU  54          3HD1      LEU  54  -5.858  17.789  -4.440
  438   1HD2  LEU  54          1HD2      LEU  54  -7.503  21.482  -4.009
  439   2HD2  LEU  54          2HD2      LEU  54  -8.893  20.443  -3.694
  440   3HD2  LEU  54          3HD2      LEU  54  -8.086  20.386  -5.261
  441    HA   PRO  55           HA       PRO  55  -9.988  17.117   1.688
  442   1HB   PRO  55          2HB       PRO  55 -12.224  18.632   2.402
  443   2HB   PRO  55          1HB       PRO  55 -10.638  18.712   3.159
  444   1HG   PRO  55          2HG       PRO  55 -11.901  20.740   1.638
  445   2HG   PRO  55          1HG       PRO  55 -10.238  20.736   2.249
  446   1HD   PRO  55          2HD       PRO  55 -11.257  20.085  -0.464
  447   2HD   PRO  55          1HD       PRO  55  -9.700  20.764   0.024
  448    H    ILE  56           H        ILE  56 -12.434  18.781  -0.313
  449    HA   ILE  56           HA       ILE  56 -13.372  16.267  -1.365
  450    HB   ILE  56           HB       ILE  56 -15.735  16.660  -0.781
  451   1HG1  ILE  56          2HG1      ILE  56 -15.431  19.132  -0.304
  452   2HG1  ILE  56          1HG1      ILE  56 -16.428  18.252   0.844
  453   1HG2  ILE  56          1HG2      ILE  56 -15.619  15.477   1.153
  454   2HG2  ILE  56          2HG2      ILE  56 -14.360  16.501   1.844
  455   3HG2  ILE  56          3HG2      ILE  56 -13.950  15.311   0.609
  456   1HD1  ILE  56          1HD1      ILE  56 -14.949  18.520   2.539
  457   2HD1  ILE  56          2HD1      ILE  56 -14.563  19.963   1.601
  458   3HD1  ILE  56          3HD1      ILE  56 -13.553  18.527   1.469
  459    H    GLN  57           H        GLN  57 -12.140  18.043  -2.820
  460    HA   GLN  57           HA       GLN  57 -12.352  19.039  -4.867
  461   1HB   GLN  57          2HB       GLN  57 -15.218  18.566  -4.279
  462   2HB   GLN  57          1HB       GLN  57 -14.868  19.894  -5.369
  463   1HG   GLN  57          2HG       GLN  57 -13.395  17.456  -5.990
  464   2HG   GLN  57          1HG       GLN  57 -15.146  17.273  -6.077
  465   1HE2  GLN  57          1HE2      GLN  57 -12.345  18.713  -7.472
  466   2HE2  GLN  57          2HE2      GLN  57 -13.117  19.382  -8.867
  467    H    GLU  58           H        GLU  58 -13.849  20.332  -2.007
  468    HA   GLU  58           HA       GLU  58 -13.962  23.047  -2.819
  469   1HB   GLU  58          2HB       GLU  58 -14.219  21.544  -0.269
  470   2HB   GLU  58          1HB       GLU  58 -13.798  23.248  -0.142
  471   1HG   GLU  58          2HG       GLU  58 -15.835  23.420  -1.872
  472   2HG   GLU  58          1HG       GLU  58 -16.310  21.967  -0.999
  473    H    ASN  59           H        ASN  59 -12.495  24.679  -2.590
  474    HA   ASN  59           HA       ASN  59  -9.732  23.884  -2.274
  475   1HB   ASN  59          2HB       ASN  59 -11.080  26.453  -3.100
  476   2HB   ASN  59          1HB       ASN  59  -9.345  26.359  -2.822
  477   1HD2  ASN  59          1HD2      ASN  59  -8.648  23.996  -3.858
  478   2HD2  ASN  59          2HD2      ASN  59  -8.976  23.943  -5.555
  479    H    GLN  60           H        GLN  60 -11.982  26.140  -0.715
