*HEADER    VIRAL PROTEIN                           21-JUL-19   6PVR              
*TITLE     INFLUENZA B M2 PROTON CHANNEL IN THE CLOSED STATE - SSNMR STRUCTURE AT
*TITLE    2 PH 7.5                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BM2 PROTEIN;                                               
*COMPND   3 CHAIN: A, B, C, D;                                                   
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: INFLUENZA B VIRUS (B/MARYLAND/1/2001);          
*SOURCE   3 ORGANISM_TAXID: 1601064;                                             
*SOURCE   4 STRAIN: B/MARYLAND/1/2001;                                           
*SOURCE   5 GENE: BM2;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET-SUMO                                  
*KEYWDS    PROTON CHANNEL, CLOSED STATE, FOUR HELIX BUNDLE, VIRAL PROTEIN        
*EXPDTA    SOLID-STATE NMR                                                       
*NUMMDL    10                                                                    
*AUTHOR    V.S.MANDALA,A.R.LOFTIS,A.S.SHCHERBAKOV,B.L.PENTELUTE,M.HONG           
*REVDAT   1   05-FEB-20 6PVR    0                                                
# Restraints file 1: bm2dihC.tbl

!    3 E  -70.453  145.080   15.557   18.170    0.796 0.758 25 10 Strong
assign (resid    2 and name C and segid C   ) (resid    3 and name N and segid C   )
       (resid    3 and name CA and segid C  ) (resid    3 and name C and segid C   )    1.0  -70.5   31.1 2
assign (resid    3 and name N and segid C   ) (resid    3 and name CA and segid C  )
       (resid    3 and name C and segid C   ) (resid    4 and name N and segid C   )    1.0  145.1   36.3 2

!    4 P  -53.961  -37.594    4.433    6.240    0.570 0.779 25 11 Strong
assign (resid    3 and name C and segid C   ) (resid    4 and name N and segid C   )
       (resid    4 and name CA and segid C  ) (resid    4 and name C and segid C   )    1.0  -54.0   20.0 2
assign (resid    4 and name N and segid C   ) (resid    4 and name CA and segid C  )
       (resid    4 and name C and segid C   ) (resid    5 and name N and segid C   )    1.0  -37.6   20.0 2

!    5 F  -67.180  -29.371    7.956   14.409    0.534 0.793 25  9 Strong
assign (resid    4 and name C and segid C   ) (resid    5 and name N and segid C   )
       (resid    5 and name CA and segid C  ) (resid    5 and name C and segid C   )    1.0  -67.2   20.0 2
assign (resid    5 and name N and segid C   ) (resid    5 and name CA and segid C  )
       (resid    5 and name C and segid C   ) (resid    6 and name N and segid C   )    1.0  -29.4   28.8 2

!    7 I  -63.654  -38.213    6.512    5.727    0.286 0.867 25 10 Strong
assign (resid    6 and name C and segid C   ) (resid    7 and name N and segid C   )
       (resid    7 and name CA and segid C  ) (resid    7 and name C and segid C   )    1.0  -63.7   20.0 2
assign (resid    7 and name N and segid C   ) (resid    7 and name CA and segid C  )
       (resid    7 and name C and segid C   ) (resid    8 and name N and segid C   )    1.0  -38.2   20.0 2

!    8 L  -64.718  -37.705    4.595    5.856    0.233 0.902 25 12 Strong
assign (resid    7 and name C and segid C   ) (resid    8 and name N and segid C   )
       (resid    8 and name CA and segid C  ) (resid    8 and name C and segid C   )    1.0  -64.7   20.0 2
assign (resid    8 and name N and segid C   ) (resid    8 and name CA and segid C  )
       (resid    8 and name C and segid C   ) (resid    9 and name N and segid C   )    1.0  -37.7   20.0 2

!    9 S  -65.261  -35.975    5.233    5.639    0.180 0.919 25 12 Strong
assign (resid    8 and name C and segid C   ) (resid    9 and name N and segid C   )
       (resid    9 and name CA and segid C  ) (resid    9 and name C and segid C   )    1.0  -65.3   20.0 2
assign (resid    9 and name N and segid C   ) (resid    9 and name CA and segid C  )
       (resid    9 and name C and segid C   ) (resid   10 and name N and segid C   )    1.0  -36.0   20.0 2

!   10 I  -64.717  -41.016    4.608    4.463    0.140 0.926 25 12 Strong
assign (resid    9 and name C and segid C   ) (resid   10 and name N and segid C   )
       (resid   10 and name CA and segid C  ) (resid   10 and name C and segid C   )    1.0  -64.7   20.0 2
assign (resid   10 and name N and segid C   ) (resid   10 and name CA and segid C  )
       (resid   10 and name C and segid C   ) (resid   11 and name N and segid C   )    1.0  -41.0   20.0 2

!   11 C  -62.839  -40.076    3.981    4.079    0.139 0.930 25 12 Strong
assign (resid   10 and name C and segid C   ) (resid   11 and name N and segid C   )
       (resid   11 and name CA and segid C  ) (resid   11 and name C and segid C   )    1.0  -62.8   20.0 2
assign (resid   11 and name N and segid C   ) (resid   11 and name CA and segid C  )
       (resid   11 and name C and segid C   ) (resid   12 and name N and segid C   )    1.0  -40.1   20.0 2

!   12 S  -65.336  -38.099    4.902    5.634    0.113 0.926 25 12 Strong
assign (resid   11 and name C and segid C   ) (resid   12 and name N and segid C   )
       (resid   12 and name CA and segid C  ) (resid   12 and name C and segid C   )    1.0  -65.3   20.0 2
assign (resid   12 and name N and segid C   ) (resid   12 and name CA and segid C  )
       (resid   12 and name C and segid C   ) (resid   13 and name N and segid C   )    1.0  -38.1   20.0 2

!   13 F  -64.651  -39.747    4.581    4.394    0.098 0.922 25 12 Strong
assign (resid   12 and name C and segid C   ) (resid   13 and name N and segid C   )
       (resid   13 and name CA and segid C  ) (resid   13 and name C and segid C   )    1.0  -64.7   20.0 2
assign (resid   13 and name N and segid C   ) (resid   13 and name CA and segid C  )
       (resid   13 and name C and segid C   ) (resid   14 and name N and segid C   )    1.0  -39.7   20.0 2

!   14 I  -64.732  -41.290    5.387    5.528    0.098 0.917 25 12 Strong
assign (resid   13 and name C and segid C   ) (resid   14 and name N and segid C   )
       (resid   14 and name CA and segid C  ) (resid   14 and name C and segid C   )    1.0  -64.7   20.0 2
assign (resid   14 and name N and segid C   ) (resid   14 and name CA and segid C  )
       (resid   14 and name C and segid C   ) (resid   15 and name N and segid C   )    1.0  -41.3   20.0 2

!   15 L  -64.693  -35.309    5.244    5.958    0.083 0.906 25 12 Strong
assign (resid   14 and name C and segid C   ) (resid   15 and name N and segid C   )
       (resid   15 and name CA and segid C  ) (resid   15 and name C and segid C   )    1.0  -64.7   20.0 2
assign (resid   15 and name N and segid C   ) (resid   15 and name CA and segid C  )
       (resid   15 and name C and segid C   ) (resid   16 and name N and segid C   )    1.0  -35.3   20.0 2

!   16 S  -67.376  -37.031    5.161    3.982    0.102 0.886 25 12 Strong
assign (resid   15 and name C and segid C   ) (resid   16 and name N and segid C   )
       (resid   16 and name CA and segid C  ) (resid   16 and name C and segid C   )    1.0  -67.4   20.0 2
assign (resid   16 and name N and segid C   ) (resid   16 and name CA and segid C  )
       (resid   16 and name C and segid C   ) (resid   17 and name N and segid C   )    1.0  -37.0   20.0 2

!   17 A  -64.866  -39.632    4.263    4.603    0.111 0.873 25 12 Strong
assign (resid   16 and name C and segid C   ) (resid   17 and name N and segid C   )
       (resid   17 and name CA and segid C  ) (resid   17 and name C and segid C   )    1.0  -64.9   20.0 2
assign (resid   17 and name N and segid C   ) (resid   17 and name CA and segid C  )
       (resid   17 and name C and segid C   ) (resid   18 and name N and segid C   )    1.0  -39.6   20.0 2

!   18 L  -65.372  -40.053    4.112    5.662    0.134 0.877 25 12 Strong
assign (resid   17 and name C and segid C   ) (resid   18 and name N and segid C   )
       (resid   18 and name CA and segid C  ) (resid   18 and name C and segid C   )    1.0  -65.4   20.0 2
assign (resid   18 and name N and segid C   ) (resid   18 and name CA and segid C  )
       (resid   18 and name C and segid C   ) (resid   19 and name N and segid C   )    1.0  -40.1   20.0 2

!   19 H  -67.345  -39.981    4.938    5.586    0.151 0.894 25 12 Strong
assign (resid   18 and name C and segid C   ) (resid   19 and name N and segid C   )
       (resid   19 and name CA and segid C  ) (resid   19 and name C and segid C   )    1.0  -67.3   20.0 2
assign (resid   19 and name N and segid C   ) (resid   19 and name CA and segid C  )
       (resid   19 and name C and segid C   ) (resid   20 and name N and segid C   )    1.0  -40.0   20.0 2

!   20 F  -68.154  -37.986    4.580    5.788    0.147 0.904 25 12 Strong
assign (resid   19 and name C and segid C   ) (resid   20 and name N and segid C   )
       (resid   20 and name CA and segid C  ) (resid   20 and name C and segid C   )    1.0  -68.2   20.0 2
assign (resid   20 and name N and segid C   ) (resid   20 and name CA and segid C  )
       (resid   20 and name C and segid C   ) (resid   21 and name N and segid C   )    1.0  -38.0   20.0 2

!   21 M  -64.346  -41.737    3.603    4.840    0.157 0.905 25 12 Strong
assign (resid   20 and name C and segid C   ) (resid   21 and name N and segid C   )
       (resid   21 and name CA and segid C  ) (resid   21 and name C and segid C   )    1.0  -64.3   20.0 2
assign (resid   21 and name N and segid C   ) (resid   21 and name CA and segid C  )
       (resid   21 and name C and segid C   ) (resid   22 and name N and segid C   )    1.0  -41.7   20.0 2

!   22 A  -64.298  -37.696    5.053    5.182    0.149 0.903 25 12 Strong
assign (resid   21 and name C and segid C   ) (resid   22 and name N and segid C   )
       (resid   22 and name CA and segid C  ) (resid   22 and name C and segid C   )    1.0  -64.3   20.0 2
assign (resid   22 and name N and segid C   ) (resid   22 and name CA and segid C  )
       (resid   22 and name C and segid C   ) (resid   23 and name N and segid C   )    1.0  -37.7   20.0 2

!   23 W  -64.018  -42.866    5.882    6.641    0.144 0.908 25 12 Strong
assign (resid   22 and name C and segid C   ) (resid   23 and name N and segid C   )
       (resid   23 and name CA and segid C  ) (resid   23 and name C and segid C   )    1.0  -64.0   20.0 2
assign (resid   23 and name N and segid C   ) (resid   23 and name CA and segid C  )
       (resid   23 and name C and segid C   ) (resid   24 and name N and segid C   )    1.0  -42.9   20.0 2

!   24 T  -66.286  -39.115    3.373    5.352    0.138 0.909 25 12 Strong
assign (resid   23 and name C and segid C   ) (resid   24 and name N and segid C   )
       (resid   24 and name CA and segid C  ) (resid   24 and name C and segid C   )    1.0  -66.3   20.0 2
assign (resid   24 and name N and segid C   ) (resid   24 and name CA and segid C  )
       (resid   24 and name C and segid C   ) (resid   25 and name N and segid C   )    1.0  -39.1   20.0 2

!   25 I  -65.277  -38.743    4.978    5.048    0.132 0.913 25 11 Strong
assign (resid   24 and name C and segid C   ) (resid   25 and name N and segid C   )
       (resid   25 and name CA and segid C  ) (resid   25 and name C and segid C   )    1.0  -65.3   20.0 2
assign (resid   25 and name N and segid C   ) (resid   25 and name CA and segid C  )
       (resid   25 and name C and segid C   ) (resid   26 and name N and segid C   )    1.0  -38.7   20.0 2

!   26 G  -61.876  -39.677    4.193    5.760    0.166 0.913 25 11 Strong
assign (resid   25 and name C and segid C   ) (resid   26 and name N and segid C   )
       (resid   26 and name CA and segid C  ) (resid   26 and name C and segid C   )    1.0  -61.9   20.0 2
assign (resid   26 and name N and segid C   ) (resid   26 and name CA and segid C  )
       (resid   26 and name C and segid C   ) (resid   27 and name N and segid C   )    1.0  -39.7   20.0 2

!   27 H  -67.900  -38.563    5.490    6.555    0.197 0.910 25  9 Strong
assign (resid   26 and name C and segid C   ) (resid   27 and name N and segid C   )
       (resid   27 and name CA and segid C  ) (resid   27 and name C and segid C   )    1.0  -67.9   20.0 2
assign (resid   27 and name N and segid C   ) (resid   27 and name CA and segid C  )
       (resid   27 and name C and segid C   ) (resid   28 and name N and segid C   )    1.0  -38.6   20.0 2

!   28 L  -65.307  -32.504    4.888    6.443    0.242 0.851 25 10 Strong
assign (resid   27 and name C and segid C   ) (resid   28 and name N and segid C   )
       (resid   28 and name CA and segid C  ) (resid   28 and name C and segid C   )    1.0  -65.3   20.0 2
assign (resid   28 and name N and segid C   ) (resid   28 and name CA and segid C  )
       (resid   28 and name C and segid C   ) (resid   29 and name N and segid C   )    1.0  -32.5   20.0 2
# Restraints file 2: bm2dihD.tbl

!    3 E  -70.453  145.080   15.557   18.170    0.796 0.758 25 10 Strong
assign (resid    2 and name C and segid D   ) (resid    3 and name N and segid D   )
       (resid    3 and name CA and segid D  ) (resid    3 and name C and segid D   )    1.0  -70.5   31.1 2
assign (resid    3 and name N and segid D   ) (resid    3 and name CA and segid D  )
       (resid    3 and name C and segid D   ) (resid    4 and name N and segid D   )    1.0  145.1   36.3 2

!    4 P  -53.961  -37.594    4.433    6.240    0.570 0.779 25 11 Strong
assign (resid    3 and name C and segid D   ) (resid    4 and name N and segid D   )
       (resid    4 and name CA and segid D  ) (resid    4 and name C and segid D   )    1.0  -54.0   20.0 2
assign (resid    4 and name N and segid D   ) (resid    4 and name CA and segid D  )
       (resid    4 and name C and segid D   ) (resid    5 and name N and segid D   )    1.0  -37.6   20.0 2

!    5 F  -67.180  -29.371    7.956   14.409    0.534 0.793 25  9 Strong
assign (resid    4 and name C and segid D   ) (resid    5 and name N and segid D   )
       (resid    5 and name CA and segid D  ) (resid    5 and name C and segid D   )    1.0  -67.2   20.0 2
assign (resid    5 and name N and segid D   ) (resid    5 and name CA and segid D  )
       (resid    5 and name C and segid D   ) (resid    6 and name N and segid D   )    1.0  -29.4   28.8 2

!    7 I  -63.654  -38.213    6.512    5.727    0.286 0.867 25 10 Strong
assign (resid    6 and name C and segid D   ) (resid    7 and name N and segid D   )
       (resid    7 and name CA and segid D  ) (resid    7 and name C and segid D   )    1.0  -63.7   20.0 2
assign (resid    7 and name N and segid D   ) (resid    7 and name CA and segid D  )
       (resid    7 and name C and segid D   ) (resid    8 and name N and segid D   )    1.0  -38.2   20.0 2

!    8 L  -64.718  -37.705    4.595    5.856    0.233 0.902 25 12 Strong
assign (resid    7 and name C and segid D   ) (resid    8 and name N and segid D   )
       (resid    8 and name CA and segid D  ) (resid    8 and name C and segid D   )    1.0  -64.7   20.0 2
assign (resid    8 and name N and segid D   ) (resid    8 and name CA and segid D  )
       (resid    8 and name C and segid D   ) (resid    9 and name N and segid D   )    1.0  -37.7   20.0 2

!    9 S  -65.261  -35.975    5.233    5.639    0.180 0.919 25 12 Strong
assign (resid    8 and name C and segid D   ) (resid    9 and name N and segid D   )
       (resid    9 and name CA and segid D  ) (resid    9 and name C and segid D   )    1.0  -65.3   20.0 2
assign (resid    9 and name N and segid D   ) (resid    9 and name CA and segid D  )
       (resid    9 and name C and segid D   ) (resid   10 and name N and segid D   )    1.0  -36.0   20.0 2

!   10 I  -64.717  -41.016    4.608    4.463    0.140 0.926 25 12 Strong
assign (resid    9 and name C and segid D   ) (resid   10 and name N and segid D   )
       (resid   10 and name CA and segid D  ) (resid   10 and name C and segid D   )    1.0  -64.7   20.0 2
assign (resid   10 and name N and segid D   ) (resid   10 and name CA and segid D  )
       (resid   10 and name C and segid D   ) (resid   11 and name N and segid D   )    1.0  -41.0   20.0 2

!   11 C  -62.839  -40.076    3.981    4.079    0.139 0.930 25 12 Strong
assign (resid   10 and name C and segid D   ) (resid   11 and name N and segid D   )
       (resid   11 and name CA and segid D  ) (resid   11 and name C and segid D   )    1.0  -62.8   20.0 2
assign (resid   11 and name N and segid D   ) (resid   11 and name CA and segid D  )
       (resid   11 and name C and segid D   ) (resid   12 and name N and segid D   )    1.0  -40.1   20.0 2

!   12 S  -65.336  -38.099    4.902    5.634    0.113 0.926 25 12 Strong
assign (resid   11 and name C and segid D   ) (resid   12 and name N and segid D   )
       (resid   12 and name CA and segid D  ) (resid   12 and name C and segid D   )    1.0  -65.3   20.0 2
assign (resid   12 and name N and segid D   ) (resid   12 and name CA and segid D  )
       (resid   12 and name C and segid D   ) (resid   13 and name N and segid D   )    1.0  -38.1   20.0 2

!   13 F  -64.651  -39.747    4.581    4.394    0.098 0.922 25 12 Strong
assign (resid   12 and name C and segid D   ) (resid   13 and name N and segid D   )
       (resid   13 and name CA and segid D  ) (resid   13 and name C and segid D   )    1.0  -64.7   20.0 2
assign (resid   13 and name N and segid D   ) (resid   13 and name CA and segid D  )
       (resid   13 and name C and segid D   ) (resid   14 and name N and segid D   )    1.0  -39.7   20.0 2

!   14 I  -64.732  -41.290    5.387    5.528    0.098 0.917 25 12 Strong
assign (resid   13 and name C and segid D   ) (resid   14 and name N and segid D   )
       (resid   14 and name CA and segid D  ) (resid   14 and name C and segid D   )    1.0  -64.7   20.0 2
assign (resid   14 and name N and segid D   ) (resid   14 and name CA and segid D  )
       (resid   14 and name C and segid D   ) (resid   15 and name N and segid D   )    1.0  -41.3   20.0 2

!   15 L  -64.693  -35.309    5.244    5.958    0.083 0.906 25 12 Strong
assign (resid   14 and name C and segid D   ) (resid   15 and name N and segid D   )
       (resid   15 and name CA and segid D  ) (resid   15 and name C and segid D   )    1.0  -64.7   20.0 2
assign (resid   15 and name N and segid D   ) (resid   15 and name CA and segid D  )
       (resid   15 and name C and segid D   ) (resid   16 and name N and segid D   )    1.0  -35.3   20.0 2

!   16 S  -67.376  -37.031    5.161    3.982    0.102 0.886 25 12 Strong
assign (resid   15 and name C and segid D   ) (resid   16 and name N and segid D   )
       (resid   16 and name CA and segid D  ) (resid   16 and name C and segid D   )    1.0  -67.4   20.0 2
assign (resid   16 and name N and segid D   ) (resid   16 and name CA and segid D  )
       (resid   16 and name C and segid D   ) (resid   17 and name N and segid D   )    1.0  -37.0   20.0 2

!   17 A  -64.866  -39.632    4.263    4.603    0.111 0.873 25 12 Strong
assign (resid   16 and name C and segid D   ) (resid   17 and name N and segid D   )
       (resid   17 and name CA and segid D  ) (resid   17 and name C and segid D   )    1.0  -64.9   20.0 2
assign (resid   17 and name N and segid D   ) (resid   17 and name CA and segid D  )
       (resid   17 and name C and segid D   ) (resid   18 and name N and segid D   )    1.0  -39.6   20.0 2

!   18 L  -65.372  -40.053    4.112    5.662    0.134 0.877 25 12 Strong
assign (resid   17 and name C and segid D   ) (resid   18 and name N and segid D   )
       (resid   18 and name CA and segid D  ) (resid   18 and name C and segid D   )    1.0  -65.4   20.0 2
assign (resid   18 and name N and segid D   ) (resid   18 and name CA and segid D  )
       (resid   18 and name C and segid D   ) (resid   19 and name N and segid D   )    1.0  -40.1   20.0 2

!   19 H  -67.345  -39.981    4.938    5.586    0.151 0.894 25 12 Strong
assign (resid   18 and name C and segid D   ) (resid   19 and name N and segid D   )
       (resid   19 and name CA and segid D  ) (resid   19 and name C and segid D   )    1.0  -67.3   20.0 2
assign (resid   19 and name N and segid D   ) (resid   19 and name CA and segid D  )
       (resid   19 and name C and segid D   ) (resid   20 and name N and segid D   )    1.0  -40.0   20.0 2

!   20 F  -68.154  -37.986    4.580    5.788    0.147 0.904 25 12 Strong
assign (resid   19 and name C and segid D   ) (resid   20 and name N and segid D   )
       (resid   20 and name CA and segid D  ) (resid   20 and name C and segid D   )    1.0  -68.2   20.0 2
assign (resid   20 and name N and segid D   ) (resid   20 and name CA and segid D  )
       (resid   20 and name C and segid D   ) (resid   21 and name N and segid D   )    1.0  -38.0   20.0 2

!   21 M  -64.346  -41.737    3.603    4.840    0.157 0.905 25 12 Strong
assign (resid   20 and name C and segid D   ) (resid   21 and name N and segid D   )
       (resid   21 and name CA and segid D  ) (resid   21 and name C and segid D   )    1.0  -64.3   20.0 2
assign (resid   21 and name N and segid D   ) (resid   21 and name CA and segid D  )
       (resid   21 and name C and segid D   ) (resid   22 and name N and segid D   )    1.0  -41.7   20.0 2

!   22 A  -64.298  -37.696    5.053    5.182    0.149 0.903 25 12 Strong
assign (resid   21 and name C and segid D   ) (resid   22 and name N and segid D   )
       (resid   22 and name CA and segid D  ) (resid   22 and name C and segid D   )    1.0  -64.3   20.0 2
assign (resid   22 and name N and segid D   ) (resid   22 and name CA and segid D  )
       (resid   22 and name C and segid D   ) (resid   23 and name N and segid D   )    1.0  -37.7   20.0 2

!   23 W  -64.018  -42.866    5.882    6.641    0.144 0.908 25 12 Strong
assign (resid   22 and name C and segid D   ) (resid   23 and name N and segid D   )
       (resid   23 and name CA and segid D  ) (resid   23 and name C and segid D   )    1.0  -64.0   20.0 2
assign (resid   23 and name N and segid D   ) (resid   23 and name CA and segid D  )
       (resid   23 and name C and segid D   ) (resid   24 and name N and segid D   )    1.0  -42.9   20.0 2

!   24 T  -66.286  -39.115    3.373    5.352    0.138 0.909 25 12 Strong
assign (resid   23 and name C and segid D   ) (resid   24 and name N and segid D   )
       (resid   24 and name CA and segid D  ) (resid   24 and name C and segid D   )    1.0  -66.3   20.0 2
assign (resid   24 and name N and segid D   ) (resid   24 and name CA and segid D  )
       (resid   24 and name C and segid D   ) (resid   25 and name N and segid D   )    1.0  -39.1   20.0 2

!   25 I  -65.277  -38.743    4.978    5.048    0.132 0.913 25 11 Strong
assign (resid   24 and name C and segid D   ) (resid   25 and name N and segid D   )
       (resid   25 and name CA and segid D  ) (resid   25 and name C and segid D   )    1.0  -65.3   20.0 2
assign (resid   25 and name N and segid D   ) (resid   25 and name CA and segid D  )
       (resid   25 and name C and segid D   ) (resid   26 and name N and segid D   )    1.0  -38.7   20.0 2

!   26 G  -61.876  -39.677    4.193    5.760    0.166 0.913 25 11 Strong
assign (resid   25 and name C and segid D   ) (resid   26 and name N and segid D   )
       (resid   26 and name CA and segid D  ) (resid   26 and name C and segid D   )    1.0  -61.9   20.0 2
assign (resid   26 and name N and segid D   ) (resid   26 and name CA and segid D  )
       (resid   26 and name C and segid D   ) (resid   27 and name N and segid D   )    1.0  -39.7   20.0 2

!   27 H  -67.900  -38.563    5.490    6.555    0.197 0.910 25  9 Strong
assign (resid   26 and name C and segid D   ) (resid   27 and name N and segid D   )
       (resid   27 and name CA and segid D  ) (resid   27 and name C and segid D   )    1.0  -67.9   20.0 2
assign (resid   27 and name N and segid D   ) (resid   27 and name CA and segid D  )
       (resid   27 and name C and segid D   ) (resid   28 and name N and segid D   )    1.0  -38.6   20.0 2

!   28 L  -65.307  -32.504    4.888    6.443    0.242 0.851 25 10 Strong
assign (resid   27 and name C and segid D   ) (resid   28 and name N and segid D   )
       (resid   28 and name CA and segid D  ) (resid   28 and name C and segid D   )    1.0  -65.3   20.0 2
assign (resid   28 and name N and segid D   ) (resid   28 and name CA and segid D  )
       (resid   28 and name C and segid D   ) (resid   29 and name N and segid D   )    1.0  -32.5   20.0 2
# Restraints file 3: bm2dihA.tbl

!    3 E  -70.453  145.080   15.557   18.170    0.796 0.758 25 10 Strong
assign (resid    2 and name C and segid A   ) (resid    3 and name N and segid A   )
       (resid    3 and name CA and segid A  ) (resid    3 and name C and segid A   )    1.0  -70.5   31.1 2
assign (resid    3 and name N and segid A   ) (resid    3 and name CA and segid A  )
       (resid    3 and name C and segid A   ) (resid    4 and name N and segid A   )    1.0  145.1   36.3 2

!    4 P  -53.961  -37.594    4.433    6.240    0.570 0.779 25 11 Strong
assign (resid    3 and name C and segid A   ) (resid    4 and name N and segid A   )
       (resid    4 and name CA and segid A  ) (resid    4 and name C and segid A   )    1.0  -54.0   20.0 2
assign (resid    4 and name N and segid A   ) (resid    4 and name CA and segid A  )
       (resid    4 and name C and segid A   ) (resid    5 and name N and segid A   )    1.0  -37.6   20.0 2

!    5 F  -67.180  -29.371    7.956   14.409    0.534 0.793 25  9 Strong
assign (resid    4 and name C and segid A   ) (resid    5 and name N and segid A   )
       (resid    5 and name CA and segid A  ) (resid    5 and name C and segid A   )    1.0  -67.2   20.0 2
assign (resid    5 and name N and segid A   ) (resid    5 and name CA and segid A  )
       (resid    5 and name C and segid A   ) (resid    6 and name N and segid A   )    1.0  -29.4   28.8 2

!    7 I  -63.654  -38.213    6.512    5.727    0.286 0.867 25 10 Strong
assign (resid    6 and name C and segid A   ) (resid    7 and name N and segid A   )
       (resid    7 and name CA and segid A  ) (resid    7 and name C and segid A   )    1.0  -63.7   20.0 2
assign (resid    7 and name N and segid A   ) (resid    7 and name CA and segid A  )
       (resid    7 and name C and segid A   ) (resid    8 and name N and segid A   )    1.0  -38.2   20.0 2

!    8 L  -64.718  -37.705    4.595    5.856    0.233 0.902 25 12 Strong
assign (resid    7 and name C and segid A   ) (resid    8 and name N and segid A   )
       (resid    8 and name CA and segid A  ) (resid    8 and name C and segid A   )    1.0  -64.7   20.0 2
assign (resid    8 and name N and segid A   ) (resid    8 and name CA and segid A  )
       (resid    8 and name C and segid A   ) (resid    9 and name N and segid A   )    1.0  -37.7   20.0 2

!    9 S  -65.261  -35.975    5.233    5.639    0.180 0.919 25 12 Strong
assign (resid    8 and name C and segid A   ) (resid    9 and name N and segid A   )
       (resid    9 and name CA and segid A  ) (resid    9 and name C and segid A   )    1.0  -65.3   20.0 2
assign (resid    9 and name N and segid A   ) (resid    9 and name CA and segid A  )
       (resid    9 and name C and segid A   ) (resid   10 and name N and segid A   )    1.0  -36.0   20.0 2

!   10 I  -64.717  -41.016    4.608    4.463    0.140 0.926 25 12 Strong
assign (resid    9 and name C and segid A   ) (resid   10 and name N and segid A   )
       (resid   10 and name CA and segid A  ) (resid   10 and name C and segid A   )    1.0  -64.7   20.0 2
assign (resid   10 and name N and segid A   ) (resid   10 and name CA and segid A  )
       (resid   10 and name C and segid A   ) (resid   11 and name N and segid A   )    1.0  -41.0   20.0 2

!   11 C  -62.839  -40.076    3.981    4.079    0.139 0.930 25 12 Strong
assign (resid   10 and name C and segid A   ) (resid   11 and name N and segid A   )
       (resid   11 and name CA and segid A  ) (resid   11 and name C and segid A   )    1.0  -62.8   20.0 2
assign (resid   11 and name N and segid A   ) (resid   11 and name CA and segid A  )
       (resid   11 and name C and segid A   ) (resid   12 and name N and segid A   )    1.0  -40.1   20.0 2

!   12 S  -65.336  -38.099    4.902    5.634    0.113 0.926 25 12 Strong
assign (resid   11 and name C and segid A   ) (resid   12 and name N and segid A   )
       (resid   12 and name CA and segid A  ) (resid   12 and name C and segid A   )    1.0  -65.3   20.0 2
assign (resid   12 and name N and segid A   ) (resid   12 and name CA and segid A  )
       (resid   12 and name C and segid A   ) (resid   13 and name N and segid A   )    1.0  -38.1   20.0 2

!   13 F  -64.651  -39.747    4.581    4.394    0.098 0.922 25 12 Strong
assign (resid   12 and name C and segid A   ) (resid   13 and name N and segid A   )
       (resid   13 and name CA and segid A  ) (resid   13 and name C and segid A   )    1.0  -64.7   20.0 2
assign (resid   13 and name N and segid A   ) (resid   13 and name CA and segid A  )
       (resid   13 and name C and segid A   ) (resid   14 and name N and segid A   )    1.0  -39.7   20.0 2

!   14 I  -64.732  -41.290    5.387    5.528    0.098 0.917 25 12 Strong
assign (resid   13 and name C and segid A   ) (resid   14 and name N and segid A   )
       (resid   14 and name CA and segid A  ) (resid   14 and name C and segid A   )    1.0  -64.7   20.0 2
assign (resid   14 and name N and segid A   ) (resid   14 and name CA and segid A  )
       (resid   14 and name C and segid A   ) (resid   15 and name N and segid A   )    1.0  -41.3   20.0 2

!   15 L  -64.693  -35.309    5.244    5.958    0.083 0.906 25 12 Strong
assign (resid   14 and name C and segid A   ) (resid   15 and name N and segid A   )
       (resid   15 and name CA and segid A  ) (resid   15 and name C and segid A   )    1.0  -64.7   20.0 2
assign (resid   15 and name N and segid A   ) (resid   15 and name CA and segid A  )
       (resid   15 and name C and segid A   ) (resid   16 and name N and segid A   )    1.0  -35.3   20.0 2

!   16 S  -67.376  -37.031    5.161    3.982    0.102 0.886 25 12 Strong
assign (resid   15 and name C and segid A   ) (resid   16 and name N and segid A   )
       (resid   16 and name CA and segid A  ) (resid   16 and name C and segid A   )    1.0  -67.4   20.0 2
assign (resid   16 and name N and segid A   ) (resid   16 and name CA and segid A  )
       (resid   16 and name C and segid A   ) (resid   17 and name N and segid A   )    1.0  -37.0   20.0 2

!   17 A  -64.866  -39.632    4.263    4.603    0.111 0.873 25 12 Strong
assign (resid   16 and name C and segid A   ) (resid   17 and name N and segid A   )
       (resid   17 and name CA and segid A  ) (resid   17 and name C and segid A   )    1.0  -64.9   20.0 2
assign (resid   17 and name N and segid A   ) (resid   17 and name CA and segid A  )
       (resid   17 and name C and segid A   ) (resid   18 and name N and segid A   )    1.0  -39.6   20.0 2

!   18 L  -65.372  -40.053    4.112    5.662    0.134 0.877 25 12 Strong
assign (resid   17 and name C and segid A   ) (resid   18 and name N and segid A   )
       (resid   18 and name CA and segid A  ) (resid   18 and name C and segid A   )    1.0  -65.4   20.0 2
assign (resid   18 and name N and segid A   ) (resid   18 and name CA and segid A  )
       (resid   18 and name C and segid A   ) (resid   19 and name N and segid A   )    1.0  -40.1   20.0 2

!   19 H  -67.345  -39.981    4.938    5.586    0.151 0.894 25 12 Strong
assign (resid   18 and name C and segid A   ) (resid   19 and name N and segid A   )
       (resid   19 and name CA and segid A  ) (resid   19 and name C and segid A   )    1.0  -67.3   20.0 2
assign (resid   19 and name N and segid A   ) (resid   19 and name CA and segid A  )
       (resid   19 and name C and segid A   ) (resid   20 and name N and segid A   )    1.0  -40.0   20.0 2

!   20 F  -68.154  -37.986    4.580    5.788    0.147 0.904 25 12 Strong
assign (resid   19 and name C and segid A   ) (resid   20 and name N and segid A   )
       (resid   20 and name CA and segid A  ) (resid   20 and name C and segid A   )    1.0  -68.2   20.0 2
assign (resid   20 and name N and segid A   ) (resid   20 and name CA and segid A  )
       (resid   20 and name C and segid A   ) (resid   21 and name N and segid A   )    1.0  -38.0   20.0 2

!   21 M  -64.346  -41.737    3.603    4.840    0.157 0.905 25 12 Strong
assign (resid   20 and name C and segid A   ) (resid   21 and name N and segid A   )
       (resid   21 and name CA and segid A  ) (resid   21 and name C and segid A   )    1.0  -64.3   20.0 2
assign (resid   21 and name N and segid A   ) (resid   21 and name CA and segid A  )
       (resid   21 and name C and segid A   ) (resid   22 and name N and segid A   )    1.0  -41.7   20.0 2

!   22 A  -64.298  -37.696    5.053    5.182    0.149 0.903 25 12 Strong
assign (resid   21 and name C and segid A   ) (resid   22 and name N and segid A   )
       (resid   22 and name CA and segid A  ) (resid   22 and name C and segid A   )    1.0  -64.3   20.0 2
assign (resid   22 and name N and segid A   ) (resid   22 and name CA and segid A  )
       (resid   22 and name C and segid A   ) (resid   23 and name N and segid A   )    1.0  -37.7   20.0 2

!   23 W  -64.018  -42.866    5.882    6.641    0.144 0.908 25 12 Strong
assign (resid   22 and name C and segid A   ) (resid   23 and name N and segid A   )
       (resid   23 and name CA and segid A  ) (resid   23 and name C and segid A   )    1.0  -64.0   20.0 2
assign (resid   23 and name N and segid A   ) (resid   23 and name CA and segid A  )
       (resid   23 and name C and segid A   ) (resid   24 and name N and segid A   )    1.0  -42.9   20.0 2

!   24 T  -66.286  -39.115    3.373    5.352    0.138 0.909 25 12 Strong
assign (resid   23 and name C and segid A   ) (resid   24 and name N and segid A   )
       (resid   24 and name CA and segid A  ) (resid   24 and name C and segid A   )    1.0  -66.3   20.0 2
assign (resid   24 and name N and segid A   ) (resid   24 and name CA and segid A  )
       (resid   24 and name C and segid A   ) (resid   25 and name N and segid A   )    1.0  -39.1   20.0 2

!   25 I  -65.277  -38.743    4.978    5.048    0.132 0.913 25 11 Strong
assign (resid   24 and name C and segid A   ) (resid   25 and name N and segid A   )
       (resid   25 and name CA and segid A  ) (resid   25 and name C and segid A   )    1.0  -65.3   20.0 2
assign (resid   25 and name N and segid A   ) (resid   25 and name CA and segid A  )
       (resid   25 and name C and segid A   ) (resid   26 and name N and segid A   )    1.0  -38.7   20.0 2

!   26 G  -61.876  -39.677    4.193    5.760    0.166 0.913 25 11 Strong
assign (resid   25 and name C and segid A   ) (resid   26 and name N and segid A   )
       (resid   26 and name CA and segid A  ) (resid   26 and name C and segid A   )    1.0  -61.9   20.0 2
assign (resid   26 and name N and segid A   ) (resid   26 and name CA and segid A  )
       (resid   26 and name C and segid A   ) (resid   27 and name N and segid A   )    1.0  -39.7   20.0 2

!   27 H  -67.900  -38.563    5.490    6.555    0.197 0.910 25  9 Strong
assign (resid   26 and name C and segid A   ) (resid   27 and name N and segid A   )
       (resid   27 and name CA and segid A  ) (resid   27 and name C and segid A   )    1.0  -67.9   20.0 2
assign (resid   27 and name N and segid A   ) (resid   27 and name CA and segid A  )
       (resid   27 and name C and segid A   ) (resid   28 and name N and segid A   )    1.0  -38.6   20.0 2

!   28 L  -65.307  -32.504    4.888    6.443    0.242 0.851 25 10 Strong
assign (resid   27 and name C and segid A   ) (resid   28 and name N and segid A   )
       (resid   28 and name CA and segid A  ) (resid   28 and name C and segid A   )    1.0  -65.3   20.0 2
assign (resid   28 and name N and segid A   ) (resid   28 and name CA and segid A  )
       (resid   28 and name C and segid A   ) (resid   29 and name N and segid A   )    1.0  -32.5   20.0 2
# Restraints file 4: bm2dihB.tbl

!    3 E  -70.453  145.080   15.557   18.170    0.796 0.758 25 10 Strong
assign (resid    2 and name C and segid B   ) (resid    3 and name N and segid B   )
       (resid    3 and name CA and segid B  ) (resid    3 and name C and segid B   )    1.0  -70.5   31.1 2
assign (resid    3 and name N and segid B   ) (resid    3 and name CA and segid B  )
       (resid    3 and name C and segid B   ) (resid    4 and name N and segid B   )    1.0  145.1   36.3 2

!    4 P  -53.961  -37.594    4.433    6.240    0.570 0.779 25 11 Strong
assign (resid    3 and name C and segid B   ) (resid    4 and name N and segid B   )
       (resid    4 and name CA and segid B  ) (resid    4 and name C and segid B   )    1.0  -54.0   20.0 2
assign (resid    4 and name N and segid B   ) (resid    4 and name CA and segid B  )
       (resid    4 and name C and segid B   ) (resid    5 and name N and segid B   )    1.0  -37.6   20.0 2

!    5 F  -67.180  -29.371    7.956   14.409    0.534 0.793 25  9 Strong
assign (resid    4 and name C and segid B   ) (resid    5 and name N and segid B   )
       (resid    5 and name CA and segid B  ) (resid    5 and name C and segid B   )    1.0  -67.2   20.0 2
assign (resid    5 and name N and segid B   ) (resid    5 and name CA and segid B  )
       (resid    5 and name C and segid B   ) (resid    6 and name N and segid B   )    1.0  -29.4   28.8 2

!    7 I  -63.654  -38.213    6.512    5.727    0.286 0.867 25 10 Strong
assign (resid    6 and name C and segid B   ) (resid    7 and name N and segid B   )
       (resid    7 and name CA and segid B  ) (resid    7 and name C and segid B   )    1.0  -63.7   20.0 2
assign (resid    7 and name N and segid B   ) (resid    7 and name CA and segid B  )
       (resid    7 and name C and segid B   ) (resid    8 and name N and segid B   )    1.0  -38.2   20.0 2

!    8 L  -64.718  -37.705    4.595    5.856    0.233 0.902 25 12 Strong
assign (resid    7 and name C and segid B   ) (resid    8 and name N and segid B   )
       (resid    8 and name CA and segid B  ) (resid    8 and name C and segid B   )    1.0  -64.7   20.0 2
assign (resid    8 and name N and segid B   ) (resid    8 and name CA and segid B  )
       (resid    8 and name C and segid B   ) (resid    9 and name N and segid B   )    1.0  -37.7   20.0 2

!    9 S  -65.261  -35.975    5.233    5.639    0.180 0.919 25 12 Strong
assign (resid    8 and name C and segid B   ) (resid    9 and name N and segid B   )
       (resid    9 and name CA and segid B  ) (resid    9 and name C and segid B   )    1.0  -65.3   20.0 2
assign (resid    9 and name N and segid B   ) (resid    9 and name CA and segid B  )
       (resid    9 and name C and segid B   ) (resid   10 and name N and segid B   )    1.0  -36.0   20.0 2

!   10 I  -64.717  -41.016    4.608    4.463    0.140 0.926 25 12 Strong
assign (resid    9 and name C and segid B   ) (resid   10 and name N and segid B   )
       (resid   10 and name CA and segid B  ) (resid   10 and name C and segid B   )    1.0  -64.7   20.0 2
assign (resid   10 and name N and segid B   ) (resid   10 and name CA and segid B  )
       (resid   10 and name C and segid B   ) (resid   11 and name N and segid B   )    1.0  -41.0   20.0 2

!   11 C  -62.839  -40.076    3.981    4.079    0.139 0.930 25 12 Strong
assign (resid   10 and name C and segid B   ) (resid   11 and name N and segid B   )
       (resid   11 and name CA and segid B  ) (resid   11 and name C and segid B   )    1.0  -62.8   20.0 2
assign (resid   11 and name N and segid B   ) (resid   11 and name CA and segid B  )
       (resid   11 and name C and segid B   ) (resid   12 and name N and segid B   )    1.0  -40.1   20.0 2

!   12 S  -65.336  -38.099    4.902    5.634    0.113 0.926 25 12 Strong
assign (resid   11 and name C and segid B   ) (resid   12 and name N and segid B   )
       (resid   12 and name CA and segid B  ) (resid   12 and name C and segid B   )    1.0  -65.3   20.0 2
assign (resid   12 and name N and segid B   ) (resid   12 and name CA and segid B  )
       (resid   12 and name C and segid B   ) (resid   13 and name N and segid B   )    1.0  -38.1   20.0 2

!   13 F  -64.651  -39.747    4.581    4.394    0.098 0.922 25 12 Strong
assign (resid   12 and name C and segid B   ) (resid   13 and name N and segid B   )
       (resid   13 and name CA and segid B  ) (resid   13 and name C and segid B   )    1.0  -64.7   20.0 2
assign (resid   13 and name N and segid B   ) (resid   13 and name CA and segid B  )
       (resid   13 and name C and segid B   ) (resid   14 and name N and segid B   )    1.0  -39.7   20.0 2

!   14 I  -64.732  -41.290    5.387    5.528    0.098 0.917 25 12 Strong
assign (resid   13 and name C and segid B   ) (resid   14 and name N and segid B   )
       (resid   14 and name CA and segid B  ) (resid   14 and name C and segid B   )    1.0  -64.7   20.0 2
assign (resid   14 and name N and segid B   ) (resid   14 and name CA and segid B  )
       (resid   14 and name C and segid B   ) (resid   15 and name N and segid B   )    1.0  -41.3   20.0 2

!   15 L  -64.693  -35.309    5.244    5.958    0.083 0.906 25 12 Strong
assign (resid   14 and name C and segid B   ) (resid   15 and name N and segid B   )
       (resid   15 and name CA and segid B  ) (resid   15 and name C and segid B   )    1.0  -64.7   20.0 2
assign (resid   15 and name N and segid B   ) (resid   15 and name CA and segid B  )
       (resid   15 and name C and segid B   ) (resid   16 and name N and segid B   )    1.0  -35.3   20.0 2

!   16 S  -67.376  -37.031    5.161    3.982    0.102 0.886 25 12 Strong
assign (resid   15 and name C and segid B   ) (resid   16 and name N and segid B   )
       (resid   16 and name CA and segid B  ) (resid   16 and name C and segid B   )    1.0  -67.4   20.0 2
assign (resid   16 and name N and segid B   ) (resid   16 and name CA and segid B  )
       (resid   16 and name C and segid B   ) (resid   17 and name N and segid B   )    1.0  -37.0   20.0 2

!   17 A  -64.866  -39.632    4.263    4.603    0.111 0.873 25 12 Strong
assign (resid   16 and name C and segid B   ) (resid   17 and name N and segid B   )
       (resid   17 and name CA and segid B  ) (resid   17 and name C and segid B   )    1.0  -64.9   20.0 2
assign (resid   17 and name N and segid B   ) (resid   17 and name CA and segid B  )
       (resid   17 and name C and segid B   ) (resid   18 and name N and segid B   )    1.0  -39.6   20.0 2

!   18 L  -65.372  -40.053    4.112    5.662    0.134 0.877 25 12 Strong
assign (resid   17 and name C and segid B   ) (resid   18 and name N and segid B   )
       (resid   18 and name CA and segid B  ) (resid   18 and name C and segid B   )    1.0  -65.4   20.0 2
assign (resid   18 and name N and segid B   ) (resid   18 and name CA and segid B  )
       (resid   18 and name C and segid B   ) (resid   19 and name N and segid B   )    1.0  -40.1   20.0 2

!   19 H  -67.345  -39.981    4.938    5.586    0.151 0.894 25 12 Strong
assign (resid   18 and name C and segid B   ) (resid   19 and name N and segid B   )
       (resid   19 and name CA and segid B  ) (resid   19 and name C and segid B   )    1.0  -67.3   20.0 2
assign (resid   19 and name N and segid B   ) (resid   19 and name CA and segid B  )
       (resid   19 and name C and segid B   ) (resid   20 and name N and segid B   )    1.0  -40.0   20.0 2

!   20 F  -68.154  -37.986    4.580    5.788    0.147 0.904 25 12 Strong
assign (resid   19 and name C and segid B   ) (resid   20 and name N and segid B   )
       (resid   20 and name CA and segid B  ) (resid   20 and name C and segid B   )    1.0  -68.2   20.0 2
assign (resid   20 and name N and segid B   ) (resid   20 and name CA and segid B  )
       (resid   20 and name C and segid B   ) (resid   21 and name N and segid B   )    1.0  -38.0   20.0 2

!   21 M  -64.346  -41.737    3.603    4.840    0.157 0.905 25 12 Strong
assign (resid   20 and name C and segid B   ) (resid   21 and name N and segid B   )
       (resid   21 and name CA and segid B  ) (resid   21 and name C and segid B   )    1.0  -64.3   20.0 2
assign (resid   21 and name N and segid B   ) (resid   21 and name CA and segid B  )
       (resid   21 and name C and segid B   ) (resid   22 and name N and segid B   )    1.0  -41.7   20.0 2

!   22 A  -64.298  -37.696    5.053    5.182    0.149 0.903 25 12 Strong
assign (resid   21 and name C and segid B   ) (resid   22 and name N and segid B   )
       (resid   22 and name CA and segid B  ) (resid   22 and name C and segid B   )    1.0  -64.3   20.0 2
assign (resid   22 and name N and segid B   ) (resid   22 and name CA and segid B  )
       (resid   22 and name C and segid B   ) (resid   23 and name N and segid B   )    1.0  -37.7   20.0 2

!   23 W  -64.018  -42.866    5.882    6.641    0.144 0.908 25 12 Strong
assign (resid   22 and name C and segid B   ) (resid   23 and name N and segid B   )
       (resid   23 and name CA and segid B  ) (resid   23 and name C and segid B   )    1.0  -64.0   20.0 2
assign (resid   23 and name N and segid B   ) (resid   23 and name CA and segid B  )
       (resid   23 and name C and segid B   ) (resid   24 and name N and segid B   )    1.0  -42.9   20.0 2

!   24 T  -66.286  -39.115    3.373    5.352    0.138 0.909 25 12 Strong
assign (resid   23 and name C and segid B   ) (resid   24 and name N and segid B   )
       (resid   24 and name CA and segid B  ) (resid   24 and name C and segid B   )    1.0  -66.3   20.0 2
assign (resid   24 and name N and segid B   ) (resid   24 and name CA and segid B  )
       (resid   24 and name C and segid B   ) (resid   25 and name N and segid B   )    1.0  -39.1   20.0 2

!   25 I  -65.277  -38.743    4.978    5.048    0.132 0.913 25 11 Strong
assign (resid   24 and name C and segid B   ) (resid   25 and name N and segid B   )
       (resid   25 and name CA and segid B  ) (resid   25 and name C and segid B   )    1.0  -65.3   20.0 2
assign (resid   25 and name N and segid B   ) (resid   25 and name CA and segid B  )
       (resid   25 and name C and segid B   ) (resid   26 and name N and segid B   )    1.0  -38.7   20.0 2

!   26 G  -61.876  -39.677    4.193    5.760    0.166 0.913 25 11 Strong
assign (resid   25 and name C and segid B   ) (resid   26 and name N and segid B   )
       (resid   26 and name CA and segid B  ) (resid   26 and name C and segid B   )    1.0  -61.9   20.0 2
assign (resid   26 and name N and segid B   ) (resid   26 and name CA and segid B  )
       (resid   26 and name C and segid B   ) (resid   27 and name N and segid B   )    1.0  -39.7   20.0 2

!   27 H  -67.900  -38.563    5.490    6.555    0.197 0.910 25  9 Strong
assign (resid   26 and name C and segid B   ) (resid   27 and name N and segid B   )
       (resid   27 and name CA and segid B  ) (resid   27 and name C and segid B   )    1.0  -67.9   20.0 2
assign (resid   27 and name N and segid B   ) (resid   27 and name CA and segid B  )
       (resid   27 and name C and segid B   ) (resid   28 and name N and segid B   )    1.0  -38.6   20.0 2