  480    HA   GLN  60           HA       GLN  60 -12.014  27.084   1.350
  481   1HB   GLN  60          2HB       GLN  60 -11.284  24.473   1.753
  482   2HB   GLN  60          1HB       GLN  60  -9.983  25.341   2.557
  483   1HG   GLN  60          2HG       GLN  60 -12.190  26.667   3.459
  484   2HG   GLN  60          1HG       GLN  60 -12.782  25.012   3.322
  485   1HE2  GLN  60          1HE2      GLN  60 -12.421  26.506   5.727
  486   2HE2  GLN  60          2HE2      GLN  60 -11.251  25.670   6.683
  487    H    ALA  61           H        ALA  61 -11.045  29.026   0.755
  488    HA   ALA  61           HA       ALA  61  -9.507  30.699   0.802
  489   1HB   ALA  61          1HB       ALA  61  -8.889  29.011   3.125
  490   2HB   ALA  61          2HB       ALA  61  -9.188  30.745   3.025
  491   3HB   ALA  61          3HB       ALA  61  -7.598  30.099   2.622
  492    HA   PRO  62           HA       PRO  62  -6.441  28.111  -1.677
  493   1HB   PRO  62          2HB       PRO  62  -7.213  28.847  -4.158
  494   2HB   PRO  62          1HB       PRO  62  -7.937  27.481  -3.306
  495   1HG   PRO  62          2HG       PRO  62  -8.973  30.264  -3.652
  496   2HG   PRO  62          1HG       PRO  62  -9.847  28.723  -3.733
  497   1HD   PRO  62          2HD       PRO  62  -9.867  30.357  -1.541
  498   2HD   PRO  62          1HD       PRO  62 -10.084  28.596  -1.457
  499    H    ALA  63           H        ALA  63  -7.607  31.398  -1.840
  500    HA   ALA  63           HA       ALA  63  -5.494  32.511  -3.349
  501   1HB   ALA  63          1HB       ALA  63  -7.725  33.550  -2.985
  502   2HB   ALA  63          2HB       ALA  63  -6.368  34.639  -2.699
  503   3HB   ALA  63          3HB       ALA  63  -7.229  33.924  -1.335
  504    HA   PRO  64           HA       PRO  64  -3.700  33.892   1.007
  505   1HB   PRO  64          2HB       PRO  64  -4.271  32.069   3.006
  506   2HB   PRO  64          1HB       PRO  64  -5.101  33.611   2.778
  507   1HG   PRO  64          2HG       PRO  64  -5.918  30.871   1.914
  508   2HG   PRO  64          1HG       PRO  64  -6.911  32.171   2.603
  509   1HD   PRO  64          2HD       PRO  64  -6.942  31.649  -0.017
  510   2HD   PRO  64          1HD       PRO  64  -7.031  33.316   0.582
  511    H    ASN  65           H        ASN  65  -2.056  33.046  -0.480
  512    HA   ASN  65           HA       ASN  65  -1.109  30.342   0.010
  513   1HB   ASN  65          2HB       ASN  65  -0.495  32.492  -1.963
  514   2HB   ASN  65          1HB       ASN  65   0.754  31.296  -1.633
  515   1HD2  ASN  65          1HD2      ASN  65   0.498  29.221  -2.338
  516   2HD2  ASN  65          2HD2      ASN  65  -0.786  28.724  -3.381
  517    H    ILE  66           H        ILE  66   0.263  33.634   0.186
  518    HA   ILE  66           HA       ILE  66   1.509  33.116   2.689
  519    HB   ILE  66           HB       ILE  66   3.052  31.836   1.331
  520   1HG1  ILE  66          2HG1      ILE  66   4.863  34.070   1.732
  521   2HG1  ILE  66          1HG1      ILE  66   3.748  33.896   3.084
  522   1HG2  ILE  66          1HG2      ILE  66   3.011  32.573  -0.823