!   28 L  -65.307  -32.504    4.888    6.443    0.242 0.851 25 10 Strong
assign (resid   27 and name C and segid B   ) (resid   28 and name N and segid B   )
       (resid   28 and name CA and segid B  ) (resid   28 and name C and segid B   )    1.0  -65.3   20.0 2
assign (resid   28 and name N and segid B   ) (resid   28 and name CA and segid B  )
       (resid   28 and name C and segid B   ) (resid   29 and name N and segid B   )    1.0  -32.5   20.0 2
# Restraints file 5: ehb.tbl
!helix hydrogen bond restraints
!helix A
assign (resid 10 and name N and segid A) (resid  6 and name O and segid A)	2.95 0.1 0.1
assign (resid 11 and name N and segid A) (resid  7 and name O and segid A)	2.95 0.1 0.1
assign (resid 12 and name N and segid A) (resid  8 and name O and segid A)	2.95 0.1 0.1
assign (resid 13 and name N and segid A) (resid  9 and name O and segid A)	2.95 0.1 0.1
assign (resid 14 and name N and segid A) (resid 10 and name O and segid A)	2.95 0.1 0.1
assign (resid 15 and name N and segid A) (resid 11 and name O and segid A)	2.95 0.1 0.1
assign (resid 16 and name N and segid A) (resid 12 and name O and segid A)	2.95 0.1 0.1
assign (resid 17 and name N and segid A) (resid 13 and name O and segid A)	2.95 0.1 0.1
assign (resid 18 and name N and segid A) (resid 14 and name O and segid A)	2.95 0.1 0.1
assign (resid 19 and name N and segid A) (resid 15 and name O and segid A)	2.95 0.1 0.1
assign (resid 20 and name N and segid A) (resid 16 and name O and segid A)	2.95 0.1 0.1
assign (resid 21 and name N and segid A) (resid 17 and name O and segid A)	2.95 0.1 0.1
assign (resid 22 and name N and segid A) (resid 18 and name O and segid A)	2.95 0.1 0.1
assign (resid 23 and name N and segid A) (resid 19 and name O and segid A)	2.95 0.1 0.1
assign (resid 24 and name N and segid A) (resid 20 and name O and segid A)	2.95 0.1 0.1
assign (resid 25 and name N and segid A) (resid 21 and name O and segid A)	2.95 0.1 0.1
assign (resid 26 and name N and segid A) (resid 22 and name O and segid A)	2.95 0.1 0.1
assign (resid 27 and name N and segid A) (resid 23 and name O and segid A)	2.95 0.1 0.1
assign (resid 28 and name N and segid A) (resid 24 and name O and segid A)	2.95 0.1 0.1
assign (resid 10 and name HN and segid A) (resid  6 and name O and segid A)	2.0 0.1 0.1
assign (resid 11 and name HN and segid A) (resid  7 and name O and segid A)	2.0 0.1 0.1
assign (resid 12 and name HN and segid A) (resid  8 and name O and segid A)	2.0 0.1 0.1
assign (resid 13 and name HN and segid A) (resid  9 and name O and segid A)	2.0 0.1 0.1
assign (resid 14 and name HN and segid A) (resid 10 and name O and segid A)	2.0 0.1 0.1
assign (resid 15 and name HN and segid A) (resid 11 and name O and segid A)	2.0 0.1 0.1
assign (resid 16 and name HN and segid A) (resid 12 and name O and segid A)	2.0 0.1 0.1
assign (resid 17 and name HN and segid A) (resid 13 and name O and segid A)	2.0 0.1 0.1
assign (resid 18 and name HN and segid A) (resid 14 and name O and segid A)	2.0 0.1 0.1
assign (resid 19 and name HN and segid A) (resid 15 and name O and segid A)	2.0 0.1 0.1
assign (resid 20 and name HN and segid A) (resid 16 and name O and segid A)	2.0 0.1 0.1
assign (resid 21 and name HN and segid A) (resid 17 and name O and segid A)	2.0 0.1 0.1
assign (resid 22 and name HN and segid A) (resid 18 and name O and segid A)	2.0 0.1 0.1
assign (resid 23 and name HN and segid A) (resid 19 and name O and segid A)	2.0 0.1 0.1
assign (resid 24 and name HN and segid A) (resid 20 and name O and segid A)	2.0 0.1 0.1
assign (resid 25 and name HN and segid A) (resid 21 and name O and segid A)	2.0 0.1 0.1
assign (resid 26 and name HN and segid A) (resid 22 and name O and segid A)	2.0 0.1 0.1
assign (resid 27 and name HN and segid A) (resid 23 and name O and segid A)	2.0 0.1 0.1
assign (resid 28 and name HN and segid A) (resid 24 and name O and segid A)	2.0 0.1 0.1

helix B
assign (resid 10 and name N and segid B) (resid  6 and name O and segid B)	2.95 0.1 0.1
assign (resid 11 and name N and segid B) (resid  7 and name O and segid B)	2.95 0.1 0.1
assign (resid 12 and name N and segid B) (resid  8 and name O and segid B)	2.95 0.1 0.1
assign (resid 13 and name N and segid B) (resid  9 and name O and segid B)	2.95 0.1 0.1
assign (resid 14 and name N and segid B) (resid 10 and name O and segid B)	2.95 0.1 0.1
assign (resid 15 and name N and segid B) (resid 11 and name O and segid B)	2.95 0.1 0.1
assign (resid 16 and name N and segid B) (resid 12 and name O and segid B)	2.95 0.1 0.1
assign (resid 17 and name N and segid B) (resid 13 and name O and segid B)	2.95 0.1 0.1
assign (resid 18 and name N and segid B) (resid 14 and name O and segid B)	2.95 0.1 0.1
assign (resid 19 and name N and segid B) (resid 15 and name O and segid B)	2.95 0.1 0.1
assign (resid 20 and name N and segid B) (resid 16 and name O and segid B)	2.95 0.1 0.1
assign (resid 21 and name N and segid B) (resid 17 and name O and segid B)	2.95 0.1 0.1
assign (resid 22 and name N and segid B) (resid 18 and name O and segid B)	2.95 0.1 0.1
assign (resid 23 and name N and segid B) (resid 19 and name O and segid B)	2.95 0.1 0.1
assign (resid 24 and name N and segid B) (resid 20 and name O and segid B)	2.95 0.1 0.1
assign (resid 25 and name N and segid B) (resid 21 and name O and segid B)	2.95 0.1 0.1
assign (resid 26 and name N and segid B) (resid 22 and name O and segid B)	2.95 0.1 0.1
assign (resid 27 and name N and segid B) (resid 23 and name O and segid B)	2.95 0.1 0.1
assign (resid 28 and name N and segid B) (resid 24 and name O and segid B)	2.95 0.1 0.1
assign (resid 10 and name HN and segid B) (resid  6 and name O and segid B)	2.0 0.1 0.1
assign (resid 11 and name HN and segid B) (resid  7 and name O and segid B)	2.0 0.1 0.1
assign (resid 12 and name HN and segid B) (resid  8 and name O and segid B)	2.0 0.1 0.1
assign (resid 13 and name HN and segid B) (resid  9 and name O and segid B)	2.0 0.1 0.1
assign (resid 14 and name HN and segid B) (resid 10 and name O and segid B)	2.0 0.1 0.1
assign (resid 15 and name HN and segid B) (resid 11 and name O and segid B)	2.0 0.1 0.1
assign (resid 16 and name HN and segid B) (resid 12 and name O and segid B)	2.0 0.1 0.1
assign (resid 17 and name HN and segid B) (resid 13 and name O and segid B)	2.0 0.1 0.1
assign (resid 18 and name HN and segid B) (resid 14 and name O and segid B)	2.0 0.1 0.1
assign (resid 19 and name HN and segid B) (resid 15 and name O and segid B)	2.0 0.1 0.1
assign (resid 20 and name HN and segid B) (resid 16 and name O and segid B)	2.0 0.1 0.1
assign (resid 21 and name HN and segid B) (resid 17 and name O and segid B)	2.0 0.1 0.1
assign (resid 22 and name HN and segid B) (resid 18 and name O and segid B)	2.0 0.1 0.1
assign (resid 23 and name HN and segid B) (resid 19 and name O and segid B)	2.0 0.1 0.1
assign (resid 24 and name HN and segid B) (resid 20 and name O and segid B)	2.0 0.1 0.1
assign (resid 25 and name HN and segid B) (resid 21 and name O and segid B)	2.0 0.1 0.1
assign (resid 26 and name HN and segid B) (resid 22 and name O and segid B)	2.0 0.1 0.1
assign (resid 27 and name HN and segid B) (resid 23 and name O and segid B)	2.0 0.1 0.1
assign (resid 28 and name HN and segid B) (resid 24 and name O and segid B)	2.0 0.1 0.1


!helix C
assign (resid 10 and name N and segid C) (resid  6 and name O and segid C)	2.95 0.1 0.1
assign (resid 11 and name N and segid C) (resid  7 and name O and segid C)	2.95 0.1 0.1
assign (resid 12 and name N and segid C) (resid  8 and name O and segid C)	2.95 0.1 0.1
assign (resid 13 and name N and segid C) (resid  9 and name O and segid C)	2.95 0.1 0.1
assign (resid 14 and name N and segid C) (resid 10 and name O and segid C)	2.95 0.1 0.1
assign (resid 15 and name N and segid C) (resid 11 and name O and segid C)	2.95 0.1 0.1
assign (resid 16 and name N and segid C) (resid 12 and name O and segid C)	2.95 0.1 0.1
assign (resid 17 and name N and segid C) (resid 13 and name O and segid C)	2.95 0.1 0.1
assign (resid 18 and name N and segid C) (resid 14 and name O and segid C)	2.95 0.1 0.1
assign (resid 19 and name N and segid C) (resid 15 and name O and segid C)	2.95 0.1 0.1
assign (resid 20 and name N and segid C) (resid 16 and name O and segid C)	2.95 0.1 0.1
assign (resid 21 and name N and segid C) (resid 17 and name O and segid C)	2.95 0.1 0.1
assign (resid 22 and name N and segid C) (resid 18 and name O and segid C)	2.95 0.1 0.1
assign (resid 23 and name N and segid C) (resid 19 and name O and segid C)	2.95 0.1 0.1
assign (resid 24 and name N and segid C) (resid 20 and name O and segid C)	2.95 0.1 0.1
assign (resid 25 and name N and segid C) (resid 21 and name O and segid C)	2.95 0.1 0.1
assign (resid 26 and name N and segid C) (resid 22 and name O and segid C)	2.95 0.1 0.1
assign (resid 27 and name N and segid C) (resid 23 and name O and segid C)	2.95 0.1 0.1
assign (resid 28 and name N and segid C) (resid 24 and name O and segid C)	2.95 0.1 0.1
assign (resid 10 and name HN and segid C) (resid  6 and name O and segid C)	2.0 0.1 0.1
assign (resid 11 and name HN and segid C) (resid  7 and name O and segid C)	2.0 0.1 0.1
assign (resid 12 and name HN and segid C) (resid  8 and name O and segid C)	2.0 0.1 0.1
assign (resid 13 and name HN and segid C) (resid  9 and name O and segid C)	2.0 0.1 0.1
assign (resid 14 and name HN and segid C) (resid 10 and name O and segid C)	2.0 0.1 0.1
assign (resid 15 and name HN and segid C) (resid 11 and name O and segid C)	2.0 0.1 0.1
assign (resid 16 and name HN and segid C) (resid 12 and name O and segid C)	2.0 0.1 0.1
assign (resid 17 and name HN and segid C) (resid 13 and name O and segid C)	2.0 0.1 0.1
assign (resid 18 and name HN and segid C) (resid 14 and name O and segid C)	2.0 0.1 0.1
assign (resid 19 and name HN and segid C) (resid 15 and name O and segid C)	2.0 0.1 0.1
assign (resid 20 and name HN and segid C) (resid 16 and name O and segid C)	2.0 0.1 0.1
assign (resid 21 and name HN and segid C) (resid 17 and name O and segid C)	2.0 0.1 0.1
assign (resid 22 and name HN and segid C) (resid 18 and name O and segid C)	2.0 0.1 0.1
assign (resid 23 and name HN and segid C) (resid 19 and name O and segid C)	2.0 0.1 0.1
assign (resid 24 and name HN and segid C) (resid 20 and name O and segid C)	2.0 0.1 0.1
assign (resid 25 and name HN and segid C) (resid 21 and name O and segid C)	2.0 0.1 0.1
assign (resid 26 and name HN and segid C) (resid 22 and name O and segid C)	2.0 0.1 0.1
assign (resid 27 and name HN and segid C) (resid 23 and name O and segid C)	2.0 0.1 0.1
assign (resid 28 and name HN and segid C) (resid 24 and name O and segid C)	2.0 0.1 0.1


!helix D
assign (resid 10 and name N and segid D) (resid  6 and name O and segid D)	2.95 0.1 0.1
assign (resid 11 and name N and segid D) (resid  7 and name O and segid D)	2.95 0.1 0.1
assign (resid 12 and name N and segid D) (resid  8 and name O and segid D)	2.95 0.1 0.1
assign (resid 13 and name N and segid D) (resid  9 and name O and segid D)	2.95 0.1 0.1
assign (resid 14 and name N and segid D) (resid 10 and name O and segid D)	2.95 0.1 0.1
assign (resid 15 and name N and segid D) (resid 11 and name O and segid D)	2.95 0.1 0.1
assign (resid 16 and name N and segid D) (resid 12 and name O and segid D)	2.95 0.1 0.1
assign (resid 17 and name N and segid D) (resid 13 and name O and segid D)	2.95 0.1 0.1
assign (resid 18 and name N and segid D) (resid 14 and name O and segid D)	2.95 0.1 0.1
assign (resid 19 and name N and segid D) (resid 15 and name O and segid D)	2.95 0.1 0.1
assign (resid 20 and name N and segid D) (resid 16 and name O and segid D)	2.95 0.1 0.1
assign (resid 21 and name N and segid D) (resid 17 and name O and segid D)	2.95 0.1 0.1
assign (resid 22 and name N and segid D) (resid 18 and name O and segid D)	2.95 0.1 0.1
assign (resid 23 and name N and segid D) (resid 19 and name O and segid D)	2.95 0.1 0.1
assign (resid 24 and name N and segid D) (resid 20 and name O and segid D)	2.95 0.1 0.1
assign (resid 25 and name N and segid D) (resid 21 and name O and segid D)	2.95 0.1 0.1
assign (resid 26 and name N and segid D) (resid 22 and name O and segid D)	2.95 0.1 0.1
assign (resid 27 and name N and segid D) (resid 23 and name O and segid D)	2.95 0.1 0.1
assign (resid 28 and name N and segid D) (resid 24 and name O and segid D)	2.95 0.1 0.1
assign (resid 10 and name HN and segid D) (resid  6 and name O and segid D)	2.0 0.1 0.1
assign (resid 11 and name HN and segid D) (resid  7 and name O and segid D)	2.0 0.1 0.1
assign (resid 12 and name HN and segid D) (resid  8 and name O and segid D)	2.0 0.1 0.1
assign (resid 13 and name HN and segid D) (resid  9 and name O and segid D)	2.0 0.1 0.1
assign (resid 14 and name HN and segid D) (resid 10 and name O and segid D)	2.0 0.1 0.1
assign (resid 15 and name HN and segid D) (resid 11 and name O and segid D)	2.0 0.1 0.1
assign (resid 16 and name HN and segid D) (resid 12 and name O and segid D)	2.0 0.1 0.1
assign (resid 17 and name HN and segid D) (resid 13 and name O and segid D)	2.0 0.1 0.1
assign (resid 18 and name HN and segid D) (resid 14 and name O and segid D)	2.0 0.1 0.1
assign (resid 19 and name HN and segid D) (resid 15 and name O and segid D)	2.0 0.1 0.1
assign (resid 20 and name HN and segid D) (resid 16 and name O and segid D)	2.0 0.1 0.1
assign (resid 21 and name HN and segid D) (resid 17 and name O and segid D)	2.0 0.1 0.1
assign (resid 22 and name HN and segid D) (resid 18 and name O and segid D)	2.0 0.1 0.1
assign (resid 23 and name HN and segid D) (resid 19 and name O and segid D)	2.0 0.1 0.1
assign (resid 24 and name HN and segid D) (resid 20 and name O and segid D)	2.0 0.1 0.1
assign (resid 25 and name HN and segid D) (resid 21 and name O and segid D)	2.0 0.1 0.1
assign (resid 26 and name HN and segid D) (resid 22 and name O and segid D)	2.0 0.1 0.1
assign (resid 27 and name HN and segid D) (resid 23 and name O and segid D)	2.0 0.1 0.1
assign (resid 28 and name HN and segid D) (resid 24 and name O and segid D)	2.0 0.1 0.1

# Restraints file 6: hb.tbl
!helix hydrogen bond restraints
!helix A
assign (resid 10 and name N and segid A)(resid 10 and name HN and segid A) (resid 6 and name O and segid A)
assign (resid 11 and name N and segid A)(resid 11 and name HN and segid A) (resid 7 and name O and segid A)
assign (resid 12 and name N and segid A)(resid 12 and name HN and segid A) (resid 8 and name O and segid A)
assign (resid 13 and name N and segid A)(resid 13 and name HN and segid A) (resid 9 and name O and segid A)
assign (resid 14 and name N and segid A)(resid 14 and name HN and segid A) (resid 10 and name O and segid A)
assign (resid 15 and name N and segid A)(resid 15 and name HN and segid A) (resid 11 and name O and segid A)
assign (resid 16 and name N and segid A)(resid 16 and name HN and segid A) (resid 12 and name O and segid A)
assign (resid 17 and name N and segid A)(resid 17 and name HN and segid A) (resid 13 and name O and segid A)
assign (resid 18 and name N and segid A)(resid 18 and name HN and segid A) (resid 14 and name O and segid A)
assign (resid 19 and name N and segid A)(resid 19 and name HN and segid A) (resid 15 and name O and segid A)
assign (resid 20 and name N and segid A)(resid 20 and name HN and segid A) (resid 16 and name O and segid A)
assign (resid 21 and name N and segid A)(resid 21 and name HN and segid A) (resid 17 and name O and segid A)
assign (resid 22 and name N and segid A)(resid 22 and name HN and segid A) (resid 18 and name O and segid A)
assign (resid 23 and name N and segid A)(resid 23 and name HN and segid A) (resid 19 and name O and segid A)
assign (resid 24 and name N and segid A)(resid 24 and name HN and segid A) (resid 20 and name O and segid A)
assign (resid 25 and name N and segid A)(resid 25 and name HN and segid A) (resid 21 and name O and segid A)
assign (resid 26 and name N and segid A)(resid 26 and name HN and segid A) (resid 22 and name O and segid A)
assign (resid 27 and name N and segid A)(resid 27 and name HN and segid A) (resid 23 and name O and segid A)
assign (resid 28 and name N and segid A)(resid 28 and name HN and segid A) (resid 24 and name O and segid A)

!helix B
assign (resid 10 and name N and segid B)(resid 10 and name HN and segid B) (resid 6 and name O and segid B)
assign (resid 11 and name N and segid B)(resid 11 and name HN and segid B) (resid 7 and name O and segid B)
assign (resid 12 and name N and segid B)(resid 12 and name HN and segid B) (resid 8 and name O and segid B)
assign (resid 13 and name N and segid B)(resid 13 and name HN and segid B) (resid 9 and name O and segid B)
assign (resid 14 and name N and segid B)(resid 14 and name HN and segid B) (resid 10 and name O and segid B)
assign (resid 15 and name N and segid B)(resid 15 and name HN and segid B) (resid 11 and name O and segid B)
assign (resid 16 and name N and segid B)(resid 16 and name HN and segid B) (resid 12 and name O and segid B)
assign (resid 17 and name N and segid B)(resid 17 and name HN and segid B) (resid 13 and name O and segid B)
assign (resid 18 and name N and segid B)(resid 18 and name HN and segid B) (resid 14 and name O and segid B)
assign (resid 19 and name N and segid B)(resid 19 and name HN and segid B) (resid 15 and name O and segid B)
assign (resid 20 and name N and segid B)(resid 20 and name HN and segid B) (resid 16 and name O and segid B)
assign (resid 21 and name N and segid B)(resid 21 and name HN and segid B) (resid 17 and name O and segid B)
assign (resid 22 and name N and segid B)(resid 22 and name HN and segid B) (resid 18 and name O and segid B)
assign (resid 23 and name N and segid B)(resid 23 and name HN and segid B) (resid 19 and name O and segid B)
assign (resid 24 and name N and segid B)(resid 24 and name HN and segid B) (resid 20 and name O and segid B)
assign (resid 25 and name N and segid B)(resid 25 and name HN and segid B) (resid 21 and name O and segid B)
assign (resid 26 and name N and segid B)(resid 26 and name HN and segid B) (resid 22 and name O and segid B)
assign (resid 27 and name N and segid B)(resid 27 and name HN and segid B) (resid 23 and name O and segid B)
assign (resid 28 and name N and segid B)(resid 28 and name HN and segid B) (resid 24 and name O and segid B)

!helix C
assign (resid 10 and name N and segid C)(resid 10 and name HN and segid C) (resid 6 and name O and segid C)
assign (resid 11 and name N and segid C)(resid 11 and name HN and segid C) (resid 7 and name O and segid C)
assign (resid 12 and name N and segid C)(resid 12 and name HN and segid C) (resid 8 and name O and segid C)
assign (resid 13 and name N and segid C)(resid 13 and name HN and segid C) (resid 9 and name O and segid C)
assign (resid 14 and name N and segid C)(resid 14 and name HN and segid C) (resid 10 and name O and segid C)
assign (resid 15 and name N and segid C)(resid 15 and name HN and segid C) (resid 11 and name O and segid C)
assign (resid 16 and name N and segid C)(resid 16 and name HN and segid C) (resid 12 and name O and segid C)
assign (resid 17 and name N and segid C)(resid 17 and name HN and segid C) (resid 13 and name O and segid C)
assign (resid 18 and name N and segid C)(resid 18 and name HN and segid C) (resid 14 and name O and segid C)
assign (resid 19 and name N and segid C)(resid 19 and name HN and segid C) (resid 15 and name O and segid C)
assign (resid 20 and name N and segid C)(resid 20 and name HN and segid C) (resid 16 and name O and segid C)
assign (resid 21 and name N and segid C)(resid 21 and name HN and segid C) (resid 17 and name O and segid C)
assign (resid 22 and name N and segid C)(resid 22 and name HN and segid C) (resid 18 and name O and segid C)
assign (resid 23 and name N and segid C)(resid 23 and name HN and segid C) (resid 19 and name O and segid C)
assign (resid 24 and name N and segid C)(resid 24 and name HN and segid C) (resid 20 and name O and segid C)
assign (resid 25 and name N and segid C)(resid 25 and name HN and segid C) (resid 21 and name O and segid C)
assign (resid 26 and name N and segid C)(resid 26 and name HN and segid C) (resid 22 and name O and segid C)
assign (resid 27 and name N and segid C)(resid 27 and name HN and segid C) (resid 23 and name O and segid C)
assign (resid 28 and name N and segid C)(resid 28 and name HN and segid C) (resid 24 and name O and segid C)

!helix D
assign (resid 10 and name N and segid D)(resid 10 and name HN and segid D) (resid 6 and name O and segid D)
assign (resid 11 and name N and segid D)(resid 11 and name HN and segid D) (resid 7 and name O and segid D)
assign (resid 12 and name N and segid D)(resid 12 and name HN and segid D) (resid 8 and name O and segid D)
assign (resid 13 and name N and segid D)(resid 13 and name HN and segid D) (resid 9 and name O and segid D)
assign (resid 14 and name N and segid D)(resid 14 and name HN and segid D) (resid 10 and name O and segid D)
assign (resid 15 and name N and segid D)(resid 15 and name HN and segid D) (resid 11 and name O and segid D)
assign (resid 16 and name N and segid D)(resid 16 and name HN and segid D) (resid 12 and name O and segid D)
assign (resid 17 and name N and segid D)(resid 17 and name HN and segid D) (resid 13 and name O and segid D)
assign (resid 18 and name N and segid D)(resid 18 and name HN and segid D) (resid 14 and name O and segid D)
assign (resid 19 and name N and segid D)(resid 19 and name HN and segid D) (resid 15 and name O and segid D)
assign (resid 20 and name N and segid D)(resid 20 and name HN and segid D) (resid 16 and name O and segid D)
assign (resid 21 and name N and segid D)(resid 21 and name HN and segid D) (resid 17 and name O and segid D)
assign (resid 22 and name N and segid D)(resid 22 and name HN and segid D) (resid 18 and name O and segid D)
assign (resid 23 and name N and segid D)(resid 23 and name HN and segid D) (resid 19 and name O and segid D)
assign (resid 24 and name N and segid D)(resid 24 and name HN and segid D) (resid 20 and name O and segid D)
assign (resid 25 and name N and segid D)(resid 25 and name HN and segid D) (resid 21 and name O and segid D)
assign (resid 26 and name N and segid D)(resid 26 and name HN and segid D) (resid 22 and name O and segid D)
assign (resid 27 and name N and segid D)(resid 27 and name HN and segid D) (resid 23 and name O and segid D)
assign (resid 28 and name N and segid D)(resid 28 and name HN and segid D) (resid 24 and name O and segid D)
# Restraints file 7: intranoe.tbl
!	NOE restraints for pH 7.5 BM2 from 13C-13C spin diffusion experiments


!==================Contacts from Helix A to Helix A

assign (resid	2 and name	CA and segid	A)	assign (resid	3 and name	CD and segid	A)	5.0	4.0	3.5
assign (resid	2 and name	CB and segid	A)	assign (resid	3 and name	CD and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CA and segid	A)	assign (resid	3 and name	CD and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	A)	assign (resid	3 and name	CD and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	2 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	2 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	3 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	3 and name	CD and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	5 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	5 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	6 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	6 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	7 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	7 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CG and segid	A)	assign (resid	3 and name	CD and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	A)	assign (resid	7 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	A)	assign (resid	7 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	A)	assign (resid	8 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	7 and name	CG2 and segid	A)	assign (resid	8 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	7 and name	CB and segid	A)	assign (resid	5 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	7 and name	CD1 and segid	A)	assign (resid	6 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	8 and name	CA and segid	A)	assign (resid	6 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	A)	assign (resid	6 and name	CG and segid	A)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	A)	assign (resid	9 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	9 and name	CA and segid	A)	assign (resid	7 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	9 and name	CA and segid	A)	assign (resid	8 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	A)	assign (resid	9 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	10 and name	CA and segid	A)	assign (resid	9 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	9 and name	CA and segid	A)	assign (resid	11 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	A)	assign (resid	11 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CB and segid	A)	assign (resid	11 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	A)	assign (resid	11 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	A)	assign (resid	11 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CB and segid	A)	assign (resid	11 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CG1 and segid	A)	assign (resid	9 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CG1 and segid	A)	assign (resid	6 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CD1 and segid	A)	assign (resid	13 and name	CD# and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CD1 and segid	A)	assign (resid	13 and name	CE# and segid	A)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	A)	assign (resid	12 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	11 and name	CB and segid	A)	assign (resid	12 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	12 and name	CA and segid	A)	assign (resid	11 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	13 and name	CB and segid	A)	assign (resid	12 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	A)	assign (resid	15 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	A)	assign (resid	15 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	A)	assign (resid	13 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	A)	assign (resid	15 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	14 and name	CA and segid	A)	assign (resid	15 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	A)	assign (resid	13 and name	CE1 and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	A)	assign (resid	13 and name	CE2 and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CB and segid	A)	assign (resid	17 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	A)	assign (resid	15 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	A)	assign (resid	18 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CA and segid	A)	assign (resid	14 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	A)	assign (resid	16 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	A)	assign (resid	16 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	A)	assign (resid	17 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	A)	assign (resid	17 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	15 and name	CD1 and segid	A)	assign (resid	14 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	A)	assign (resid	14 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	A)	assign (resid	16 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	A)	assign (resid	16 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	A)	assign (resid	14 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	A)	assign (resid	14 and name	CG1 and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	A)	assign (resid	17 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	16 and name	CA and segid	A)	assign (resid	17 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	16 and name	CB and segid	A)	assign (resid	17 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	16 and name	CA and segid	A)	assign (resid	17 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	16 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	14 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	18 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	18 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	18 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	18 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	19 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	A)	assign (resid	18 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	17 and name	CA and segid	A)	assign (resid	18 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	A)	assign (resid	18 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	14 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	A)	assign (resid	20 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	18 and name	CB and segid	A)	assign (resid	17 and name	CB and segid	A)	4.0	3.0	2.5
assign (resid	18 and name	CG and segid	A)	assign (resid	21 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CD1 and segid	A)	assign (resid	21 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	A)	assign (resid	14 and name	CG1 and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	A)	assign (resid	16 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	A)	assign (resid	17 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CB and segid	A)	assign (resid	19 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	20 and name	CA and segid	A)	assign (resid	22 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	20 and name	CB and segid	A)	assign (resid	17 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	A)	assign (resid	22 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	21 and name	CA and segid	A)	assign (resid	19 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	21 and name	CB and segid	A)	assign (resid	20 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	A)	assign (resid	22 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	A)	assign (resid	19 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	23 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	23 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	24 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	21 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	21 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	24 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	A)	assign (resid	22 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	24 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	A)	assign (resid	19 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	23 and name	CH2 and segid	A)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	A)	assign (resid	23 and name	CZ3 and segid	A)	5.0	4.0	7.0
assign (resid	23 and name	CA and segid	A)	assign (resid	24 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	23 and name	CA and segid	A)	assign (resid	24 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	A)	assign (resid	25 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	A)	assign (resid	22 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	23 and name	NE1 and segid	A)	assign (resid	25 and name	C and segid	A)	4.0	3.0	8.0
assign (resid	24 and name	CG2 and segid	A)	assign (resid	21 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	21 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	22 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	23 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	25 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	25 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	28 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	28 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	A)	assign (resid	21 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	22 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	A)	assign (resid	23 and name	CZ3 and segid	A)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	A)	assign (resid	23 and name	CH2 and segid	A)	5.0	4.0	7.0
assign (resid	25 and name	CA and segid	A)	assign (resid	24 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	25 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CG2 and segid	A)	assign (resid	24 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	27 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	27 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	28 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	21 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	21 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	22 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	23 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	25 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	28 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	28 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	27 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CA and segid	A)	assign (resid	24 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	25 and name	CA and segid	A)	assign (resid	24 and name	C and segid	A)	4.0	3.0	3.5
assign (resid	25 and name	CA and segid	A)	assign (resid	24 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	A)	assign (resid	25 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	25 and name	CG2 and segid	A)	assign (resid	24 and name	C and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	A)	assign (resid	28 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	A)	assign (resid	24 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	A)	assign (resid	25 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	26 and name	CA and segid	A)	assign (resid	25 and name	CG2 and segid	A)	4.0	3.0	3.5
assign (resid	25 and name	CG1 and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	25 and name	CG1 and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	A)	assign (resid	27 and name	C and segid	A)	5.0	4.0	3.5
assign (resid	27 and name	CA and segid	A)	assign (resid	26 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	A)	assign (resid	27 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	A)	assign (resid	27 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	A)	assign (resid	27 and name	CE1 and segid	A)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	A)	assign (resid	28 and name	CD1 and segid	A)	4.0	3.0	4.0
assign (resid	26 and name	CA and segid	A)	assign (resid	28 and name	CD2 and segid	A)	4.0	3.0	4.0
assign (resid	26 and name	CA and segid	A)	assign (resid	24 and name	CB and segid	A)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	A)	assign (resid	25 and name	C and segid	A)	4.0	3.0	2.5
assign (resid	27 and name	CB and segid	A)	assign (resid	26 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	28 and name	CB and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	28 and name	CG and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	28 and name	CD# and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5

!==================Contacts from Helix B to Helix B

assign (resid	2 and name	CA and segid	B)	assign (resid	3 and name	CD and segid	B)	5.0	4.0	3.5
assign (resid	2 and name	CB and segid	B)	assign (resid	3 and name	CD and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CA and segid	B)	assign (resid	3 and name	CD and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	B)	assign (resid	3 and name	CD and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	2 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	2 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	3 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	3 and name	CD and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	5 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	5 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	6 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	6 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	7 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	7 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CG and segid	B)	assign (resid	3 and name	CD and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	B)	assign (resid	7 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	B)	assign (resid	7 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	B)	assign (resid	8 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	7 and name	CG2 and segid	B)	assign (resid	8 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	7 and name	CB and segid	B)	assign (resid	5 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	7 and name	CD1 and segid	B)	assign (resid	6 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	8 and name	CA and segid	B)	assign (resid	6 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	B)	assign (resid	6 and name	CG and segid	B)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	B)	assign (resid	9 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	9 and name	CA and segid	B)	assign (resid	7 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	9 and name	CA and segid	B)	assign (resid	8 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	B)	assign (resid	9 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	10 and name	CA and segid	B)	assign (resid	9 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	9 and name	CA and segid	B)	assign (resid	11 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	B)	assign (resid	11 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CB and segid	B)	assign (resid	11 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	B)	assign (resid	11 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	B)	assign (resid	11 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CB and segid	B)	assign (resid	11 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CG1 and segid	B)	assign (resid	9 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CG1 and segid	B)	assign (resid	6 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CD1 and segid	B)	assign (resid	13 and name	CD# and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CD1 and segid	B)	assign (resid	13 and name	CE# and segid	B)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	B)	assign (resid	12 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	11 and name	CB and segid	B)	assign (resid	12 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	12 and name	CA and segid	B)	assign (resid	11 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	13 and name	CB and segid	B)	assign (resid	12 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	B)	assign (resid	15 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	B)	assign (resid	15 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	B)	assign (resid	13 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	B)	assign (resid	15 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	14 and name	CA and segid	B)	assign (resid	15 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	B)	assign (resid	13 and name	CE1 and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	B)	assign (resid	13 and name	CE2 and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CB and segid	B)	assign (resid	17 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	B)	assign (resid	15 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	B)	assign (resid	18 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CA and segid	B)	assign (resid	14 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	B)	assign (resid	16 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	B)	assign (resid	16 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	B)	assign (resid	17 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	B)	assign (resid	17 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	15 and name	CD1 and segid	B)	assign (resid	14 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	B)	assign (resid	14 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	B)	assign (resid	16 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	B)	assign (resid	16 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	B)	assign (resid	14 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	B)	assign (resid	14 and name	CG1 and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	B)	assign (resid	17 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	16 and name	CA and segid	B)	assign (resid	17 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	16 and name	CB and segid	B)	assign (resid	17 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	16 and name	CA and segid	B)	assign (resid	17 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	16 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	14 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	18 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	18 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	18 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	18 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	19 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	B)	assign (resid	18 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	17 and name	CA and segid	B)	assign (resid	18 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	B)	assign (resid	18 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	14 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	B)	assign (resid	20 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	18 and name	CB and segid	B)	assign (resid	17 and name	CB and segid	B)	4.0	3.0	2.5
assign (resid	18 and name	CG and segid	B)	assign (resid	21 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CD1 and segid	B)	assign (resid	21 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	B)	assign (resid	14 and name	CG1 and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	B)	assign (resid	16 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	B)	assign (resid	17 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CB and segid	B)	assign (resid	19 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	20 and name	CA and segid	B)	assign (resid	22 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	20 and name	CB and segid	B)	assign (resid	17 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	B)	assign (resid	22 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	21 and name	CA and segid	B)	assign (resid	19 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	21 and name	CB and segid	B)	assign (resid	20 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	B)	assign (resid	22 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	B)	assign (resid	19 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	23 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	23 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	24 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	21 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	21 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	24 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	B)	assign (resid	22 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	24 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	B)	assign (resid	19 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	23 and name	CH2 and segid	B)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	B)	assign (resid	23 and name	CZ3 and segid	B)	5.0	4.0	7.0
assign (resid	23 and name	CA and segid	B)	assign (resid	24 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	23 and name	CA and segid	B)	assign (resid	24 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	B)	assign (resid	25 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	B)	assign (resid	22 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	23 and name	NE1 and segid	B)	assign (resid	25 and name	C and segid	B)	4.0	3.0	8.0
assign (resid	24 and name	CG2 and segid	B)	assign (resid	21 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	21 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	22 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	23 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	25 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	25 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	28 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	28 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	B)	assign (resid	21 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	22 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	B)	assign (resid	23 and name	CZ3 and segid	B)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	B)	assign (resid	23 and name	CH2 and segid	B)	5.0	4.0	7.0
assign (resid	25 and name	CA and segid	B)	assign (resid	24 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	25 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CG2 and segid	B)	assign (resid	24 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	27 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	27 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	28 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	21 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	21 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	22 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	23 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	25 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	28 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	28 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	27 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CA and segid	B)	assign (resid	24 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	25 and name	CA and segid	B)	assign (resid	24 and name	C and segid	B)	4.0	3.0	3.5
assign (resid	25 and name	CA and segid	B)	assign (resid	24 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	B)	assign (resid	25 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	25 and name	CG2 and segid	B)	assign (resid	24 and name	C and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	B)	assign (resid	28 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	B)	assign (resid	24 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	B)	assign (resid	25 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	26 and name	CA and segid	B)	assign (resid	25 and name	CG2 and segid	B)	4.0	3.0	3.5
assign (resid	25 and name	CG1 and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	25 and name	CG1 and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	B)	assign (resid	27 and name	C and segid	B)	5.0	4.0	3.5
assign (resid	27 and name	CA and segid	B)	assign (resid	26 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	B)	assign (resid	27 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	B)	assign (resid	27 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	B)	assign (resid	27 and name	CE1 and segid	B)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	B)	assign (resid	28 and name	CD1 and segid	B)	4.0	3.0	4.0
assign (resid	26 and name	CA and segid	B)	assign (resid	28 and name	CD2 and segid	B)	4.0	3.0	4.0
assign (resid	26 and name	CA and segid	B)	assign (resid	24 and name	CB and segid	B)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	B)	assign (resid	25 and name	C and segid	B)	4.0	3.0	2.5
assign (resid	27 and name	CB and segid	B)	assign (resid	26 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	28 and name	CB and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	28 and name	CG and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	28 and name	CD# and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5

!==================Contacts from Helix C to Helix C

assign (resid	2 and name	CA and segid	C)	assign (resid	3 and name	CD and segid	C)	5.0	4.0	3.5
assign (resid	2 and name	CB and segid	C)	assign (resid	3 and name	CD and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CA and segid	C)	assign (resid	3 and name	CD and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	C)	assign (resid	3 and name	CD and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	2 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	2 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	3 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	3 and name	CD and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	5 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	5 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	6 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	6 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	7 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	7 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CG and segid	C)	assign (resid	3 and name	CD and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	C)	assign (resid	7 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	C)	assign (resid	7 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	C)	assign (resid	8 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	7 and name	CG2 and segid	C)	assign (resid	8 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	7 and name	CB and segid	C)	assign (resid	5 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	7 and name	CD1 and segid	C)	assign (resid	6 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	8 and name	CA and segid	C)	assign (resid	6 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	C)	assign (resid	6 and name	CG and segid	C)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	C)	assign (resid	9 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	9 and name	CA and segid	C)	assign (resid	7 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	9 and name	CA and segid	C)	assign (resid	8 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	C)	assign (resid	9 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	10 and name	CA and segid	C)	assign (resid	9 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	9 and name	CA and segid	C)	assign (resid	11 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	C)	assign (resid	11 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CB and segid	C)	assign (resid	11 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	C)	assign (resid	11 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	C)	assign (resid	11 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CB and segid	C)	assign (resid	11 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CG1 and segid	C)	assign (resid	9 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CG1 and segid	C)	assign (resid	6 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CD1 and segid	C)	assign (resid	13 and name	CD# and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CD1 and segid	C)	assign (resid	13 and name	CE# and segid	C)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	C)	assign (resid	12 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	11 and name	CB and segid	C)	assign (resid	12 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	12 and name	CA and segid	C)	assign (resid	11 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	13 and name	CB and segid	C)	assign (resid	12 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	C)	assign (resid	15 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	C)	assign (resid	15 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	C)	assign (resid	13 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	C)	assign (resid	15 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	14 and name	CA and segid	C)	assign (resid	15 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	C)	assign (resid	13 and name	CE1 and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	C)	assign (resid	13 and name	CE2 and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CB and segid	C)	assign (resid	17 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	C)	assign (resid	15 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	C)	assign (resid	18 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CA and segid	C)	assign (resid	14 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	C)	assign (resid	16 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	C)	assign (resid	16 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	C)	assign (resid	17 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	C)	assign (resid	17 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	15 and name	CD1 and segid	C)	assign (resid	14 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	C)	assign (resid	14 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	C)	assign (resid	16 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	C)	assign (resid	16 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	C)	assign (resid	14 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	C)	assign (resid	14 and name	CG1 and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	C)	assign (resid	17 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	16 and name	CA and segid	C)	assign (resid	17 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	16 and name	CB and segid	C)	assign (resid	17 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	16 and name	CA and segid	C)	assign (resid	17 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	16 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	14 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	18 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	18 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	18 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	18 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	19 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	C)	assign (resid	18 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	17 and name	CA and segid	C)	assign (resid	18 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	C)	assign (resid	18 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	14 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	C)	assign (resid	20 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	18 and name	CB and segid	C)	assign (resid	17 and name	CB and segid	C)	4.0	3.0	2.5
assign (resid	18 and name	CG and segid	C)	assign (resid	21 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CD1 and segid	C)	assign (resid	21 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	C)	assign (resid	14 and name	CG1 and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	C)	assign (resid	16 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	C)	assign (resid	17 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CB and segid	C)	assign (resid	19 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	20 and name	CA and segid	C)	assign (resid	22 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	20 and name	CB and segid	C)	assign (resid	17 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	C)	assign (resid	22 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	21 and name	CA and segid	C)	assign (resid	19 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	21 and name	CB and segid	C)	assign (resid	20 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	C)	assign (resid	22 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	C)	assign (resid	19 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	23 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	23 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	24 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	21 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	21 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	24 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	C)	assign (resid	22 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	24 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	C)	assign (resid	19 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	23 and name	CH2 and segid	C)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	C)	assign (resid	23 and name	CZ3 and segid	C)	5.0	4.0	7.0
assign (resid	23 and name	CA and segid	C)	assign (resid	24 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	23 and name	CA and segid	C)	assign (resid	24 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	C)	assign (resid	25 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	C)	assign (resid	22 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	23 and name	NE1 and segid	C)	assign (resid	25 and name	C and segid	C)	4.0	3.0	8.0
assign (resid	24 and name	CG2 and segid	C)	assign (resid	21 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	21 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	22 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	23 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	25 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	25 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	28 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	28 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	C)	assign (resid	21 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	22 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	C)	assign (resid	23 and name	CZ3 and segid	C)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	C)	assign (resid	23 and name	CH2 and segid	C)	5.0	4.0	7.0
assign (resid	25 and name	CA and segid	C)	assign (resid	24 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	25 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CG2 and segid	C)	assign (resid	24 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	27 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	27 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	28 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	21 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	21 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	22 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	23 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	25 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	28 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	28 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	27 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CA and segid	C)	assign (resid	24 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	25 and name	CA and segid	C)	assign (resid	24 and name	C and segid	C)	4.0	3.0	3.5
assign (resid	25 and name	CA and segid	C)	assign (resid	24 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	C)	assign (resid	25 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	25 and name	CG2 and segid	C)	assign (resid	24 and name	C and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	C)	assign (resid	28 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	C)	assign (resid	24 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	C)	assign (resid	25 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	26 and name	CA and segid	C)	assign (resid	25 and name	CG2 and segid	C)	4.0	3.0	3.5
assign (resid	25 and name	CG1 and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	25 and name	CG1 and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	C)	assign (resid	27 and name	C and segid	C)	5.0	4.0	3.5
assign (resid	27 and name	CA and segid	C)	assign (resid	26 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	C)	assign (resid	27 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	C)	assign (resid	27 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	C)	assign (resid	27 and name	CE1 and segid	C)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	C)	assign (resid	28 and name	CD1 and segid	C)	4.0	3.0	4.0
assign (resid	26 and name	CA and segid	C)	assign (resid	28 and name	CD2 and segid	C)	4.0	3.0	4.0
assign (resid	26 and name	CA and segid	C)	assign (resid	24 and name	CB and segid	C)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	C)	assign (resid	25 and name	C and segid	C)	4.0	3.0	2.5
assign (resid	27 and name	CB and segid	C)	assign (resid	26 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	28 and name	CB and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	28 and name	CG and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	28 and name	CD# and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5

!==================Contacts from Helix D to Helix D

assign (resid	2 and name	CA and segid	D)	assign (resid	3 and name	CD and segid	D)	5.0	4.0	3.5
assign (resid	2 and name	CB and segid	D)	assign (resid	3 and name	CD and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CA and segid	D)	assign (resid	3 and name	CD and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	D)	assign (resid	3 and name	CD and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	2 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	2 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	3 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	3 and name	CD and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	5 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	5 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	6 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	6 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	7 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	7 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CG and segid	D)	assign (resid	3 and name	CD and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	D)	assign (resid	7 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CB and segid	D)	assign (resid	7 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	D)	assign (resid	8 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	7 and name	CG2 and segid	D)	assign (resid	8 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	7 and name	CB and segid	D)	assign (resid	5 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	7 and name	CD1 and segid	D)	assign (resid	6 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	8 and name	CA and segid	D)	assign (resid	6 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	D)	assign (resid	6 and name	CG and segid	D)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	D)	assign (resid	9 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	9 and name	CA and segid	D)	assign (resid	7 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	9 and name	CA and segid	D)	assign (resid	8 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	D)	assign (resid	9 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	10 and name	CA and segid	D)	assign (resid	9 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	9 and name	CA and segid	D)	assign (resid	11 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	D)	assign (resid	11 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CB and segid	D)	assign (resid	11 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	D)	assign (resid	11 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CG2 and segid	D)	assign (resid	11 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CB and segid	D)	assign (resid	11 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CG1 and segid	D)	assign (resid	9 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CG1 and segid	D)	assign (resid	6 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CD1 and segid	D)	assign (resid	13 and name	CD# and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CD1 and segid	D)	assign (resid	13 and name	CE# and segid	D)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	D)	assign (resid	12 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	11 and name	CB and segid	D)	assign (resid	12 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	12 and name	CA and segid	D)	assign (resid	11 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	13 and name	CB and segid	D)	assign (resid	12 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	D)	assign (resid	15 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	D)	assign (resid	15 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	D)	assign (resid	13 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	D)	assign (resid	15 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	14 and name	CA and segid	D)	assign (resid	15 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	D)	assign (resid	13 and name	CE1 and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	D)	assign (resid	13 and name	CE2 and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CB and segid	D)	assign (resid	17 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	D)	assign (resid	15 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	D)	assign (resid	18 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CA and segid	D)	assign (resid	14 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	D)	assign (resid	16 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	D)	assign (resid	16 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	D)	assign (resid	17 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	D)	assign (resid	17 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	15 and name	CD1 and segid	D)	assign (resid	14 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	D)	assign (resid	14 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	D)	assign (resid	16 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CD1 and segid	D)	assign (resid	16 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	D)	assign (resid	14 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	D)	assign (resid	14 and name	CG1 and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CD2 and segid	D)	assign (resid	17 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	16 and name	CA and segid	D)	assign (resid	17 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	16 and name	CB and segid	D)	assign (resid	17 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	16 and name	CA and segid	D)	assign (resid	17 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	16 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	14 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	18 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	18 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	18 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	18 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	19 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	D)	assign (resid	18 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	17 and name	CA and segid	D)	assign (resid	18 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	D)	assign (resid	18 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	14 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	D)	assign (resid	20 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	18 and name	CB and segid	D)	assign (resid	17 and name	CB and segid	D)	4.0	3.0	2.5
assign (resid	18 and name	CG and segid	D)	assign (resid	21 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CD1 and segid	D)	assign (resid	21 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	D)	assign (resid	14 and name	CG1 and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	D)	assign (resid	16 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	D)	assign (resid	17 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CB and segid	D)	assign (resid	19 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	20 and name	CA and segid	D)	assign (resid	22 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	20 and name	CB and segid	D)	assign (resid	17 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	D)	assign (resid	22 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	21 and name	CA and segid	D)	assign (resid	19 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	21 and name	CB and segid	D)	assign (resid	20 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	D)	assign (resid	22 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	D)	assign (resid	19 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	23 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	23 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	24 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	21 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	21 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	24 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	D)	assign (resid	22 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	24 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	D)	assign (resid	19 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	23 and name	CH2 and segid	D)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	D)	assign (resid	23 and name	CZ3 and segid	D)	5.0	4.0	7.0
assign (resid	23 and name	CA and segid	D)	assign (resid	24 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	23 and name	CA and segid	D)	assign (resid	24 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	D)	assign (resid	25 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	D)	assign (resid	22 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	23 and name	NE1 and segid	D)	assign (resid	25 and name	C and segid	D)	4.0	3.0	8.0
assign (resid	24 and name	CG2 and segid	D)	assign (resid	21 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	21 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	22 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	23 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	25 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	25 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	28 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	28 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	D)	assign (resid	21 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	22 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	D)	assign (resid	23 and name	CZ3 and segid	D)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	D)	assign (resid	23 and name	CH2 and segid	D)	5.0	4.0	7.0
assign (resid	25 and name	CA and segid	D)	assign (resid	24 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	25 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CG2 and segid	D)	assign (resid	24 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	27 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	27 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	28 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	21 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	21 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	22 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	23 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	25 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	28 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	28 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	27 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CA and segid	D)	assign (resid	24 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	25 and name	CA and segid	D)	assign (resid	24 and name	C and segid	D)	4.0	3.0	3.5
assign (resid	25 and name	CA and segid	D)	assign (resid	24 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	D)	assign (resid	25 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	25 and name	CG2 and segid	D)	assign (resid	24 and name	C and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	D)	assign (resid	28 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	D)	assign (resid	24 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	D)	assign (resid	25 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	26 and name	CA and segid	D)	assign (resid	25 and name	CG2 and segid	D)	4.0	3.0	3.5
assign (resid	25 and name	CG1 and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	25 and name	CG1 and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	D)	assign (resid	27 and name	C and segid	D)	5.0	4.0	3.5
assign (resid	27 and name	CA and segid	D)	assign (resid	26 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	D)	assign (resid	27 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	D)	assign (resid	27 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	D)	assign (resid	27 and name	CE1 and segid	D)	5.0	4.0	3.5
assign (resid	26 and name	CA and segid	D)	assign (resid	28 and name	CD1 and segid	D)	4.0	3.0	4.0
assign (resid	26 and name	CA and segid	D)	assign (resid	28 and name	CD2 and segid	D)	4.0	3.0	4.0
assign (resid	26 and name	CA and segid	D)	assign (resid	24 and name	CB and segid	D)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	D)	assign (resid	25 and name	C and segid	D)	4.0	3.0	2.5
assign (resid	27 and name	CB and segid	D)	assign (resid	26 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	28 and name	CB and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	28 and name	CG and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	28 and name	CD# and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
# Restraints file 8: rdc_all.tbl
!orientation restraints from uniaxial-rotation averaged NH DIpolar Couplings

!=======================helix A
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   and segid A)
       ( resid 6    and name HN  and segid A)  8.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name N   and segid A)
       ( resid 7    and name HN  and segid A)  7.2  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   and segid A)
       ( resid 8    and name HN  and segid A)  8.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   and segid A)
       ( resid 9    and name HN  and segid A)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   and segid A)
       ( resid 10   and name HN  and segid A)  7.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   and segid A)
       ( resid 11   and name HN  and segid A) 7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   and segid A)
       ( resid 12   and name HN  and segid A)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   and segid A)
       ( resid 13   and name HN  and segid A)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   and segid A)
       ( resid 14   and name HN  and segid A)  6.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   and segid A)
       ( resid 15   and name HN  and segid A)  8.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   and segid A)
       ( resid 16   and name HN  and segid A)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   and segid A)
       ( resid 17   and name HN  and segid A)  7.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   and segid A)
       ( resid 18   and name HN  and segid A)  6.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   and segid A)
       ( resid 19   and name HN  and segid A)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   and segid A)
       ( resid 20   and name HN  and segid A)  9.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   and segid A)
       ( resid 21   and name HN  and segid A)  7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   and segid A)
       ( resid 22   and name HN  and segid A)  7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23   and name N   and segid A)
       ( resid 23   and name HN  and segid A)  10.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24   and name N   and segid A)
       ( resid 24   and name HN  and segid A)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   and segid A)
       ( resid 25   and name HN  and segid A)  7.2  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26   and name N   and segid A)
       ( resid 26   and name HN  and segid A)  10.1  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   and segid A)
       ( resid 27   and name HN  and segid A)  10.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   and segid A)
       ( resid 28   and name HN  and segid A)  7.7  0.5  0.5