  523   2HG2  ILE  66          2HG2      ILE  66   4.515  33.314  -0.278
  524   3HG2  ILE  66          3HG2      ILE  66   3.041  34.273  -0.367
  525   1HD1  ILE  66          1HD1      ILE  66   4.826  32.114   3.843
  526   2HD1  ILE  66          2HD1      ILE  66   6.096  32.498   2.681
  527   3HD1  ILE  66          3HD1      ILE  66   4.828  31.348   2.255
  528    H    THR  67           H        THR  67   0.467  35.019   3.234
  529    HA   THR  67           HA       THR  67  -0.005  37.271   3.280
  530    HB   THR  67           HB       THR  67   1.905  38.538   4.017
  531    HG1  THR  67           1HG      THR  67   4.027  37.567   3.762
  532   1HG2  THR  67          1HG2      THR  67   2.060  37.390   5.896
  533   2HG2  THR  67          2HG2      THR  67   3.056  36.167   5.105
  534   3HG2  THR  67          3HG2      THR  67   1.297  36.017   5.093
  535    H    GLY  68           H        GLY  68   1.616  39.470   2.394
  536   1HA   GLY  68          2HA       GLY  68   2.426  40.433   0.357
  537   2HA   GLY  68          1HA       GLY  68   1.575  39.180  -0.532
  538    H    ALA  69           H        ALA  69   0.691  40.879  -1.844
  539    HA   ALA  69           HA       ALA  69  -1.909  41.643  -1.088
  540   1HB   ALA  69          1HB       ALA  69   0.244  43.610  -0.571
  541   2HB   ALA  69          2HB       ALA  69  -1.291  43.362   0.258
  542   3HB   ALA  69          3HB       ALA  69  -1.250  44.216  -1.286
  543    H    LEU  70           H        LEU  70  -2.633  43.593  -2.668
  544    HA   LEU  70           HA       LEU  70  -1.326  43.821  -5.157
  545   1HB   LEU  70          2HB       LEU  70  -2.260  41.365  -5.019
  546   2HB   LEU  70          1HB       LEU  70  -3.779  42.140  -5.430
  547    HG   LEU  70           HG       LEU  70  -1.448  42.804  -7.138
  548   1HD1  LEU  70          1HD1      LEU  70  -0.909  40.663  -7.484
  549   2HD1  LEU  70          2HD1      LEU  70  -2.424  40.571  -8.383
  550   3HD1  LEU  70          3HD1      LEU  70  -2.371  40.069  -6.696
  551   1HD2  LEU  70          1HD2      LEU  70  -4.321  42.926  -7.223
  552   2HD2  LEU  70          2HD2      LEU  70  -3.701  42.053  -8.621
  553   3HD2  LEU  70          3HD2      LEU  70  -3.135  43.687  -8.281
  554    H    GLU  71           H        GLU  71  -2.214  45.822  -3.787
  555    HA   GLU  71           HA       GLU  71  -4.103  47.081  -5.446
  556   1HB   GLU  71          2HB       GLU  71  -5.378  45.449  -3.675
  557   2HB   GLU  71          1HB       GLU  71  -5.342  46.958  -2.775
  558   1HG   GLU  71          2HG       GLU  71  -6.217  47.945  -5.053
  559   2HG   GLU  71          1HG       GLU  71  -6.753  46.283  -5.301
  560    H    HIS  72           H        HIS  72  -2.985  47.056  -2.067
  561    HA   HIS  72           HA       HIS  72  -2.022  48.654  -0.769
  562   1HB   HIS  72          2HB       HIS  72  -1.221  49.476  -3.524
  563   2HB   HIS  72          1HB       HIS  72  -0.923  50.599  -2.202
  564    HD1  HIS  72           1HD      HIS  72   1.359  49.192  -3.822