!=======================helix B
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   and segid B)
       ( resid 6    and name HN  and segid B)  8.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name N   and segid B)
       ( resid 7    and name HN  and segid B)  7.2  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   and segid B)
       ( resid 8    and name HN  and segid B)  8.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   and segid B)
       ( resid 9    and name HN  and segid B)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   and segid B)
       ( resid 10   and name HN  and segid B)  7.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   and segid B)
       ( resid 11   and name HN  and segid B) 7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   and segid B)
       ( resid 12   and name HN  and segid B)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   and segid B)
       ( resid 13   and name HN  and segid B)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   and segid B)
       ( resid 14   and name HN  and segid B)  6.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   and segid B)
       ( resid 15   and name HN  and segid B)  8.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   and segid B)
       ( resid 16   and name HN  and segid B)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   and segid B)
       ( resid 17   and name HN  and segid B)  7.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   and segid B)
       ( resid 18   and name HN  and segid B)  6.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   and segid B)
       ( resid 19   and name HN  and segid B)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   and segid B)
       ( resid 20   and name HN  and segid B)  9.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   and segid B)
       ( resid 21   and name HN  and segid B)  7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   and segid B)
       ( resid 22   and name HN  and segid B)  7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23   and name N   and segid B)
       ( resid 23   and name HN  and segid B)  10.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24   and name N   and segid B)
       ( resid 24   and name HN  and segid B)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   and segid B)
       ( resid 25   and name HN  and segid B)  7.2  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26   and name N   and segid B)
       ( resid 26   and name HN  and segid B)  10.1  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   and segid B)
       ( resid 27   and name HN  and segid B)  10.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   and segid B)
       ( resid 28   and name HN  and segid B)  7.7  0.5  0.5

!=======================helix C
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   and segid C)
       ( resid 6    and name HN  and segid C)  8.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name N   and segid C)
       ( resid 7    and name HN  and segid C)  7.2  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   and segid C)
       ( resid 8    and name HN  and segid C)  8.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   and segid C)
       ( resid 9    and name HN  and segid C)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   and segid C)
       ( resid 10   and name HN  and segid C)  7.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   and segid C)
       ( resid 11   and name HN  and segid C) 7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   and segid C)
       ( resid 12   and name HN  and segid C)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   and segid C)
       ( resid 13   and name HN  and segid C)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   and segid C)
       ( resid 14   and name HN  and segid C)  6.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   and segid C)
       ( resid 15   and name HN  and segid C)  8.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   and segid C)
       ( resid 16   and name HN  and segid C)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   and segid C)
       ( resid 17   and name HN  and segid C)  7.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   and segid C)
       ( resid 18   and name HN  and segid C)  6.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   and segid C)
       ( resid 19   and name HN  and segid C)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   and segid C)
       ( resid 20   and name HN  and segid C)  9.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   and segid C)
       ( resid 21   and name HN  and segid C)  7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   and segid C)
       ( resid 22   and name HN  and segid C)  7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23   and name N   and segid C)
       ( resid 23   and name HN  and segid C)  10.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24   and name N   and segid C)
       ( resid 24   and name HN  and segid C)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   and segid C)
       ( resid 25   and name HN  and segid C)  7.2  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26   and name N   and segid C)
       ( resid 26   and name HN  and segid C)  10.1  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   and segid C)
       ( resid 27   and name HN  and segid C)  10.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   and segid C)
       ( resid 28   and name HN  and segid C)  7.7  0.5  0.5

!=======================helix D
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   and segid D)
       ( resid 6    and name HN  and segid D)  8.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name N   and segid D)
       ( resid 7    and name HN  and segid D)  7.2  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   and segid D)
       ( resid 8    and name HN  and segid D)  8.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   and segid D)
       ( resid 9    and name HN  and segid D)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   and segid D)
       ( resid 10   and name HN  and segid D)  7.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   and segid D)
       ( resid 11   and name HN  and segid D) 7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   and segid D)
       ( resid 12   and name HN  and segid D)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   and segid D)
       ( resid 13   and name HN  and segid D)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   and segid D)
       ( resid 14   and name HN  and segid D)  6.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   and segid D)
       ( resid 15   and name HN  and segid D)  8.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   and segid D)
       ( resid 16   and name HN  and segid D)  9.2  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   and segid D)
       ( resid 17   and name HN  and segid D)  7.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   and segid D)
       ( resid 18   and name HN  and segid D)  6.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   and segid D)
       ( resid 19   and name HN  and segid D)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   and segid D)
       ( resid 20   and name HN  and segid D)  9.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   and segid D)
       ( resid 21   and name HN  and segid D)  7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   and segid D)
       ( resid 22   and name HN  and segid D)  7.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23   and name N   and segid D)
       ( resid 23   and name HN  and segid D)  10.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24   and name N   and segid D)
       ( resid 24   and name HN  and segid D)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   and segid D)
       ( resid 25   and name HN  and segid D)  7.2  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26   and name N   and segid D)
       ( resid 26   and name HN  and segid D)  10.1  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   and segid D)
       ( resid 27   and name HN  and segid D)  10.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   and segid D)
       ( resid 28   and name HN  and segid D)  7.7  0.5  0.5
# Restraints file 9: D_1000243168_mr_P1.xplor-nih.V1
!!  Intermolecular NOEs for BM2

!!  NOE  distances  obtained  from  13C-19F REDOR and 19F-19F CODEX               
!!  numbers  specify:  distance,  lower error,  upper error         

! F20-X contacts
!=====================================================================A-B
assign (resid   20 and name   HZ and segid A)   (resid  16 and name  CB and segid B)    6.2  1.5  3.0
assign (resid   20 and name   HZ and segid A)   (resid  18 and name  CD2 and segid B)   6.3  1.0  1.0
assign (resid   20 and name   HZ and segid A)   (resid  18 and (name  CG or name CD1) and segid B)    5.1  1.0  1.0
assign (resid   20 and name   HZ and segid A)   (resid  18 and name  CB and segid B)    4.9  1.0  1.0
assign (resid   20 and name   HZ and segid A)   (resid  18 and name  CA and segid B)    5.0  1.5  1.0
assign (resid   20 and name   HZ and segid A)   (resid  19 and name  CA and segid B)    5.2  1.2  1.2
assign (resid   20 and name   HZ and segid A)   (resid  19 and name  CD2 and segid B)   6.0  1.0  1.0
assign (resid   20 and name   HZ and segid A)   (resid  21 and name  CA and segid B)    6.2  2.1  3.3
assign (resid   20 and name   HZ and segid A)   (resid  21 and name  CB and segid B)    6.1  1.0  1.0
assign (resid   20 and name   HZ and segid A)   (resid  22 and name  CA and segid B)    5.8  1.8  2.1
assign (resid   20 and name   HZ and segid A)   (resid  22 and name  CB and segid B)    5.9  1.0  1.0
assign (resid   20 and name   HZ and segid A)   (resid  23 and name  CG and segid B)    6.0  1.0  1.8
assign (resid   20 and name   HZ and segid A)   (resid  23 and name  CE3 and segid B)   16.4 9.0 10.0
assign (resid   20 and name   HZ and segid A)   (resid  23 and name  CH2 and segid B)   16.4 9.0 10.0
assign (resid   20 and name   HZ and segid A)   (resid  23 and name  CZ3 and segid B)   16.4 9.0 10.0
!=====================================================================B-C
assign (resid   20 and name   HZ and segid B)   (resid  16 and name  CB and segid C)    6.2  1.5  3.0
assign (resid   20 and name   HZ and segid B)   (resid  18 and name  CD2 and segid C)   6.3  1.0  1.0
assign (resid   20 and name   HZ and segid B)   (resid  18 and (name  CG or name CD1) and segid C)    5.1  1.0  1.0
assign (resid   20 and name   HZ and segid B)   (resid  18 and name  CB and segid C)    4.9  1.0  1.0
assign (resid   20 and name   HZ and segid B)   (resid  18 and name  CA and segid C)    5.0  1.5  1.0
assign (resid   20 and name   HZ and segid B)   (resid  19 and name  CA and segid C)    5.2  1.2  1.2
assign (resid   20 and name   HZ and segid B)   (resid  19 and name  CD2 and segid C)   6.0  1.0  1.0
assign (resid   20 and name   HZ and segid B)   (resid  21 and name  CA and segid C)    6.2  2.1  3.3
assign (resid   20 and name   HZ and segid B)   (resid  21 and name  CB and segid C)    6.1  1.0  1.0
assign (resid   20 and name   HZ and segid B)   (resid  22 and name  CA and segid C)    5.8  1.8  2.1
assign (resid   20 and name   HZ and segid B)   (resid  22 and name  CB and segid C)    5.9  1.0  1.0
assign (resid   20 and name   HZ and segid B)   (resid  23 and name  CG and segid C)    6.0  1.0  1.8
assign (resid   20 and name   HZ and segid B)   (resid  23 and name  CE3 and segid C)   16.4 9.0 10.0
assign (resid   20 and name   HZ and segid B)   (resid  23 and name  CH2 and segid C)   16.4 9.0 10.0
assign (resid   20 and name   HZ and segid B)   (resid  23 and name  CZ3 and segid C)   16.4 9.0 10.0
!=====================================================================C-D
assign (resid   20 and name   HZ and segid C)   (resid  16 and name  CB and segid D)    6.2  1.5  3.0
assign (resid   20 and name   HZ and segid C)   (resid  18 and name  CD2 and segid D)   6.3  1.0  1.0
assign (resid   20 and name   HZ and segid C)   (resid  18 and (name  CG or name CD1) and segid D)    5.1  1.0  1.0
assign (resid   20 and name   HZ and segid C)   (resid  18 and name  CB and segid D)    4.9  1.0  1.0
assign (resid   20 and name   HZ and segid C)   (resid  18 and name  CA and segid D)    5.0  1.5  1.0
assign (resid   20 and name   HZ and segid C)   (resid  19 and name  CA and segid D)    5.2  1.2  1.2
assign (resid   20 and name   HZ and segid C)   (resid  19 and name  CD2 and segid D)   6.0  1.0  1.0
assign (resid   20 and name   HZ and segid C)   (resid  21 and name  CA and segid D)    6.2  2.1  3.3
assign (resid   20 and name   HZ and segid C)   (resid  21 and name  CB and segid D)    6.1  1.0  1.0
assign (resid   20 and name   HZ and segid C)   (resid  22 and name  CA and segid D)    5.8  1.8  2.1
assign (resid   20 and name   HZ and segid C)   (resid  22 and name  CB and segid D)    5.9  1.0  1.0
assign (resid   20 and name   HZ and segid C)   (resid  23 and name  CG and segid D)    6.0  1.0  1.8
assign (resid   20 and name   HZ and segid C)   (resid  23 and name  CE3 and segid D)   16.4 9.0 10.0
assign (resid   20 and name   HZ and segid C)   (resid  23 and name  CH2 and segid D)   16.4 9.0 10.0
assign (resid   20 and name   HZ and segid C)   (resid  23 and name  CZ3 and segid D)   16.4 9.0 10.0
!=====================================================================D-A
assign (resid   20 and name   HZ and segid D)   (resid  16 and name  CB and segid A)    6.2  1.5  3.0
assign (resid   20 and name   HZ and segid D)   (resid  18 and name  CD2 and segid A)   6.3  1.0  1.0
assign (resid   20 and name   HZ and segid D)   (resid  18 and (name  CG or name CD1) and segid A)    5.1  1.0  1.0
assign (resid   20 and name   HZ and segid D)   (resid  18 and name  CB and segid A)    4.9  1.0  1.0
assign (resid   20 and name   HZ and segid D)   (resid  18 and name  CA and segid A)    5.0  1.5  1.0
assign (resid   20 and name   HZ and segid D)   (resid  19 and name  CA and segid A)    5.2  1.2  1.2
assign (resid   20 and name   HZ and segid D)   (resid  19 and name  CD2 and segid A)   6.0  1.0  1.0
assign (resid   20 and name   HZ and segid D)   (resid  21 and name  CA and segid A)    6.2  2.1  3.3
assign (resid   20 and name   HZ and segid D)   (resid  21 and name  CB and segid A)    6.1  1.0  1.0
assign (resid   20 and name   HZ and segid D)   (resid  22 and name  CA and segid A)    5.8  1.8  2.1
assign (resid   20 and name   HZ and segid D)   (resid  22 and name  CB and segid A)    5.9  1.0  1.0
assign (resid   20 and name   HZ and segid D)   (resid  23 and name  CG and segid A)    6.0  1.0  1.8
assign (resid   20 and name   HZ and segid D)   (resid  23 and name  CE3 and segid A)   16.4 9.0 10.0
assign (resid   20 and name   HZ and segid D)   (resid  23 and name  CH2 and segid A)   16.4 9.0 10.0
assign (resid   20 and name   HZ and segid D)   (resid  23 and name  CZ3 and segid A)   16.4 9.0 10.0


! F5-X contacts
!=====================================================================A-B
assign (resid   5 and name   HZ and segid A)   (resid  4 and name  CA and  segid B)    5.6  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  4 and name  CD and  segid B)    5.9  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CD1 and segid B)   4.1  3.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CG2 and segid B)   5.4  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CG1 and segid B)   5.1  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CB and  segid B)    5.4  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CA and  segid B)    5.5  5.0  4.2
!=====================================================================B-C
assign (resid   5 and name   HZ and segid B)   (resid  4 and name  CA and  segid C)    5.6  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  4 and name  CD and  segid C)    5.9  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CD1 and segid C)   4.1  3.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CG2 and segid C)   5.4  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CG1 and segid C)   5.1  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CB and  segid C)    5.4  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CA and  segid C)    5.5  5.0  4.2
!=====================================================================C-D
assign (resid   5 and name   HZ and segid C)   (resid  4 and name  CA and  segid D)    5.6  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  4 and name  CD and  segid D)    5.9  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CD1 and segid D)   4.1  3.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CG2 and segid D)   5.4  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CG1 and segid D)   5.1  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CB and  segid D)    5.4  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CA and  segid D)    5.5  5.0  4.2
!=====================================================================D-A
assign (resid   5 and name   HZ and segid D)   (resid  4 and name  CA and  segid A)    5.6  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  4 and name  CD and  segid A)    5.9  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CD1 and segid A)   4.1  3.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CG2 and segid A)   5.4  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CG1 and segid A)   5.1  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CB and  segid A)    5.4  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CA and  segid A)    5.5  5.0  4.2


! CODEX restraints
!=====================================================================W23
assign (resid  23 and name  HZ3 and segid A)   (resid  23 and name  HZ3 and segid B)    9.5  1.0  1.0
assign (resid  23 and name  HZ3 and segid A)   (resid  23 and name  HZ3 and segid C)   13.4  1.0  1.0
assign (resid  23 and name  HZ3 and segid B)   (resid  23 and name  HZ3 and segid C)    9.5  1.0  1.0
assign (resid  23 and name  HZ3 and segid B)   (resid  23 and name  HZ3 and segid D)   13.4  1.0  1.0
assign (resid  23 and name  HZ3 and segid C)   (resid  23 and name  HZ3 and segid D)    9.5  1.0  1.0
assign (resid  23 and name  HZ3 and segid D)   (resid  23 and name  HZ3 and segid A)    9.5  1.0  1.0
!=====================================================================F5
assign (resid   5 and name   HZ and segid A)   (resid   5 and name   HZ and segid B)    9.4  2.0  5.0
assign (resid   5 and name   HZ and segid B)   (resid   5 and name   HZ and segid C)    9.4  2.0  5.0
assign (resid   5 and name   HZ and segid C)   (resid   5 and name   HZ and segid D)    9.4  2.0  5.0
assign (resid   5 and name   HZ and segid D)   (resid   5 and name   HZ and segid A)    9.4  2.0  5.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1   5.631  14.326  -2.391
    2    H2   MET   1           HT2      MET   1   4.013  14.351  -1.873
    3    H3   MET   1           HT3      MET   1   5.036  13.074  -1.412
    4    HA   MET   1           HA       MET   1   6.346  14.499  -0.048
    5    HB2  MET   1           HB2      MET   1   5.033  16.518  -1.702
    6    HB3  MET   1           HB1      MET   1   4.986  16.927   0.012
    7    HG2  MET   1           HG2      MET   1   7.436  16.522   0.151
    8    HG3  MET   1           HG1      MET   1   7.460  16.203  -1.583
    9    HE1  MET   1           HE1      MET   1   7.546  17.656  -3.306
   10    HE2  MET   1           HE2      MET   1   7.196  19.382  -3.355
   11    HE3  MET   1           HE3      MET   1   5.878  18.229  -3.165
   12    H    PHE   2           HN       PHE   2   3.779  12.903  -0.110
   13    HA   PHE   2           HA       PHE   2   1.942  14.060   1.724
   14    HB2  PHE   2           HB2      PHE   2   2.478  11.237   0.822
   15    HB3  PHE   2           HB1      PHE   2   1.262  11.609   2.044
   16    HD1  PHE   2           HD1      PHE   2   2.055  11.607  -1.481
   17    HD2  PHE   2           HD2      PHE   2  -0.586  13.247   1.481
   18    HE1  PHE   2           HE1      PHE   2   0.454  12.248  -3.264
   19    HE2  PHE   2           HE2      PHE   2  -2.187  13.888  -0.300
   20    HZ   PHE   2           HZ       PHE   2  -1.668  13.388  -2.673
   21    H    GLU   3           HN       GLU   3   4.718  11.879   2.115
   22    HA   GLU   3           HA       GLU   3   4.283  11.772   4.969
   23    HB2  GLU   3           HB2      GLU   3   6.563  10.629   3.361
   24    HB3  GLU   3           HB1      GLU   3   6.170  10.259   5.039
   25    HG2  GLU   3           HG2      GLU   3   5.078   8.506   4.022
   26    HG3  GLU   3           HG1      GLU   3   3.788   9.706   4.000
   27    HA   PRO   4           HA       PRO   4   6.864  15.419   5.507
   28    HB2  PRO   4           HB2      PRO   4   7.015  15.380   8.240
   29    HB3  PRO   4           HB1      PRO   4   5.607  15.981   7.346
   30    HG2  PRO   4           HG2      PRO   4   6.024  13.353   8.678
   31    HG3  PRO   4           HG1      PRO   4   4.572  14.367   8.606
   32    HD2  PRO   4           HD2      PRO   4   4.914  12.161   7.027
   33    HD3  PRO   4           HD1      PRO   4   3.951  13.567   6.522
   34    H    PHE   5           HN       PHE   5   7.585  12.278   6.912
   35    HA   PHE   5           HA       PHE   5  10.210  12.804   7.819
   36    HB2  PHE   5           HB2      PHE   5  10.215  10.618   8.378
   37    HB3  PHE   5           HB1      PHE   5   8.521  10.642   7.887
   38    HD1  PHE   5           HD1      PHE   5  11.725   9.201   7.284
   39    HD2  PHE   5           HD2      PHE   5   8.043  10.249   5.343
   40    HE1  PHE   5           HE1      PHE   5  12.239   7.611   5.452
   41    HE2  PHE   5           HE2      PHE   5   8.553   8.660   3.509
   42    HZ   PHE   5           HZ       PHE   5  10.654   7.334   3.562
   43    H    GLN   6           HN       GLN   6   8.957  12.686   4.651
   44    HA   GLN   6           HA       GLN   6  11.082  11.560   3.205
   45    HB2  GLN   6           HB2      GLN   6   8.860  12.129   2.248
   46    HB3  GLN   6           HB1      GLN   6   9.272  13.841   2.370
   47    HG2  GLN   6           HG2      GLN   6  11.313  13.351   0.946
   48    HG3  GLN   6           HG1      GLN   6  10.654  11.736   0.687
   49   HE21  GLN   6          HE21      GLN   6   9.853  11.776  -1.430
   50   HE22  GLN   6          HE22      GLN   6   8.811  12.971  -2.038
   51    H    ILE   7           HN       ILE   7  10.572  14.833   4.453
   52    HA   ILE   7           HA       ILE   7  12.659  16.124   3.105
   53    HB   ILE   7           HB       ILE   7  12.562  17.797   4.901
   54   HG12  ILE   7          HG12      ILE   7  10.581  17.045   6.626
   55   HG13  ILE   7          HG11      ILE   7  11.388  15.507   6.368
   56   HG21  ILE   7          HG21      ILE   7   9.847  16.662   4.167
   57   HG22  ILE   7          HG22      ILE   7  10.789  17.787   3.189
   58   HG23  ILE   7          HG23      ILE   7  10.145  18.299   4.750
   59   HD11  ILE   7          HD11      ILE   7  13.588  16.880   6.802
   60   HD12  ILE   7          HD12      ILE   7  12.591  16.380   8.168
   61   HD13  ILE   7          HD13      ILE   7  12.486  18.031   7.562
   62    H    LEU   8           HN       LEU   8  12.684  14.227   6.098
   63    HA   LEU   8           HA       LEU   8  15.389  14.820   6.750
   64    HB2  LEU   8           HB2      LEU   8  13.731  14.083   8.432
   65    HB3  LEU   8           HB1      LEU   8  13.641  12.512   7.638
   66    HG   LEU   8           HG       LEU   8  16.081  12.201   8.047
   67   HD11  LEU   8          HD11      LEU   8  16.886  14.449   8.174
   68   HD12  LEU   8          HD12      LEU   8  17.077  13.782   9.795
   69   HD13  LEU   8          HD13      LEU   8  15.731  14.865   9.439
   70   HD21  LEU   8          HD21      LEU   8  14.534  11.237   9.646
   71   HD22  LEU   8          HD22      LEU   8  14.329  12.793  10.451
   72   HD23  LEU   8          HD23      LEU   8  15.873  11.947  10.548
   73    H    SER   9           HN       SER   9  13.767  12.340   4.910
   74    HA   SER   9           HA       SER   9  15.978  10.556   4.645
   75    HB2  SER   9           HB2      SER   9  13.690   9.815   4.206
   76    HB3  SER   9           HB1      SER   9  13.564  10.945   2.860
   77    HG   SER   9           HG       SER   9  15.277   9.819   1.861
   78    H    ILE  10           HN       ILE  10  14.643  13.053   2.480
   79    HA   ILE  10           HA       ILE  10  16.557  12.754   0.437
   80    HB   ILE  10           HB       ILE  10  14.901  15.160   1.237
   81   HG12  ILE  10          HG12      ILE  10  14.528  13.245  -1.081
   82   HG13  ILE  10          HG11      ILE  10  13.769  12.981   0.491
   83   HG21  ILE  10          HG21      ILE  10  16.704  14.626  -1.136
   84   HG22  ILE  10          HG22      ILE  10  16.691  16.030  -0.068
   85   HG23  ILE  10          HG23      ILE  10  15.379  15.788  -1.220
   86   HD11  ILE  10          HD11      ILE  10  13.453  15.498  -1.171
   87   HD12  ILE  10          HD12      ILE  10  12.633  15.136   0.348
   88   HD13  ILE  10          HD13      ILE  10  12.273  14.191  -1.097
   89    H    CYS  11           HN       CYS  11  16.464  14.895   3.286
   90    HA   CYS  11           HA       CYS  11  18.791  16.361   2.702
   91    HB2  CYS  11           HB2      CYS  11  17.469  15.624   5.316
   92    HB3  CYS  11           HB1      CYS  11  18.859  16.703   5.211
   93    HG   CYS  11           HG       CYS  11  17.416  18.358   3.794
   94    H    SER  12           HN       SER  12  18.367  13.415   4.707
   95    HA   SER  12           HA       SER  12  21.055  13.106   5.402
   96    HB2  SER  12           HB2      SER  12  19.262  11.846   6.487
   97    HB3  SER  12           HB1      SER  12  18.936  10.984   4.986
   98    HG   SER  12           HG       SER  12  20.980  10.075   5.108
   99    H    PHE  13           HN       PHE  13  19.243  11.869   2.608
  100    HA   PHE  13           HA       PHE  13  21.256  10.279   1.507
  101    HB2  PHE  13           HB2      PHE  13  18.953  10.222   0.699
  102    HB3  PHE  13           HB1      PHE  13  19.095  11.880   0.114
  103    HD1  PHE  13           HD1      PHE  13  20.828   8.565  -0.173
  104    HD2  PHE  13           HD2      PHE  13  19.710  12.233  -2.111
  105    HE1  PHE  13           HE1      PHE  13  21.768   7.724  -2.308
  106    HE2  PHE  13           HE2      PHE  13  20.651  11.392  -4.245
  107    HZ   PHE  13           HZ       PHE  13  21.680   9.137  -4.344
  108    H    ILE  14           HN       ILE  14  20.497  13.709   0.921
  109    HA   ILE  14           HA       ILE  14  22.522  14.185  -0.976
  110    HB   ILE  14           HB       ILE  14  21.154  16.048   0.981
  111   HG12  ILE  14          HG12      ILE  14  19.877  14.791  -0.899
  112   HG13  ILE  14          HG11      ILE  14  19.668  16.537  -0.793
  113   HG21  ILE  14          HG21      ILE  14  23.147  17.184   0.402
  114   HG22  ILE  14          HG22      ILE  14  21.965  17.794  -0.753
  115   HG23  ILE  14          HG23      ILE  14  23.130  16.567  -1.250
  116   HD11  ILE  14          HD11      ILE  14  20.166  15.459  -3.122
  117   HD12  ILE  14          HD12      ILE  14  21.832  15.380  -2.548
  118   HD13  ILE  14          HD13      ILE  14  21.012  16.937  -2.673
  119    H    LEU  15           HN       LEU  15  22.492  14.614   2.555
  120    HA   LEU  15           HA       LEU  15  25.117  15.654   2.769
  121    HB2  LEU  15           HB2      LEU  15  23.336  14.221   4.757
  122    HB3  LEU  15           HB1      LEU  15  24.866  14.987   5.183
  123    HG   LEU  15           HG       LEU  15  22.652  16.489   3.770
  124   HD11  LEU  15          HD11      LEU  15  21.758  15.677   5.901
  125   HD12  LEU  15          HD12      LEU  15  22.084  17.405   6.017
  126   HD13  LEU  15          HD13      LEU  15  23.196  16.247   6.747
  127   HD21  LEU  15          HD21      LEU  15  24.846  17.532   3.636
  128   HD22  LEU  15          HD22      LEU  15  25.105  17.296   5.363
  129   HD23  LEU  15          HD23      LEU  15  23.877  18.431   4.803
  130    H    SER  16           HN       SER  16  23.858  12.420   2.532
  131    HA   SER  16           HA       SER  16  26.166  11.051   3.524
  132    HB2  SER  16           HB2      SER  16  23.935  10.006   3.481
  133    HB3  SER  16           HB1      SER  16  23.944  10.066   1.722
  134    HG   SER  16           HG       SER  16  25.325   8.455   1.669
  135    H    ALA  17           HN       ALA  17  24.943  11.817   0.278
  136    HA   ALA  17           HA       ALA  17  27.052  10.551  -1.141
  137    HB1  ALA  17           HB1      ALA  17  25.020  11.006  -2.320
  138    HB2  ALA  17           HB2      ALA  17  26.257  12.036  -3.039
  139    HB3  ALA  17           HB3      ALA  17  25.089  12.719  -1.908
  140    H    LEU  18           HN       LEU  18  26.588  13.849   0.109
  141    HA   LEU  18           HA       LEU  18  28.933  14.896  -1.138
  142    HB2  LEU  18           HB2      LEU  18  27.073  15.845   1.028
  143    HB3  LEU  18           HB1      LEU  18  28.540  16.738   0.623
  144    HG   LEU  18           HG       LEU  18  26.586  15.910  -1.523
  145   HD11  LEU  18          HD11      LEU  18  25.313  17.195   0.153
  146   HD12  LEU  18          HD12      LEU  18  25.560  18.153  -1.307
  147   HD13  LEU  18          HD13      LEU  18  26.542  18.459   0.125
  148   HD21  LEU  18          HD21      LEU  18  28.590  18.176  -1.254
  149   HD22  LEU  18          HD22      LEU  18  27.608  17.840  -2.678
  150   HD23  LEU  18          HD23      LEU  18  28.848  16.694  -2.172
  151    H    HIS  19           HN       HIS  19  28.250  13.234   1.886
  152    HA   HIS  19           HA       HIS  19  30.621  14.006   3.257
  153    HB2  HIS  19           HB2      HIS  19  28.566  13.012   4.311
  154    HB3  HIS  19           HB1      HIS  19  29.026  11.464   3.606
  155    HD2  HIS  19           HD2      HIS  19  31.271  10.220   4.832
  156    HE1  HIS  19           HE1      HIS  19  31.748  13.101   7.881
  157    HE2  HIS  19           HE2      HIS  19  32.498  10.818   7.059
  158    H    PHE  20           HN       PHE  20  29.740  11.119   1.348
  159    HA   PHE  20           HA       PHE  20  32.332   9.937   1.593
  160    HB2  PHE  20           HB2      PHE  20  29.810   9.268   0.322
  161    HB3  PHE  20           HB1      PHE  20  31.180   8.894  -0.724
  162    HD1  PHE  20           HD1      PHE  20  30.166   8.587   2.890
  163    HD2  PHE  20           HD2      PHE  20  32.273   6.859  -0.434
  164    HE1  PHE  20           HE1      PHE  20  30.689   6.583   4.258
  165    HE2  PHE  20           HE2      PHE  20  32.794   4.858   0.937
  166    HZ   PHE  20           HZ       PHE  20  32.007   4.714   3.286
  167    H    MET  21           HN       MET  21  30.887  12.240  -0.605
  168    HA   MET  21           HA       MET  21  32.715  12.016  -2.744
  169    HB2  MET  21           HB2      MET  21  30.788  14.043  -1.754
  170    HB3  MET  21           HB1      MET  21  32.050  14.617  -2.846
  171    HG2  MET  21           HG2      MET  21  31.449  12.789  -4.436
  172    HG3  MET  21           HG1      MET  21  30.121  12.336  -3.370
  173    HE1  MET  21           HE1      MET  21  28.950  12.321  -5.380
  174    HE2  MET  21           HE2      MET  21  28.475  13.673  -6.402
  175    HE3  MET  21           HE3      MET  21  27.591  13.351  -4.913
  176    H    ALA  22           HN       ALA  22  32.692  14.288   0.026
  177    HA   ALA  22           HA       ALA  22  35.193  15.451  -0.621
  178    HB1  ALA  22           HB1      ALA  22  33.915  16.751   0.821
  179    HB2  ALA  22           HB2      ALA  22  35.099  16.045   1.922
  180    HB3  ALA  22           HB3      ALA  22  33.471  15.375   1.829
  181    H    TRP  23           HN       TRP  23  34.264  12.757   1.482
  182    HA   TRP  23           HA       TRP  23  36.764  12.316   2.679
  183    HB2  TRP  23           HB2      TRP  23  34.238  11.078   2.678
  184    HB3  TRP  23           HB1      TRP  23  35.390   9.834   2.194
  185    HD1  TRP  23           HD1      TRP  23  34.305  11.912   5.139
  186    HE1  TRP  23           HE1      TRP  23  35.671  11.228   7.218
  187    HE3  TRP  23           HE3      TRP  23  37.825   8.932   2.944
  188    HZ2  TRP  23           HZ2      TRP  23  37.955   9.626   7.862
  189    HZ3  TRP  23           HZ3      TRP  23  39.581   7.841   4.310
  190    HH2  TRP  23           HH2      TRP  23  39.651   8.184   6.764
  191    H    THR  24           HN       THR  24  35.348  10.823  -0.234
  192    HA   THR  24           HA       THR  24  37.440   9.130  -0.903
  193    HB   THR  24           HB       THR  24  36.624   9.654  -3.336
  194    HG1  THR  24           HG1      THR  24  35.222  11.185  -3.429
  195   HG21  THR  24          HG21      THR  24  35.984   7.615  -2.263
  196   HG22  THR  24          HG22      THR  24  34.491   8.357  -2.837
  197   HG23  THR  24          HG23      THR  24  34.929   8.465  -1.132
  198    H    ILE  25           HN       ILE  25  36.934  12.535  -1.859
  199    HA   ILE  25           HA       ILE  25  39.320  12.744  -3.376
  200    HB   ILE  25           HB       ILE  25  37.645  14.823  -1.968
  201   HG12  ILE  25          HG12      ILE  25  38.009  14.206  -4.911
  202   HG13  ILE  25          HG11      ILE  25  36.718  13.515  -3.930
  203   HG21  ILE  25          HG21      ILE  25  39.884  15.732  -2.140
  204   HG22  ILE  25          HG22      ILE  25  38.915  16.442  -3.431
  205   HG23  ILE  25          HG23      ILE  25  40.047  15.140  -3.793
  206   HD11  ILE  25          HD11      ILE  25  36.105  15.916  -3.296
  207   HD12  ILE  25          HD12      ILE  25  35.770  15.445  -4.962
  208   HD13  ILE  25          HD13      ILE  25  37.188  16.426  -4.592
  209    H    GLY  26           HN       GLY  26  38.602  13.296   0.021
  210    HA2  GLY  26           HA2      GLY  26  41.030  14.478   0.803
  211    HA3  GLY  26           HA1      GLY  26  39.974  13.555   1.867
  212    H    HIS  27           HN       HIS  27  40.063  11.043   0.844
  213    HA   HIS  27           HA       HIS  27  42.558  10.061   1.770
  214    HB2  HIS  27           HB2      HIS  27  40.405   8.802   1.884
  215    HB3  HIS  27           HB1      HIS  27  40.482   8.591   0.135
  216    HD2  HIS  27           HD2      HIS  27  42.053   7.059   3.342
  217    HE1  HIS  27           HE1      HIS  27  43.960   5.262   0.031
  218    HE2  HIS  27           HE2      HIS  27  43.669   5.165   2.553
  219    H    LEU  28           HN       LEU  28  41.207  10.576  -1.451
  220    HA   LEU  28           HA       LEU  28  43.302   9.299  -2.882
  221    HB2  LEU  28           HB2      LEU  28  41.232  11.350  -3.662
  222    HB3  LEU  28           HB1      LEU  28  42.407  10.706  -4.810
  223    HG   LEU  28           HG       LEU  28  40.633   8.922  -3.129
  224   HD11  LEU  28          HD11      LEU  28  39.260  10.422  -4.575
  225   HD12  LEU  28          HD12      LEU  28  39.162   8.732  -5.071
  226   HD13  LEU  28          HD13      LEU  28  40.170   9.861  -5.977
  227   HD21  LEU  28          HD21      LEU  28  42.403   8.560  -5.562
  228   HD22  LEU  28          HD22      LEU  28  41.185   7.369  -5.104
  229   HD23  LEU  28          HD23      LEU  28  42.514   7.736  -4.007
  230    H    ASN  29           HN       ASN  29  42.799  12.597  -1.761
  231    HA   ASN  29           HA       ASN  29  44.191  14.405  -1.597
  232    HB2  ASN  29           HB2      ASN  29  46.056  12.090  -1.575
  233    HB3  ASN  29           HB1      ASN  29  46.754  13.678  -1.884
  234   HD21  ASN  29          HD21      ASN  29  46.246  11.616   0.606
  235   HD22  ASN  29          HD22      ASN  29  45.996  12.722   1.869
  236    H    GLN  30           HN       GLN  30  46.325  12.648  -3.800
  237    HA   GLN  30           HA       GLN  30  46.231  14.842  -5.684
  238    HB2  GLN  30           HB2      GLN  30  47.778  12.271  -5.487
  239    HB3  GLN  30           HB1      GLN  30  47.812  13.240  -6.962
  240    HG2  GLN  30           HG2      GLN  30  48.465  15.221  -5.544
  241    HG3  GLN  30           HG1      GLN  30  48.621  14.118  -4.178
  242   HE21  GLN  30          HE21      GLN  30  50.989  14.876  -4.287
  243   HE22  GLN  30          HE22      GLN  30  52.024  14.057  -5.353
  244    H    ILE  31           HN       ILE  31  45.386  14.807  -7.732
  245    HA   ILE  31           HA       ILE  31  43.096  13.238  -8.218
  246    HB   ILE  31           HB       ILE  31  44.820  14.901 -10.062
  247   HG12  ILE  31          HG12      ILE  31  42.033  15.450  -9.032
  248   HG13  ILE  31          HG11      ILE  31  43.463  15.921  -8.113
  249   HG21  ILE  31          HG21      ILE  31  43.697  13.308 -11.462
  250   HG22  ILE  31          HG22      ILE  31  42.754  14.796 -11.547
  251   HG23  ILE  31          HG23      ILE  31  42.200  13.459 -10.539
  252   HD11  ILE  31          HD11      ILE  31  42.888  16.743 -10.975
  253   HD12  ILE  31          HD12      ILE  31  44.271  17.250 -10.007
  254   HD13  ILE  31          HD13      ILE  31  42.646  17.766  -9.560
  255    H    LYS  32           HN       LYS  32  46.426  12.981  -9.427
  256    HA   LYS  32           HA       LYS  32  47.551  11.267 -10.460
  257    HB2  LYS  32           HB2      LYS  32  45.485   9.827  -8.822
  258    HB3  LYS  32           HB1      LYS  32  46.556   8.924  -9.894
  259    HG2  LYS  32           HG2      LYS  32  48.504   9.692  -8.760
  260    HG3  LYS  32           HG1      LYS  32  47.600  10.935  -7.892
  261    HD2  LYS  32           HD2      LYS  32  46.336   9.172  -6.703
  262    HD3  LYS  32           HD1      LYS  32  47.269   7.939  -7.552
  263    HE2  LYS  32           HE2      LYS  32  49.326   8.699  -6.524
  264    HE3  LYS  32           HE1      LYS  32  48.505  10.085  -5.807
  265    HZ1  LYS  32           HZ1      LYS  32  48.894   8.008  -4.377
  266    HZ2  LYS  32           HZ2      LYS  32  47.589   7.343  -5.236
  267    HZ3  LYS  32           HZ3      LYS  32  47.373   8.755  -4.317
  268    H    ARG  33           HN       ARG  33  47.290  11.615 -12.612
  269    HA   ARG  33           HA       ARG  33  45.241   9.996 -13.946
  270    HB2  ARG  33           HB2      ARG  33  44.314  11.713 -15.192
  271    HB3  ARG  33           HB1      ARG  33  44.608  12.533 -13.663
  272    HG2  ARG  33           HG2      ARG  33  46.414  12.635 -16.107
  273    HG3  ARG  33           HG1      ARG  33  45.363  13.926 -15.528
  274    HD2  ARG  33           HD2      ARG  33  46.634  13.685 -13.288
  275    HD3  ARG  33           HD1      ARG  33  47.843  12.824 -14.234
  276    HE   ARG  33           HE       ARG  33  47.244  15.253 -15.534
  277   HH11  ARG  33          HH11      ARG  33  48.753  14.066 -12.622
  278   HH12  ARG  33          HH12      ARG  33  49.823  15.417 -12.489
  279   HH21  ARG  33          HH21      ARG  33  48.645  16.999 -15.332
  280   HH22  ARG  33          HH22      ARG  33  49.765  17.069 -14.013
  281    H1   MET   1           HT1      MET   1   8.225  -5.521   3.913
  282    H2   MET   1           HT2      MET   1   6.556  -5.256   3.727
  283    H3   MET   1           HT3      MET   1   7.381  -4.597   5.059
  284    HA   MET   1           HA       MET   1   8.596  -3.104   3.680
  285    HB2  MET   1           HB2      MET   1   7.733  -5.016   1.647
  286    HB3  MET   1           HB1      MET   1   7.467  -3.346   1.147
  287    HG2  MET   1           HG2      MET   1   9.823  -2.817   1.747
  288    HG3  MET   1           HG1      MET   1  10.077  -4.513   2.157
  289    HE1  MET   1           HE1      MET   1  10.549  -6.257   0.808
  290    HE2  MET   1           HE2      MET   1  10.369  -6.427  -0.936
  291    HE3  MET   1           HE3      MET   1   8.937  -6.396   0.091
  292    H    PHE   2           HN       PHE   2   5.934  -3.495   5.059
  293    HA   PHE   2           HA       PHE   2   3.955  -2.012   3.656
  294    HB2  PHE   2           HB2      PHE   2   4.360  -2.711   6.558
  295    HB3  PHE   2           HB1      PHE   2   3.014  -1.705   6.022
  296    HD1  PHE   2           HD1      PHE   2   4.322  -5.064   6.272
  297    HD2  PHE   2           HD2      PHE   2   1.427  -2.607   4.267
  298    HE1  PHE   2           HE1      PHE   2   3.069  -7.095   5.593
  299    HE2  PHE   2           HE2      PHE   2   0.173  -4.636   3.588
  300    HZ   PHE   2           HZ       PHE   2   0.995  -6.880   4.251
  301    H    GLU   3           HN       GLU   3   6.433  -1.116   6.037
  302    HA   GLU   3           HA       GLU   3   5.568   1.640   5.959
  303    HB2  GLU   3           HB2      GLU   3   7.949   0.446   7.371
  304    HB3  GLU   3           HB1      GLU   3   7.279   2.058   7.619
  305    HG2  GLU   3           HG2      GLU   3   6.196   0.955   9.324
  306    HG3  GLU   3           HG1      GLU   3   5.038   0.689   8.024
  307    HA   PRO   4           HA       PRO   4   8.358   2.422   2.517
  308    HB2  PRO   4           HB2      PRO   4   8.097   5.147   2.425
  309    HB3  PRO   4           HB1      PRO   4   6.899   4.024   1.756
  310    HG2  PRO   4           HG2      PRO   4   6.872   5.505   4.337
  311    HG3  PRO   4           HG1      PRO   4   5.545   5.174   3.210
  312    HD2  PRO   4           HD2      PRO   4   5.916   3.753   5.516
  313    HD3  PRO   4           HD1      PRO   4   5.171   3.053   4.061
  314    H    PHE   5           HN       PHE   5   8.576   4.046   5.627
  315    HA   PHE   5           HA       PHE   5  11.075   5.319   5.276
  316    HB2  PHE   5           HB2      PHE   5  10.798   5.959   7.423
  317    HB3  PHE   5           HB1      PHE   5   9.206   5.215   7.283
  318    HD1  PHE   5           HD1      PHE   5  12.318   5.167   9.016
  319    HD2  PHE   5           HD2      PHE   5   9.078   2.646   7.766
  320    HE1  PHE   5           HE1      PHE   5  12.955   3.497  10.734
  321    HE2  PHE   5           HE2      PHE   5   9.710   0.974   9.485
  322    HZ   PHE   5           HZ       PHE   5  11.651   1.399  10.972
  323    H    GLN   6           HN       GLN   6  10.303   2.004   5.456
  324    HA   GLN   6           HA       GLN   6  12.507   0.945   6.831
  325    HB2  GLN   6           HB2      GLN   6  10.514  -0.362   6.125
  326    HB3  GLN   6           HB1      GLN   6  11.057  -0.243   4.452
  327    HG2  GLN   6           HG2      GLN   6  13.233  -1.319   5.184
  328    HG3  GLN   6           HG1      GLN   6  12.477  -1.613   6.750
  329   HE21  GLN   6          HE21      GLN   6  12.007  -3.829   6.753
  330   HE22  GLN   6          HE22      GLN   6  11.180  -4.634   5.509
  331    H    ILE   7           HN       ILE   7  12.112   1.966   3.468
  332    HA   ILE   7           HA       ILE   7  14.486   0.914   2.423
  333    HB   ILE   7           HB       ILE   7  14.272   2.607   0.659
  334   HG12  ILE   7          HG12      ILE   7  12.001   4.039   1.153
  335   HG13  ILE   7          HG11      ILE   7  12.695   3.968   2.763
  336   HG21  ILE   7          HG21      ILE   7  11.605   1.520   1.607
  337   HG22  ILE   7          HG22      ILE   7  12.775   0.652   0.614
  338   HG23  ILE   7          HG23      ILE   7  11.957   2.077  -0.028
  339   HD11  ILE   7          HD11      ILE   7  14.921   4.676   1.557
  340   HD12  ILE   7          HD12      ILE   7  13.693   5.893   1.898
  341   HD13  ILE   7          HD13      ILE   7  13.828   5.213   0.280
  342    H    LEU   8           HN       LEU   8  13.894   3.940   4.152
  343    HA   LEU   8           HA       LEU   8  16.516   4.981   3.761
  344    HB2  LEU   8           HB2      LEU   8  14.566   6.417   4.267
  345    HB3  LEU   8           HB1      LEU   8  14.453   5.680   5.865
  346    HG   LEU   8           HG       LEU   8  16.767   6.466   6.357