  565    HD2  HIS  72           2HD      HIS  72  -0.117  47.910  -0.155
  566    HE1  HIS  72           1HE      HIS  72   3.193  47.803  -2.808
  567    HE2  HIS  72           2HE      HIS  72   2.264  47.005  -0.607
  568    H    HIS  73           H        HIS  73  -1.911  51.294  -0.668
  569    HA   HIS  73           HA       HIS  73  -4.652  52.057  -0.328
  570   1HB   HIS  73          2HB       HIS  73  -1.999  53.326   0.226
  571   2HB   HIS  73          1HB       HIS  73  -3.445  54.330   0.228
  572    HD1  HIS  73           1HD      HIS  73  -5.131  53.977   2.139
  573    HD2  HIS  73           2HD      HIS  73  -1.776  51.539   2.371
  574    HE1  HIS  73           1HE      HIS  73  -5.163  53.013   4.460
  575    HE2  HIS  73           2HE      HIS  73  -3.073  51.613   4.608
  576    H    HIS  74           H        HIS  74  -2.073  52.831  -2.598
  577    HA   HIS  74           HA       HIS  74  -2.067  53.931  -4.591
  578   1HB   HIS  74          2HB       HIS  74  -4.802  52.843  -4.358
  579   2HB   HIS  74          1HB       HIS  74  -4.627  54.175  -5.498
  580    HD1  HIS  74           1HD      HIS  74  -1.846  53.475  -6.640
  581    HD2  HIS  74           2HD      HIS  74  -4.913  50.729  -6.074
  582    HE1  HIS  74           1HE      HIS  74  -1.347  51.577  -8.213
  583    HE2  HIS  74           2HE      HIS  74  -3.216  49.924  -7.854
  584    H    HIS  75           H        HIS  75  -2.322  55.408  -2.103
  585    HA   HIS  75           HA       HIS  75  -4.127  57.576  -2.446
  586   1HB   HIS  75          2HB       HIS  75  -2.305  56.684  -0.452
  587   2HB   HIS  75          1HB       HIS  75  -1.897  58.354  -0.827
  588    HD1  HIS  75           1HD      HIS  75  -3.784  56.616   1.509
  589    HD2  HIS  75           2HD      HIS  75  -4.631  59.868  -0.933
  590    HE1  HIS  75           1HE      HIS  75  -5.733  57.779   2.592
  591    HE2  HIS  75           2HE      HIS  75  -6.287  59.689   1.047
  592    H    HIS  76           H        HIS  76  -3.990  58.996  -4.040
  593    HA   HIS  76           HA       HIS  76  -1.558  60.475  -4.470
  594   1HB   HIS  76          2HB       HIS  76  -1.358  58.384  -5.912
  595   2HB   HIS  76          1HB       HIS  76  -2.706  59.017  -6.851
  596    HD1  HIS  76           1HD      HIS  76  -2.239  61.458  -7.953
  597    HD2  HIS  76           2HD      HIS  76   1.081  59.304  -6.690
  598    HE1  HIS  76           1HE      HIS  76  -0.276  62.494  -9.135
  599    HE2  HIS  76           2HE      HIS  76   1.723  61.176  -8.354
  600    H    HIS  77           H        HIS  77  -1.923  62.476  -5.367
  601    HA   HIS  77           HA       HIS  77  -4.748  63.149  -5.820
  602   1HB   HIS  77          2HB       HIS  77  -2.443  64.622  -4.651
  603   2HB   HIS  77          1HB       HIS  77  -3.630  65.564  -5.550
  604    HD1  HIS  77           1HD      HIS  77  -3.133  65.694  -2.410
  605    HD2  HIS  77           2HD      HIS  77  -6.210  63.675  -4.339
  606    HE1  HIS  77           1HE      HIS  77  -4.962  65.466  -0.699
  607    HE2  HIS  77           2HE      HIS  77  -6.800  64.204  -1.876