  347   HD11  LEU   8          HD11      LEU   8  17.745   6.627   4.181
  348   HD12  LEU   8          HD12      LEU   8  17.632   8.284   4.774
  349   HD13  LEU   8          HD13      LEU   8  16.457   7.684   3.603
  350   HD21  LEU   8          HD21      LEU   8  14.920   7.848   7.103
  351   HD22  LEU   8          HD22      LEU   8  14.739   8.550   5.497
  352   HD23  LEU   8          HD23      LEU   8  16.168   8.916   6.462
  353    H    SER   9           HN       SER   9  14.968   3.010   6.186
  354    HA   SER   9           HA       SER   9  17.024   3.157   8.162
  355    HB2  SER   9           HB2      SER   9  14.771   2.403   8.734
  356    HB3  SER   9           HB1      SER   9  14.947   1.011   7.668
  357    HG   SER   9           HG       SER   9  16.681   0.327   8.980
  358    H    ILE  10           HN       ILE  10  16.257   0.714   5.682
  359    HA   ILE  10           HA       ILE  10  18.420  -0.998   6.243
  360    HB   ILE  10           HB       ILE  10  16.887  -0.552   3.667
  361   HG12  ILE  10          HG12      ILE  10  16.691  -2.823   5.663
  362   HG13  ILE  10          HG11      ILE  10  15.688  -1.377   5.780
  363   HG21  ILE  10          HG21      ILE  10  18.966  -2.602   4.473
  364   HG22  ILE  10          HG22      ILE  10  18.923  -1.604   3.021
  365   HG23  ILE  10          HG23      ILE  10  17.779  -2.931   3.211
  366   HD11  ILE  10          HD11      ILE  10  15.848  -3.166   3.337
  367   HD12  ILE  10          HD12      ILE  10  14.784  -1.776   3.550
  368   HD13  ILE  10          HD13      ILE  10  14.556  -3.220   4.536
  369    H    CYS  11           HN       CYS  11  18.095   1.711   3.959
  370    HA   CYS  11           HA       CYS  11  20.609   1.444   2.723
  371    HB2  CYS  11           HB2      CYS  11  18.847   3.850   3.207
  372    HB3  CYS  11           HB1      CYS  11  20.332   3.919   2.257
  373    HG   CYS  11           HG       CYS  11  19.276   2.229   0.563
  374    H    SER  12           HN       SER  12  19.625   3.465   5.515
  375    HA   SER  12           HA       SER  12  22.141   4.584   6.009
  376    HB2  SER  12           HB2      SER  12  20.097   5.426   7.059
  377    HB3  SER  12           HB1      SER  12  19.927   3.927   7.968
  378    HG   SER  12           HG       SER  12  21.835   4.402   9.037
  379    H    PHE  13           HN       PHE  13  20.662   1.595   7.235
  380    HA   PHE  13           HA       PHE  13  22.662   0.878   9.044
  381    HB2  PHE  13           HB2      PHE  13  20.511  -0.270   8.950
  382    HB3  PHE  13           HB1      PHE  13  20.888  -0.890   7.342
  383    HD1  PHE  13           HD1      PHE  13  22.336  -0.783  10.801
  384    HD2  PHE  13           HD2      PHE  13  21.858  -3.006   7.157
  385    HE1  PHE  13           HE1      PHE  13  23.503  -2.715  11.827
  386    HE2  PHE  13           HE2      PHE  13  23.026  -4.938   8.183
  387    HZ   PHE  13           HZ       PHE  13  23.847  -4.793  10.518
  388    H    ILE  14           HN       ILE  14  22.313   0.044   5.600
  389    HA   ILE  14           HA       ILE  14  24.634  -1.534   5.392
  390    HB   ILE  14           HB       ILE  14  23.163   0.118   3.323
  391   HG12  ILE  14          HG12      ILE  14  22.072  -1.886   4.564
  392   HG13  ILE  14          HG11      ILE  14  22.007  -1.880   2.803
  393   HG21  ILE  14          HG21      ILE  14  25.312  -0.193   2.385
  394   HG22  ILE  14          HG22      ILE  14  24.378  -1.541   1.743
  395   HG23  ILE  14          HG23      ILE  14  25.491  -1.801   3.088
  396   HD11  ILE  14          HD11      ILE  14  22.745  -4.062   4.036
  397   HD12  ILE  14          HD12      ILE  14  24.295  -3.240   4.226
  398   HD13  ILE  14          HD13      ILE  14  23.647  -3.547   2.614
  399    H    LEU  15           HN       LEU  15  24.117   1.922   4.778
  400    HA   LEU  15           HA       LEU  15  26.765   2.505   3.951
  401    HB2  LEU  15           HB2      LEU  15  24.585   4.250   5.122
  402    HB3  LEU  15           HB1      LEU  15  26.097   4.876   4.465
  403    HG   LEU  15           HG       LEU  15  24.262   3.084   2.861
  404   HD11  LEU  15          HD11      LEU  15  22.992   5.084   3.485
  405   HD12  LEU  15          HD12      LEU  15  23.453   5.182   1.786
  406   HD13  LEU  15          HD13      LEU  15  24.335   6.116   2.994
  407   HD21  LEU  15          HD21      LEU  15  26.537   3.244   2.012
  408   HD22  LEU  15          HD22      LEU  15  26.514   5.000   2.177
  409   HD23  LEU  15          HD23      LEU  15  25.490   4.215   0.976
  410    H    SER  16           HN       SER  16  25.268   2.196   7.070
  411    HA   SER  16           HA       SER  16  27.266   3.589   8.580
  412    HB2  SER  16           HB2      SER  16  24.979   3.244   9.434
  413    HB3  SER  16           HB1      SER  16  25.261   1.506   9.470
  414    HG   SER  16           HG       SER  16  26.482   1.732  11.189
  415    H    ALA  17           HN       ALA  17  26.616   0.168   7.882
  416    HA   ALA  17           HA       ALA  17  28.787  -0.864   9.394
  417    HB1  ALA  17           HB1      ALA  17  27.003  -2.354   8.830
  418    HB2  ALA  17           HB2      ALA  17  28.422  -2.916   7.948
  419    HB3  ALA  17           HB3      ALA  17  27.167  -2.004   7.110
  420    H    LEU  18           HN       LEU  18  28.440   0.167   6.012
  421    HA   LEU  18           HA       LEU  18  31.032  -0.739   5.228
  422    HB2  LEU  18           HB2      LEU  18  28.963   1.077   4.014
  423    HB3  LEU  18           HB1      LEU  18  30.548   0.869   3.269
  424    HG   LEU  18           HG       LEU  18  28.874  -1.519   4.043
  425   HD11  LEU  18          HD11      LEU  18  27.484  -0.113   2.569
  426   HD12  LEU  18          HD12      LEU  18  28.034  -1.553   1.715
  427   HD13  LEU  18          HD13      LEU  18  28.813   0.000   1.416
  428   HD21  LEU  18          HD21      LEU  18  31.012  -1.033   1.942
  429   HD22  LEU  18          HD22      LEU  18  30.227  -2.577   2.266
  430   HD23  LEU  18          HD23      LEU  18  31.267  -1.845   3.486
  431    H    HIS  19           HN       HIS  19  29.760   2.207   6.665
  432    HA   HIS  19           HA       HIS  19  31.960   3.892   6.028
  433    HB2  HIS  19           HB2      HIS  19  29.691   4.657   6.789
  434    HB3  HIS  19           HB1      HIS  19  30.110   4.093   8.406
  435    HD2  HIS  19           HD2      HIS  19  32.026   5.696   9.764
  436    HE1  HIS  19           HE1      HIS  19  32.302   8.666   6.776
  437    HE2  HIS  19           HE2      HIS  19  32.956   8.059   9.154
  438    H    PHE  20           HN       PHE  20  31.119   1.980   8.923
  439    HA   PHE  20           HA       PHE  20  33.527   2.669  10.306
  440    HB2  PHE  20           HB2      PHE  20  31.174   1.052  10.820
  441    HB3  PHE  20           HB1      PHE  20  32.645   0.244  11.362
  442    HD1  PHE  20           HD1      PHE  20  31.077   3.665  11.393
  443    HD2  PHE  20           HD2      PHE  20  33.492   0.775  13.461
  444    HE1  PHE  20           HE1      PHE  20  31.202   5.174  13.359
  445    HE2  PHE  20           HE2      PHE  20  33.615   2.283  15.425
  446    HZ   PHE  20           HZ       PHE  20  32.469   4.477  15.372
  447    H    MET  21           HN       MET  21  32.639   0.188   8.009
  448    HA   MET  21           HA       MET  21  34.736  -1.636   8.491
  449    HB2  MET  21           HB2      MET  21  32.871  -1.026   6.264
  450    HB3  MET  21           HB1      MET  21  34.329  -1.933   5.850
  451    HG2  MET  21           HG2      MET  21  33.812  -3.527   7.705
  452    HG3  MET  21           HG1      MET  21  32.304  -2.661   7.989
  453    HE1  MET  21           HE1      MET  21  31.450  -4.825   8.012
  454    HE2  MET  21           HE2      MET  21  31.256  -5.959   6.680
  455    HE3  MET  21           HE3      MET  21  30.136  -4.612   6.849
  456    H    ALA  22           HN       ALA  22  34.503   1.001   6.088
  457    HA   ALA  22           HA       ALA  22  37.169   0.707   5.168
  458    HB1  ALA  22           HB1      ALA  22  35.813   1.884   3.694
  459    HB2  ALA  22           HB2      ALA  22  36.750   3.180   4.437
  460    HB3  ALA  22           HB3      ALA  22  35.099   2.867   4.974
  461    H    TRP  23           HN       TRP  23  35.699   2.744   7.667
  462    HA   TRP  23           HA       TRP  23  37.943   4.328   8.250
  463    HB2  TRP  23           HB2      TRP  23  35.345   3.988   9.273
  464    HB3  TRP  23           HB1      TRP  23  36.439   3.734  10.632
  465    HD1  TRP  23           HD1      TRP  23  35.119   6.396   8.321
  466    HE1  TRP  23           HE1      TRP  23  36.093   8.684   9.007
  467    HE3  TRP  23           HE3      TRP  23  38.643   4.880  11.691
  468    HZ2  TRP  23           HZ2      TRP  23  38.102   9.732  10.758
  469    HZ3  TRP  23           HZ3      TRP  23  40.071   6.535  12.856
  470    HH2  TRP  23           HH2      TRP  23  39.806   8.961  12.391
  471    H    THR  24           HN       THR  24  36.850   1.290   9.766
  472    HA   THR  24           HA       THR  24  38.855   1.017  11.664
  473    HB   THR  24           HB       THR  24  38.462  -1.530  11.200
  474    HG1  THR  24           HG1      THR  24  37.233  -1.895   9.564
  475   HG21  THR  24          HG21      THR  24  37.486  -0.489  13.119
  476   HG22  THR  24          HG22      THR  24  36.170  -1.315  12.286
  477   HG23  THR  24          HG23      THR  24  36.356   0.432  12.127
  478    H    ILE  25           HN       ILE  25  38.806  -0.140   8.283
  479    HA   ILE  25           HA       ILE  25  41.401  -1.279   8.353
  480    HB   ILE  25           HB       ILE  25  39.729  -0.224   6.071
  481   HG12  ILE  25          HG12      ILE  25  40.471  -3.052   6.867
  482   HG13  ILE  25          HG11      ILE  25  38.990  -2.253   7.398
  483   HG21  ILE  25          HG21      ILE  25  42.040  -0.086   5.360
  484   HG22  ILE  25          HG22      ILE  25  41.344  -1.538   4.642
  485   HG23  ILE  25          HG23      ILE  25  42.394  -1.670   6.051
  486   HD11  ILE  25          HD11      ILE  25  38.510  -1.813   4.923
  487   HD12  ILE  25          HD12      ILE  25  38.384  -3.492   5.452
  488   HD13  ILE  25          HD13      ILE  25  39.814  -2.948   4.573
  489    H    GLY  26           HN       GLY  26  40.238   1.939   7.570
  490    HA2  GLY  26           HA2      GLY  26  42.617   3.043   6.551
  491    HA3  GLY  26           HA1      GLY  26  41.334   3.968   7.326
  492    H    HIS  27           HN       HIS  27  41.350   3.067   9.887
  493    HA   HIS  27           HA       HIS  27  43.580   4.406  11.023
  494    HB2  HIS  27           HB2      HIS  27  41.329   4.235  12.092
  495    HB3  HIS  27           HB1      HIS  27  41.647   2.528  12.399
  496    HD2  HIS  27           HD2      HIS  27  42.576   5.995  13.889
  497    HE1  HIS  27           HE1      HIS  27  44.788   3.088  16.007
  498    HE2  HIS  27           HE2      HIS  27  44.114   5.536  15.949
  499    H    LEU  28           HN       LEU  28  42.777   0.996  10.566
  500    HA   LEU  28           HA       LEU  28  44.937  -0.046  12.090
  501    HB2  LEU  28           HB2      LEU  28  43.200  -1.213   9.916
  502    HB3  LEU  28           HB1      LEU  28  44.470  -2.142  10.715
  503    HG   LEU  28           HG       LEU  28  42.311  -0.683  12.254
  504   HD11  LEU  28          HD11      LEU  28  41.310  -2.380  10.722
  505   HD12  LEU  28          HD12      LEU  28  41.135  -2.818  12.421
  506   HD13  LEU  28          HD13      LEU  28  42.365  -3.604  11.431
  507   HD21  LEU  28          HD21      LEU  28  44.384  -2.802  12.889
  508   HD22  LEU  28          HD22      LEU  28  43.008  -2.490  13.947
  509   HD23  LEU  28          HD23      LEU  28  44.186  -1.216  13.638
  510    H    ASN  29           HN       ASN  29  44.572   0.856   8.708
  511    HA   ASN  29           HA       ASN  29  46.083   1.159   7.015
  512    HB2  ASN  29           HB2      ASN  29  47.709   1.555   9.472
  513    HB3  ASN  29           HB1      ASN  29  48.584   1.296   7.965
  514   HD21  ASN  29          HD21      ASN  29  47.524   3.756   9.847
  515   HD22  ASN  29          HD22      ASN  29  47.190   4.923   8.661
  516    H    GLN  30           HN       GLN  30  48.355  -0.620   9.056
  517    HA   GLN  30           HA       GLN  30  48.740  -2.581   6.964
  518    HB2  GLN  30           HB2      GLN  30  50.001  -2.050   9.641
  519    HB3  GLN  30           HB1      GLN  30  50.342  -3.539   8.756
  520    HG2  GLN  30           HG2      GLN  30  50.954  -2.116   6.765
  521    HG3  GLN  30           HG1      GLN  30  50.803  -0.700   7.804
  522   HE21  GLN  30          HE21      GLN  30  53.221  -0.473   7.254
  523   HE22  GLN  30          HE22      GLN  30  54.324  -1.337   8.211
  524    H    ILE  31           HN       ILE  31  48.206  -4.729   7.032
  525    HA   ILE  31           HA       ILE  31  45.885  -5.500   8.427
  526    HB   ILE  31           HB       ILE  31  48.007  -7.122   7.015
  527   HG12  ILE  31          HG12      ILE  31  45.158  -6.550   6.180
  528   HG13  ILE  31          HG11      ILE  31  46.475  -5.445   5.782
  529   HG21  ILE  31          HG21      ILE  31  46.964  -8.616   8.578
  530   HG22  ILE  31          HG22      ILE  31  46.181  -8.899   7.023
  531   HG23  ILE  31          HG23      ILE  31  45.368  -7.936   8.257
  532   HD11  ILE  31          HD11      ILE  31  46.405  -8.393   5.070
  533   HD12  ILE  31          HD12      ILE  31  47.671  -7.247   4.628
  534   HD13  ILE  31          HD13      ILE  31  46.051  -7.073   3.955
  535    H    LYS  32           HN       LYS  32  49.320  -6.174   9.025
  536    HA   LYS  32           HA       LYS  32  50.426  -6.956  10.878
  537    HB2  LYS  32           HB2      LYS  32  48.018  -5.598  12.055
  538    HB3  LYS  32           HB1      LYS  32  49.150  -6.458  13.098
  539    HG2  LYS  32           HG2      LYS  32  50.970  -5.071  12.437
  540    HG3  LYS  32           HG1      LYS  32  50.064  -4.400  11.080
  541    HD2  LYS  32           HD2      LYS  32  48.482  -3.351  12.668
  542    HD3  LYS  32           HD1      LYS  32  49.417  -3.999  14.017
  543    HE2  LYS  32           HE2      LYS  32  51.356  -2.698  13.377
  544    HE3  LYS  32           HE1      LYS  32  50.566  -2.169  11.893
  545    HZ1  LYS  32           HZ1      LYS  32  50.550  -0.618  13.920
  546    HZ2  LYS  32           HZ2      LYS  32  49.332  -1.642  14.517
  547    HZ3  LYS  32           HZ3      LYS  32  49.110  -0.820  13.046
  548    H    ARG  33           HN       ARG  33  50.524  -9.134  10.627
  549    HA   ARG  33           HA       ARG  33  48.558 -10.702  12.133
  550    HB2  ARG  33           HB2      ARG  33  47.985 -12.141  10.413
  551    HB3  ARG  33           HB1      ARG  33  48.122 -10.618   9.542
  552    HG2  ARG  33           HG2      ARG  33  50.273 -12.759   9.719
  553    HG3  ARG  33           HG1      ARG  33  49.269 -12.400   8.316
  554    HD2  ARG  33           HD2      ARG  33  50.164  -9.983   8.544
  555    HD3  ARG  33           HD1      ARG  33  51.418 -10.698   9.551
  556    HE   ARG  33           HE       ARG  33  51.241 -12.170   7.153
  557   HH11  ARG  33          HH11      ARG  33  52.186  -9.016   8.306
  558   HH12  ARG  33          HH12      ARG  33  53.342  -8.774   7.043
  559   HH21  ARG  33          HH21      ARG  33  52.749 -11.824   5.521
  560   HH22  ARG  33          HH22      ARG  33  53.661 -10.352   5.474
  561    H1   MET   1           HT1      MET   1   8.246   0.599  23.644
  562    H2   MET   1           HT2      MET   1   6.650   0.172  23.245
  563    H3   MET   1           HT3      MET   1   7.286   1.660  22.732
  564    HA   MET   1           HA       MET   1   8.803   0.602  21.253
  565    HB2  MET   1           HB2      MET   1   8.159  -1.675  22.966
  566    HB3  MET   1           HB1      MET   1   8.086  -2.088  21.253
  567    HG2  MET   1           HG2      MET   1  10.343  -1.089  20.942
  568    HG3  MET   1           HG1      MET   1  10.416  -0.767  22.674
  569    HE1  MET   1           HE1      MET   1  10.989  -2.149  24.364
  570    HE2  MET   1           HE2      MET   1  11.083  -3.907  24.412
  571    HE3  MET   1           HE3      MET   1   9.509  -3.118  24.337
  572    H    PHE   2           HN       PHE   2   5.934   1.513  21.526
  573    HA   PHE   2           HA       PHE   2   4.309  -0.072  19.816
  574    HB2  PHE   2           HB2      PHE   2   4.193   2.799  20.719
  575    HB3  PHE   2           HB1      PHE   2   3.020   2.132  19.585
  576    HD1  PHE   2           HD1      PHE   2   4.049   2.343  23.042
  577    HD2  PHE   2           HD2      PHE   2   1.683   0.089  20.256
  578    HE1  PHE   2           HE1      PHE   2   2.795   1.331  24.927
  579    HE2  PHE   2           HE2      PHE   2   0.428  -0.924  22.140
  580    HZ   PHE   2           HZ       PHE   2   0.984  -0.303  24.476
  581    H    GLU   3           HN       GLU   3   6.420   2.729  19.256
  582    HA   GLU   3           HA       GLU   3   5.758   2.716  16.443
  583    HB2  GLU   3           HB2      GLU   3   7.797   4.395  17.897
  584    HB3  GLU   3           HB1      GLU   3   7.201   4.650  16.257
  585    HG2  GLU   3           HG2      GLU   3   5.788   6.080  17.381
  586    HG3  GLU   3           HG1      GLU   3   4.841   4.598  17.478
  587    HA   PRO   4           HA       PRO   4   9.115  -0.178  15.662
  588    HB2  PRO   4           HB2      PRO   4   9.045  -0.112  12.924
  589    HB3  PRO   4           HB1      PRO   4   7.902  -1.040  13.911
  590    HG2  PRO   4           HG2      PRO   4   7.553   1.606  12.594
  591    HG3  PRO   4           HG1      PRO   4   6.407   0.262  12.754
  592    HD2  PRO   4           HD2      PRO   4   6.308   2.489  14.339
  593    HD3  PRO   4           HD1      PRO   4   5.767   0.888  14.890
  594    H    PHE   5           HN       PHE   5   8.929   3.039  14.256
  595    HA   PHE   5           HA       PHE   5  11.525   3.176  13.150
  596    HB2  PHE   5           HB2      PHE   5  10.946   5.294  12.625
  597    HB3  PHE   5           HB1      PHE   5   9.354   4.852  13.238
  598    HD1  PHE   5           HD1      PHE   5  12.135   7.044  13.626
  599    HD2  PHE   5           HD2      PHE   5   8.984   5.118  15.813
  600    HE1  PHE   5           HE1      PHE   5  12.376   8.713  15.444
  601    HE2  PHE   5           HE2      PHE   5   9.222   6.786  17.633
  602    HZ   PHE   5           HZ       PHE   5  10.919   8.584  17.447
  603    H    GLN   6           HN       GLN   6  10.520   2.996  16.405
  604    HA   GLN   6           HA       GLN   6  12.406   4.615  17.707
  605    HB2  GLN   6           HB2      GLN   6  10.472   3.513  18.816
  606    HB3  GLN   6           HB1      GLN   6  11.286   1.958  18.637
  607    HG2  GLN   6           HG2      GLN   6  13.241   2.944  19.915
  608    HG3  GLN   6           HG1      GLN   6  12.225   4.345  20.247
  609   HE21  GLN   6          HE21      GLN   6  11.619   4.114  22.416
  610   HE22  GLN   6          HE22      GLN   6  10.954   2.701  23.080
  611    H    ILE   7           HN       ILE   7  12.630   1.313  16.449
  612    HA   ILE   7           HA       ILE   7  15.065   0.583  17.617
  613    HB   ILE   7           HB       ILE   7  15.251  -1.065  15.808
  614   HG12  ILE   7          HG12      ILE   7  13.024  -0.833  14.246
  615   HG13  ILE   7          HG11      ILE   7  13.443   0.858  14.467
  616   HG21  ILE   7          HG21      ILE   7  12.401  -0.634  16.753
  617   HG22  ILE   7          HG22      ILE   7  13.661  -1.489  17.642
  618   HG23  ILE   7          HG23      ILE   7  13.051  -2.148  16.124
  619   HD11  ILE   7          HD11      ILE   7  15.875   0.071  13.853
  620   HD12  ILE   7          HD12      ILE   7  14.686   0.304  12.570
  621   HD13  ILE   7          HD13      ILE   7  15.040  -1.319  13.157
  622    H    LEU   8           HN       LEU   8  14.398   2.420  14.659
  623    HA   LEU   8           HA       LEU   8  17.110   2.514  13.806
  624    HB2  LEU   8           HB2      LEU   8  15.201   2.809  12.261
  625    HB3  LEU   8           HB1      LEU   8  14.781   4.312  13.082
  626    HG   LEU   8           HG       LEU   8  17.031   5.219  12.503
  627   HD11  LEU   8          HD11      LEU   8  18.357   3.243  12.281
  628   HD12  LEU   8          HD12      LEU   8  18.253   3.929  10.659
  629   HD13  LEU   8          HD13      LEU   8  17.249   2.547  11.098
  630   HD21  LEU   8          HD21      LEU   8  15.178   5.763  11.037
  631   HD22  LEU   8          HD22      LEU   8  15.304   4.203  10.224
  632   HD23  LEU   8          HD23      LEU   8  16.578   5.406  10.027
  633    H    SER   9           HN       SER   9  15.063   4.524  15.797
  634    HA   SER   9           HA       SER   9  16.780   6.798  15.926
  635    HB2  SER   9           HB2      SER   9  14.420   6.954  16.543
  636    HB3  SER   9           HB1      SER   9  14.675   5.830  17.874
  637    HG   SER   9           HG       SER   9  16.127   7.344  18.767
  638    H    ILE  10           HN       ILE  10  16.268   4.057  18.146
  639    HA   ILE  10           HA       ILE  10  18.198   4.825  20.048
  640    HB   ILE  10           HB       ILE  10  17.134   2.080  19.333
  641   HG12  ILE  10          HG12      ILE  10  16.473   3.850  21.702
  642   HG13  ILE  10          HG11      ILE  10  15.557   3.912  20.194
  643   HG21  ILE  10          HG21      ILE  10  18.921   3.053  21.576
  644   HG22  ILE  10          HG22      ILE  10  19.176   1.687  20.490
  645   HG23  ILE  10          HG23      ILE  10  17.935   1.599  21.739
  646   HD11  ILE  10          HD11      ILE  10  15.999   1.401  21.834
  647   HD12  ILE  10          HD12      ILE  10  15.003   1.544  20.387
  648   HD13  ILE  10          HD13      ILE  10  14.530   2.374  21.868
  649    H    CYS  11           HN       CYS  11  18.424   2.718  17.179
  650    HA   CYS  11           HA       CYS  11  21.079   1.879  17.568
  651    HB2  CYS  11           HB2      CYS  11  19.423   2.256  15.069
  652    HB3  CYS  11           HB1      CYS  11  21.042   1.555  15.055
  653    HG   CYS  11           HG       CYS  11  20.162  -0.401  16.548
  654    H    SER  12           HN       SER  12  19.790   4.620  15.643
  655    HA   SER  12           HA       SER  12  22.258   5.584  14.761
  656    HB2  SER  12           HB2      SER  12  20.131   6.358  13.831
  657    HB3  SER  12           HB1      SER  12  19.716   7.116  15.365
  658    HG   SER  12           HG       SER  12  21.456   8.503  15.106
  659    H    PHE  13           HN       PHE  13  20.408   6.346  17.698
  660    HA   PHE  13           HA       PHE  13  22.042   8.387  18.674
  661    HB2  PHE  13           HB2      PHE  13  19.864   7.871  19.650
  662    HB3  PHE  13           HB1      PHE  13  20.458   6.303  20.196
  663    HD1  PHE  13           HD1      PHE  13  21.332   9.945  20.407
  664    HD2  PHE  13           HD2      PHE  13  21.306   6.121  22.364
  665    HE1  PHE  13           HE1      PHE  13  22.190  11.000  22.480
  666    HE2  PHE  13           HE2      PHE  13  22.166   7.176  24.436
  667    HZ   PHE  13           HZ       PHE  13  22.608   9.615  24.495
  668    H    ILE  14           HN       ILE  14  22.202   4.878  19.262
  669    HA   ILE  14           HA       ILE  14  24.420   4.923  20.995
  670    HB   ILE  14           HB       ILE  14  23.412   2.774  19.116
  671   HG12  ILE  14          HG12      ILE  14  22.009   3.680  21.104
  672   HG13  ILE  14          HG11      ILE  14  22.230   1.936  20.986
  673   HG21  ILE  14          HG21      ILE  14  25.662   2.170  19.528
  674   HG22  ILE  14          HG22      ILE  14  24.759   1.289  20.758
  675   HG23  ILE  14          HG23      ILE  14  25.618   2.770  21.186
  676   HD11  ILE  14          HD11      ILE  14  22.619   3.111  23.288
  677   HD12  ILE  14          HD12      ILE  14  24.166   3.599  22.596
  678   HD13  ILE  14          HD13      ILE  14  23.769   1.887  22.757
  679    H    LEU  15           HN       LEU  15  24.233   4.489  17.468
  680    HA   LEU  15           HA       LEU  15  27.009   4.134  17.047
  681    HB2  LEU  15           HB2      LEU  15  24.784   5.073  15.219
  682    HB3  LEU  15           HB1      LEU  15  26.420   4.710  14.669
  683    HG   LEU  15           HG       LEU  15  24.760   2.710  16.217
  684   HD11  LEU  15          HD11      LEU  15  23.535   3.268  14.170
  685   HD12  LEU  15          HD12      LEU  15  24.270   1.673  14.004
  686   HD13  LEU  15          HD13      LEU  15  25.003   3.069  13.213
  687   HD21  LEU  15          HD21      LEU  15  27.147   2.245  16.174
  688   HD22  LEU  15          HD22      LEU  15  27.210   2.531  14.436
  689   HD23  LEU  15          HD23      LEU  15  26.347   1.129  15.067
  690    H    SER  16           HN       SER  16  25.007   6.955  17.423
  691    HA   SER  16           HA       SER  16  26.824   8.851  16.288
  692    HB2  SER  16           HB2      SER  16  24.413   9.311  16.514
  693    HB3  SER  16           HB1      SER  16  24.571   9.259  18.267
  694    HG   SER  16           HG       SER  16  25.510  11.162  18.243
  695    H    ALA  17           HN       ALA  17  26.075   7.819  19.605
  696    HA   ALA  17           HA       ALA  17  27.907   9.569  20.886
  697    HB1  ALA  17           HB1      ALA  17  26.145   8.628  22.201
  698    HB2  ALA  17           HB2      ALA  17  27.650   7.940  22.812
  699    HB3  ALA  17           HB3      ALA  17  26.605   6.984  21.759
  700    H    LEU  18           HN       LEU  18  28.182   6.254  19.621
  701    HA   LEU  18           HA       LEU  18  30.800   5.828  20.676
  702    HB2  LEU  18           HB2      LEU  18  29.077   4.440  18.637
  703    HB3  LEU  18           HB1      LEU  18  30.745   3.941  18.919
  704    HG   LEU  18           HG       LEU  18  28.814   4.263  21.216
  705   HD11  LEU  18          HD11      LEU  18  27.776   2.697  19.619
  706   HD12  LEU  18          HD12      LEU  18  28.363   1.836  21.041
  707   HD13  LEU  18          HD13      LEU  18  29.280   1.778  19.536
  708   HD21  LEU  18          HD21      LEU  18  31.291   2.565  20.765
  709   HD22  LEU  18          HD22      LEU  18  30.365   2.650  22.263
  710   HD23  LEU  18          HD23      LEU  18  31.241   4.067  21.686
  711    H    HIS  19           HN       HIS  19  29.503   7.265  17.741
  712    HA   HIS  19           HA       HIS  19  31.879   7.098  16.186
  713    HB2  HIS  19           HB2      HIS  19  29.570   7.546  15.301
  714    HB3  HIS  19           HB1      HIS  19  29.683   9.164  15.992
  715    HD2  HIS  19           HD2      HIS  19  31.453  10.920  14.623
  716    HE1  HIS  19           HE1      HIS  19  32.398   8.236  11.505
  717    HE2  HIS  19           HE2      HIS  19  32.619  10.637  12.303
  718    H    PHE  20           HN       PHE  20  30.457   9.683  18.193
  719    HA   PHE  20           HA       PHE  20  32.650  11.469  17.783
  720    HB2  PHE  20           HB2      PHE  20  30.144  11.490  19.246
  721    HB3  PHE  20           HB1      PHE  20  31.452  12.197  20.193
  722    HD1  PHE  20           HD1      PHE  20  30.125  12.227  16.671
  723    HD2  PHE  20           HD2      PHE  20  31.981  14.438  19.855
  724    HE1  PHE  20           HE1      PHE  20  30.037  14.289  15.295
  725    HE2  PHE  20           HE2      PHE  20  31.891  16.498  18.477
  726    HZ   PHE  20           HZ       PHE  20  30.924  16.425  16.193
  727    H    MET  21           HN       MET  21  31.988   8.885  20.045
  728    HA   MET  21           HA       MET  21  33.861   9.562  22.044
  729    HB2  MET  21           HB2      MET  21  32.427   7.115  21.171
  730    HB3  MET  21           HB1      MET  21  33.871   6.878  22.159
  731    HG2  MET  21           HG2      MET  21  32.956   8.505  23.816
  732    HG3  MET  21           HG1      MET  21  31.481   8.610  22.856
  733    HE1  MET  21           HE1      MET  21  30.494   8.340  24.945
  734    HE2  MET  21           HE2      MET  21  30.448   6.915  25.978
  735    HE3  MET  21           HE3      MET  21  29.404   7.001  24.563
  736    H    ALA  22           HN       ALA  22  34.193   7.345  19.248
  737    HA   ALA  22           HA       ALA  22  36.946   6.842  19.694
  738    HB1  ALA  22           HB1      ALA  22  35.928   5.262  18.328
  739    HB2  ALA  22           HB2      ALA  22  36.814   6.236  17.156
  740    HB3  ALA  22           HB3      ALA  22  35.082   6.480  17.376
  741    H    TRP  23           HN       TRP  23  35.222   9.213  17.705
  742    HA   TRP  23           HA       TRP  23  37.438  10.258  16.333
  743    HB2  TRP  23           HB2      TRP  23  34.693  10.835  16.540
  744    HB3  TRP  23           HB1      TRP  23  35.536  12.325  16.959
  745    HD1  TRP  23           HD1      TRP  23  34.780  10.035  14.070
  746    HE1  TRP  23           HE1      TRP  23  35.774  11.028  11.907
  747    HE3  TRP  23           HE3      TRP  23  37.607  13.801  16.046
  748    HZ2  TRP  23           HZ2      TRP  23  37.535  13.145  11.120
  749    HZ3  TRP  23           HZ3      TRP  23  38.931  15.288  14.571
  750    HH2  TRP  23           HH2      TRP  23  38.899  14.965  12.113
  751    H    THR  24           HN       THR  24  35.918  11.367  19.365
  752    HA   THR  24           HA       THR  24  37.572  13.525  19.907
  753    HB   THR  24           HB       THR  24  37.096  12.821  22.384
  754    HG1  THR  24           HG1      THR  24  36.127  10.989  22.556
  755   HG21  THR  24          HG21      THR  24  35.892  14.634  21.392
  756   HG22  THR  24          HG22      THR  24  34.676  13.546  22.063
  757   HG23  THR  24          HG23      THR  24  34.998  13.545  20.329
  758    H    ILE  25           HN       ILE  25  37.995  10.104  20.848
  759    HA   ILE  25           HA       ILE  25  40.468  10.497  22.178
  760    HB   ILE  25           HB       ILE  25  39.260   8.062  20.865
  761   HG12  ILE  25          HG12      ILE  25  39.679   8.759  23.782
  762   HG13  ILE  25          HG11      ILE  25  38.186   9.107  22.910
  763   HG21  ILE  25          HG21      ILE  25  41.660   7.739  20.857
  764   HG22  ILE  25          HG22      ILE  25  40.997   6.814  22.205
  765   HG23  ILE  25          HG23      ILE  25  41.794   8.358  22.504
  766   HD11  ILE  25          HD11      ILE  25  38.142   6.626  22.285
  767   HD12  ILE  25          HD12      ILE  25  37.827   7.006  23.978
  768   HD13  ILE  25          HD13      ILE  25  39.411   6.404  23.490
  769    H    GLY  26           HN       GLY  26  39.656   9.775  18.834
  770    HA2  GLY  26           HA2      GLY  26  42.236   9.229  17.859
  771    HA3  GLY  26           HA1      GLY  26  40.908   9.857  16.889
  772    H    HIS  27           HN       HIS  27  40.447  12.317  17.940
  773    HA   HIS  27           HA       HIS  27  42.546  13.883  16.850
  774    HB2  HIS  27           HB2      HIS  27  40.145  14.568  16.915
  775    HB3  HIS  27           HB1      HIS  27  40.299  14.798  18.657
  776    HD2  HIS  27           HD2      HIS  27  41.195  16.661  15.368
  777    HE1  HIS  27           HE1      HIS  27  42.841  18.886  18.556
  778    HE2  HIS  27           HE2      HIS  27  42.347  18.899  16.065
  779    H    LEU  28           HN       LEU  28  41.607  13.062  20.155
  780    HA   LEU  28           HA       LEU  28  43.424  14.821  21.447
  781    HB2  LEU  28           HB2      LEU  28  41.990  12.323  22.345
  782    HB3  LEU  28           HB1      LEU  28  43.052  13.243  23.414
  783    HG   LEU  28           HG       LEU  28  40.771  14.524  21.895
  784   HD11  LEU  28          HD11      LEU  28  39.924  12.736  23.414
  785   HD12  LEU  28          HD12      LEU  28  39.448  14.349  23.943
  786   HD13  LEU  28          HD13      LEU  28  40.769  13.510  24.754
  787   HD21  LEU  28          HD21      LEU  28  42.573  15.322  24.196
  788   HD22  LEU  28          HD22      LEU  28  41.067  16.170  23.850
  789   HD23  LEU  28          HD23      LEU  28  42.358  16.143  22.651
  790    H    ASN  29           HN       ASN  29  43.671  11.499  20.313
  791    HA   ASN  29           HA       ASN  29  45.451  10.092  20.021
  792    HB2  ASN  29           HB2      ASN  29  46.678  12.797  19.898
  793    HB3  ASN  29           HB1      ASN  29  47.769  11.432  20.130
  794   HD21  ASN  29          HD21      ASN  29  46.579  13.295  17.716
  795   HD22  ASN  29          HD22      ASN  29  46.517  12.159  16.458
  796    H    GLN  30           HN       GLN  30  47.243  12.331  22.089
  797    HA   GLN  30           HA       GLN  30  47.836  10.188  23.940
  798    HB2  GLN  30           HB2      GLN  30  48.678  13.061  23.670
  799    HB3  GLN  30           HB1      GLN  30  49.062  12.136  25.122
  800    HG2  GLN  30           HG2      GLN  30  50.079  10.375  23.630
  801    HG3  GLN  30           HG1      GLN  30  49.852  11.476  22.273
  802   HE21  GLN  30          HE21      GLN  30  52.336  11.331  22.197
  803   HE22  GLN  30          HE22      GLN  30  53.213  12.385  23.197
  804    H    ILE  31           HN       ILE  31  47.165  10.019  26.046
  805    HA   ILE  31           HA       ILE  31  44.602  10.969  26.721
  806    HB   ILE  31           HB       ILE  31  46.815   9.793  28.408
  807   HG12  ILE  31          HG12      ILE  31  44.182   8.565  27.576
  808   HG13  ILE  31          HG11      ILE  31  45.611   8.463  26.548
  809   HG21  ILE  31          HG21      ILE  31  45.441  11.061  29.912
  810   HG22  ILE  31          HG22      ILE  31  44.906   9.386  30.042
  811   HG23  ILE  31          HG23      ILE  31  43.964  10.542  29.099
  812   HD11  ILE  31          HD11      ILE  31  45.474   7.533  29.432
  813   HD12  ILE  31          HD12      ILE  31  46.864   7.382  28.357
  814   HD13  ILE  31          HD13      ILE  31  45.388   6.477  28.022
  815    H    LYS  32           HN       LYS  32  47.845  12.052  27.684
  816    HA   LYS  32           HA       LYS  32  48.583  13.992  28.661
  817    HB2  LYS  32           HB2      LYS  32  46.108  14.872  27.203
  818    HB3  LYS  32           HB1      LYS  32  47.001  16.014  28.207
  819    HG2  LYS  32           HG2      LYS  32  48.988  15.750  26.920
  820    HG3  LYS  32           HG1      LYS  32  48.357  14.319  26.102
  821    HD2  LYS  32           HD2      LYS  32  46.610  15.708  25.037
  822    HD3  LYS  32           HD1      LYS  32  47.269  17.138  25.833
  823    HE2  LYS  32           HE2      LYS  32  49.367  16.909  24.646
  824    HE3  LYS  32           HE1      LYS  32  48.865  15.360  23.969
  825    HZ1  LYS  32           HZ1      LYS  32  48.617  17.464  22.547
  826    HZ2  LYS  32           HZ2      LYS  32  47.256  17.788  23.511
  827    HZ3  LYS  32           HZ3      LYS  32  47.328  16.363  22.589
  828    H    ARG  33           HN       ARG  33  48.580  13.599  30.821
  829    HA   ARG  33           HA       ARG  33  46.299  14.661  32.327
  830    HB2  ARG  33           HB2      ARG  33  45.922  12.772  33.610
  831    HB3  ARG  33           HB1      ARG  33  46.296  12.046  32.052
  832    HG2  ARG  33           HG2      ARG  33  48.248  12.403  34.354
  833    HG3  ARG  33           HG1      ARG  33  47.509  10.890  33.835
  834    HD2  ARG  33           HD2      ARG  33  48.509  11.431  31.512
  835    HD3  ARG  33           HD1      ARG  33  49.535  12.569  32.378
  836    HE   ARG  33           HE       ARG  33  49.654  10.071  33.682
  837   HH11  ARG  33          HH11      ARG  33  50.600  11.586  30.686
  838   HH12  ARG  33          HH12      ARG  33  51.959  10.543  30.453
  839   HH21  ARG  33          HH21      ARG  33  51.427   8.727  33.350
  840   HH22  ARG  33          HH22      ARG  33  52.427   8.932  31.950
  841    H1   MET   1           HT1      MET   1   5.489  20.387  17.355
  842    H2   MET   1           HT2      MET   1   3.951  19.721  17.634
  843    H3   MET   1           HT3      MET   1   4.817  19.310  16.231
  844    HA   MET   1           HA       MET   1   6.449  18.130  17.476
  845    HB2  MET   1           HB2      MET   1   5.290  19.732  19.628
  846    HB3  MET   1           HB1      MET   1   5.471  18.038  20.082
  847    HG2  MET   1           HG2      MET   1   7.838  18.112  19.318
  848    HG3  MET   1           HG1      MET   1   7.645  19.826  18.955
  849    HE1  MET   1           HE1      MET   1   7.773  21.606  20.336
  850    HE2  MET   1           HE2      MET   1   7.678  21.691  22.093
  851    HE3  MET   1           HE3      MET   1   6.229  21.332  21.155
  852    H    PHE   2           HN       PHE   2   3.683  17.889  16.281
  853    HA   PHE   2           HA       PHE   2   2.224  15.939  17.747
  854    HB2  PHE   2           HB2      PHE   2   2.247  16.774  14.855
  855    HB3  PHE   2           HB1      PHE   2   1.225  15.460  15.436
  856    HD1  PHE   2           HD1      PHE   2   1.660  19.042  15.227
  857    HD2  PHE   2           HD2      PHE   2  -0.410  15.913  17.316
  858    HE1  PHE   2           HE1      PHE   2   0.003  20.690  16.055
  859    HE2  PHE   2           HE2      PHE   2  -2.067  17.559  18.145
  860    HZ   PHE   2           HZ       PHE   2  -1.861  19.949  17.515
  861    H    GLU   3           HN       GLU   3   4.675  15.723  15.187
  862    HA   GLU   3           HA       GLU   3   4.509  12.838  15.219
  863    HB2  GLU   3           HB2      GLU   3   6.427  14.603  13.704
  864    HB3  GLU   3           HB1      GLU   3   6.151  12.883  13.440
  865    HG2  GLU   3           HG2      GLU   3   4.718  13.724  11.846
  866    HG3  GLU   3           HG1      GLU   3   3.624  13.673  13.226
  867    HA   PRO   4           HA       PRO   4   7.636  12.690  18.451
  868    HB2  PRO   4           HB2      PRO   4   8.048   9.982  18.460
  869    HB3  PRO   4           HB1      PRO   4   6.662  10.766  19.241
  870    HG2  PRO   4           HG2      PRO   4   6.818   9.375  16.615
  871    HG3  PRO   4           HG1      PRO   4   5.532   9.349  17.833
  872    HD2  PRO   4           HD2      PRO   4   5.387  10.865  15.562
  873    HD3  PRO   4           HD1      PRO   4   4.599  11.333  17.085
  874    H    PHE   5           HN       PHE   5   8.026  11.234  15.275
  875    HA   PHE   5           HA       PHE   5  10.777  10.600  15.427
  876    HB2  PHE   5           HB2      PHE   5  10.514   9.953  13.280
  877    HB3  PHE   5           HB1      PHE   5   8.804  10.284  13.545
  878    HD1  PHE   5           HD1      PHE   5  11.686  11.124  11.625
  879    HD2  PHE   5           HD2      PHE   5   8.025  12.752  13.165
  880    HE1  PHE   5           HE1      PHE   5  11.780  12.936   9.934
  881    HE2  PHE   5           HE2      PHE   5   8.114  14.564  11.474
  882    HZ   PHE   5           HZ       PHE   5   9.994  14.654   9.858
  883    H    GLN   6           HN       GLN   6   9.215  13.629  15.423
  884    HA   GLN   6           HA       GLN   6  10.997  15.221  13.946
  885    HB2  GLN   6           HB2      GLN   6   8.800  15.988  14.818
  886    HB3  GLN   6           HB1      GLN   6   9.468  15.973  16.451
  887    HG2  GLN   6           HG2      GLN   6  11.264  17.561  15.624
  888    HG3  GLN   6           HG1      GLN   6  10.354  17.693  14.121
  889   HE21  GLN   6          HE21      GLN   6   9.363  19.726  14.227
  890   HE22  GLN   6          HE22      GLN   6   8.453  20.281  15.548
  891    H    ILE   7           HN       ILE   7  11.096  14.064  17.286
  892    HA   ILE   7           HA       ILE   7  13.209  15.648  18.218
  893    HB   ILE   7           HB       ILE   7  13.535  13.920  19.931
  894   HG12  ILE   7          HG12      ILE   7  11.644  11.989  19.530
  895   HG13  ILE   7          HG11      ILE   7  12.188  12.260  17.882
  896   HG21  ILE   7          HG21      ILE   7  10.624  14.351  19.197
  897   HG22  ILE   7          HG22      ILE   7  11.620  15.456  20.144
  898   HG23  ILE   7          HG23      ILE   7  11.214  13.864  20.785
  899   HD11  ILE   7          HD11      ILE   7  14.598  12.088  18.919
  900   HD12  ILE   7          HD12      ILE   7  13.678  10.615  18.611
  901   HD13  ILE   7          HD13      ILE   7  13.758  11.275  20.242
  902    H    LEU   8           HN       LEU   8  13.245  12.606  16.420
  903    HA   LEU   8           HA       LEU   8  16.064  12.224  16.613
  904    HB2  LEU   8           HB2      LEU   8  14.491  10.367  16.179
  905    HB3  LEU   8           HB1      LEU   8  14.091  11.083  14.618
  906    HG   LEU   8           HG       LEU   8  16.488  10.896  13.954
  907   HD11  LEU   8          HD11      LEU   8  17.625  10.935  16.057
  908   HD12  LEU   8          HD12      LEU   8  17.873   9.312  15.413
  909   HD13  LEU   8          HD13      LEU   8  16.673   9.586  16.677
  910   HD21  LEU   8          HD21      LEU   8  14.982   9.121  13.276
  911   HD22  LEU   8          HD22      LEU   8  15.090   8.362  14.864
  912   HD23  LEU   8          HD23      LEU   8  16.495   8.378  13.797
  913    H    SER   9           HN       SER   9  13.924  13.811  14.366
  914    HA   SER   9           HA       SER   9  15.811  14.205  12.258
  915    HB2  SER   9           HB2      SER   9  13.410  14.398  11.853
  916    HB3  SER   9           HB1      SER   9  13.317  15.768  12.956
  917    HG   SER   9           HG       SER   9  14.739  16.882  11.565
  918    H    ILE  10           HN       ILE  10  14.652  16.333  14.872
  919    HA   ILE  10           HA       ILE  10  16.290  18.535  14.236
  920    HB   ILE  10           HB       ILE  10  15.092  17.678  16.883
  921   HG12  ILE  10          HG12      ILE  10  14.215  19.872  14.988
  922   HG13  ILE  10          HG11      ILE  10  13.585  18.227  14.881
  923   HG21  ILE  10          HG21      ILE  10  16.552  20.187  16.025
  924   HG22  ILE  10          HG22      ILE  10  16.852  19.180  17.441
  925   HG23  ILE  10          HG23      ILE  10  15.410  20.192  17.369
  926   HD11  ILE  10          HD11      ILE  10  13.477  19.951  17.373
  927   HD12  ILE  10          HD12      ILE  10  12.767  18.349  17.176
  928   HD13  ILE  10          HD13      ILE  10  12.131  19.713  16.258
  929    H    CYS  11           HN       CYS  11  16.789  15.781  16.437
  930    HA   CYS  11           HA       CYS  11  19.242  16.631  17.522
  931    HB2  CYS  11           HB2      CYS  11  18.088  13.878  17.060
  932    HB3  CYS  11           HB1      CYS  11  19.604  14.154  17.917
  933    HG   CYS  11           HG       CYS  11  18.286  15.499  19.730
  934    H    SER  12           HN       SER  12  18.588  14.488  14.724
  935    HA   SER  12           HA       SER  12  21.258  14.027  14.036
  936    HB2  SER  12           HB2      SER  12  19.411  12.733  13.086
  937    HB3  SER  12           HB1      SER  12  18.822  14.163  12.243
  938    HG   SER  12           HG       SER  12  20.711  14.188  11.042
  939    H    PHE  13           HN       PHE  13  19.021  16.587  13.017
  940    HA   PHE  13           HA       PHE  13  20.656  17.809  11.111
  941    HB2  PHE  13           HB2      PHE  13  18.302  18.394  11.381
  942    HB3  PHE  13           HB1      PHE  13  18.628  19.055  12.984
  943    HD1  PHE  13           HD1      PHE  13  19.819  19.373   9.440
  944    HD2  PHE  13           HD2      PHE  13  19.068  21.338  13.185
  945    HE1  PHE  13           HE1      PHE  13  20.410  21.552   8.414
  946    HE2  PHE  13           HE2      PHE  13  19.660  23.518  12.160
  947    HZ   PHE  13           HZ       PHE  13  20.331  23.625   9.774
  948    H    ILE  14           HN       ILE  14  20.356  18.457  14.602
  949    HA   ILE  14           HA       ILE  14  22.233  20.552  14.720
  950    HB   ILE  14           HB       ILE  14  21.353  18.551  16.815
  951   HG12  ILE  14          HG12      ILE  14  19.725  20.252  15.717
  952   HG13  ILE  14          HG11      ILE  14  19.785  20.196  17.476
  953   HG21  ILE  14          HG21      ILE  14  23.423  19.359  17.625
  954   HG22  ILE  14          HG22      ILE  14  22.235  20.421  18.377
  955   HG23  ILE  14          HG23      ILE  14  23.153  20.977  16.976
  956   HD11  ILE  14          HD11      ILE  14  19.888  22.516  16.280
  957   HD12  ILE  14          HD12      ILE  14  21.572  22.101  15.966
  958   HD13  ILE  14          HD13      ILE  14  20.982  22.208  17.625
  959    H    LEU  15           HN       LEU  15  22.612  17.062  15.240
  960    HA   LEU  15           HA       LEU  15  25.373  17.127  15.879
  961    HB2  LEU  15           HB2      LEU  15  23.604  14.929  14.781
  962    HB3  LEU  15           HB1      LEU  15  25.263  14.677  15.320
  963    HG   LEU  15           HG       LEU  15  23.164  15.933  17.100
  964   HD11  LEU  15          HD11      LEU  15  22.377  13.697  16.483
  965   HD12  LEU  15          HD12      LEU  15  22.963  13.681  18.146
  966   HD13  LEU  15          HD13      LEU  15  23.961  13.014  16.853
  967   HD21  LEU  15          HD21      LEU  15  25.464  16.316  17.798
  968   HD22  LEU  15          HD22      LEU  15  25.855  14.611  17.573
  969   HD23  LEU  15          HD23      LEU  15  24.757  15.101  18.862
  970    H    SER  16           HN       SER  16  23.634  17.128  12.871
  971    HA   SER  16           HA       SER  16  25.801  16.292  11.192
  972    HB2  SER  16           HB2      SER  16  23.446  16.085  10.493
  973    HB3  SER  16           HB1      SER  16  23.293  17.839  10.504
  974    HG   SER  16           HG       SER  16  24.413  17.953   8.705
  975    H    ALA  17           HN       ALA  17  24.394  19.437  12.058
  976    HA   ALA  17           HA       ALA  17  26.140  20.997  10.448
  977    HB1  ALA  17           HB1      ALA  17  24.090  21.996  11.174
  978    HB2  ALA  17           HB2      ALA  17  25.389  22.869  11.987
  979    HB3  ALA  17           HB3      ALA  17  24.453  21.660  12.866
  980    H    LEU  18           HN       LEU  18  26.288  19.840  13.805
  981    HA   LEU  18           HA       LEU  18  28.628  21.341  14.460
  982    HB2  LEU  18           HB2      LEU  18  27.151  19.048  15.732
  983    HB3  LEU  18           HB1      LEU  18  28.685  19.624  16.384
  984    HG   LEU  18           HG       LEU  18  26.434  21.546  15.803
  985   HD11  LEU  18          HD11      LEU  18  25.530  19.813  17.307
  986   HD12  LEU  18          HD12      LEU  18  25.773  21.327  18.178
  987   HD13  LEU  18          HD13      LEU  18  26.922  20.004  18.372
  988   HD21  LEU  18          HD21      LEU  18  28.765  21.552  17.748
  989   HD22  LEU  18          HD22      LEU  18  27.609  22.865  17.530
  990   HD23  LEU  18          HD23      LEU  18  28.708  22.434  16.222
  991    H    HIS  19           HN       HIS  19  28.011  18.200  13.000
  992    HA   HIS  19           HA       HIS  19  30.593  17.091  13.433
  993    HB2  HIS  19           HB2      HIS  19  28.529  15.811  12.789
  994    HB3  HIS  19           HB1      HIS  19  28.685  16.492  11.171
  995    HD2  HIS  19           HD2      HIS  19  30.835  15.434   9.638
  996    HE1  HIS  19           HE1      HIS  19  32.027  12.560  12.494
  997    HE2  HIS  19           HE2      HIS  19  32.349  13.357  10.104
  998    H    PHE  20           HN       PHE  20  29.117  18.799  10.668
  999    HA   PHE  20           HA       PHE  20  31.519  18.745   9.117
 1000    HB2  PHE  20           HB2      PHE  20  28.815  19.748   8.802
 1001    HB3  PHE  20           HB1      PHE  20  30.008  20.900   8.199
 1002    HD1  PHE  20           HD1      PHE  20  29.315  17.201   8.145
 1003    HD2  PHE  20           HD2      PHE  20  30.812  20.629   6.029
 1004    HE1  PHE  20           HE1      PHE  20  29.668  15.804   6.126
 1005    HE2  PHE  20           HE2      PHE  20  31.164  19.229   4.012
 1006    HZ   PHE  20           HZ       PHE  20  30.593  16.810   4.058
 1007    H    MET  21           HN       MET  21  30.218  20.888  11.555
 1008    HA   MET  21           HA       MET  21  31.774  23.178  11.004
 1009    HB2  MET  21           HB2      MET  21  30.270  22.096  13.321
 1010    HB3  MET  21           HB1      MET  21  31.490  23.323  13.671
 1011    HG2  MET  21           HG2      MET  21  30.474  24.777  11.914
 1012    HG3  MET  21           HG1      MET  21  29.205  23.573  11.693
 1013    HE1  MET  21           HE1      MET  21  27.851  25.461  11.803
 1014    HE2  MET  21           HE2      MET  21  27.481  26.486  13.186
 1015    HE3  MET  21           HE3      MET  21  26.712  24.909  13.039
 1016    H    ALA  22           HN       ALA  22  32.352  20.513  13.320
 1017    HA   ALA  22           HA       ALA  22  34.924  21.435  14.084
 1018    HB1  ALA  22           HB1      ALA  22  33.998  19.932  15.596
 1019    HB2  ALA  22           HB2      ALA  22  35.169  18.920  14.750
 1020    HB3  ALA  22           HB3      ALA  22  33.459  18.832  14.330
 1021    H    TRP  23           HN       TRP  23  33.823  19.147  11.615
 1022    HA   TRP  23           HA       TRP  23  36.336  18.172  10.834
 1023    HB2  TRP  23           HB2      TRP  23  33.668  17.890   9.989
 1024    HB3  TRP  23           HB1      TRP  23  34.572  18.429   8.574
 1025    HD1  TRP  23           HD1      TRP  23  34.096  15.479  10.864
 1026    HE1  TRP  23           HE1      TRP  23  35.545  13.513  10.036
 1027    HE3  TRP  23           HE3      TRP  23  36.908  17.877   7.339
 1028    HZ2  TRP  23           HZ2      TRP  23  37.624  13.023   8.127
 1029    HZ3  TRP  23           HZ3      TRP  23  38.610  16.645   6.028
 1030    HH2  TRP  23           HH2      TRP  23  38.972  14.219   6.420
 1031    H    THR  24           HN       THR  24  34.438  20.883   9.504
 1032    HA   THR  24           HA       THR  24  36.182  21.673   7.492
 1033    HB   THR  24           HB       THR  24  35.216  24.038   8.071
 1034    HG1  THR  24           HG1      THR  24  34.053  24.060   9.793
 1035   HG21  THR  24          HG21      THR  24  34.392  22.829   6.179
 1036   HG22  THR  24          HG22      THR  24  32.975  23.292   7.122
 1037   HG23  THR  24          HG23      THR  24  33.589  21.641   7.205
 1038    H    ILE  25           HN       ILE  25  36.091  22.713  10.913
 1039    HA   ILE  25           HA       ILE  25  38.319  24.455  10.719
 1040    HB   ILE  25           HB       ILE  25  37.114  22.978  13.060
 1041   HG12  ILE  25          HG12      ILE  25  37.092  25.917  12.324
 1042   HG13  ILE  25          HG11      ILE  25  35.816  24.792  11.857
 1043   HG21  ILE  25          HG21      ILE  25  39.432  23.393  13.621
 1044   HG22  ILE  25          HG22      ILE  25  38.457  24.615  14.435
 1045   HG23  ILE  25          HG23      ILE  25  39.345  25.029  12.969
 1046   HD11  ILE  25          HD11      ILE  25  35.627  24.198  14.339
 1047   HD12  ILE  25          HD12      ILE  25  35.063  25.804  13.880
 1048   HD13  ILE  25          HD13      ILE  25  36.638  25.609  14.649
 1049    H    GLY  26           HN       GLY  26  38.025  21.033  11.460
 1050    HA2  GLY  26           HA2      GLY  26  40.666  20.524  12.285
 1051    HA3  GLY  26           HA1      GLY  26  39.595  19.331  11.558
 1052    H    HIS  27           HN       HIS  27  39.215  20.260   9.035
 1053    HA   HIS  27           HA       HIS  27  41.619  19.529   7.715
 1054    HB2  HIS  27           HB2      HIS  27  39.327  19.164   6.796
 1055    HB3  HIS  27           HB1      HIS  27  39.198  20.903   6.530
 1056    HD2  HIS  27           HD2      HIS  27  40.835  17.800   4.861
 1057    HE1  HIS  27           HE1      HIS  27  42.125  21.200   2.718
 1058    HE2  HIS  27           HE2      HIS  27  42.071  18.662   2.729
 1059    H    LEU  28           HN       LEU  28  40.051  22.628   8.351
 1060    HA   LEU  28           HA       LEU  28  41.782  24.196   6.730
 1061    HB2  LEU  28           HB2      LEU  28  39.969  24.861   9.046
 1062    HB3  LEU  28           HB1      LEU  28  40.919  26.086   8.204
 1063    HG   LEU  28           HG       LEU  28  39.076  24.177   6.751
 1064   HD11  LEU  28          HD11      LEU  28  37.802  25.548   8.402
 1065   HD12  LEU  28          HD12      LEU  28  37.408  25.964   6.735
 1066   HD13  LEU  28          HD13      LEU  28  38.477  27.006   7.674
 1067   HD21  LEU  28          HD21      LEU  28  40.524  26.749   6.066
 1068   HD22  LEU  28          HD22      LEU  28  39.196  26.132   5.084
 1069   HD23  LEU  28          HD23      LEU  28  40.665  25.179   5.275
 1070    H    ASN  29           HN       ASN  29  41.880  23.165  10.092
 1071    HA   ASN  29           HA       ASN  29  43.531  23.205  11.675
 1072    HB2  ASN  29           HB2      ASN  29  45.032  23.266   9.110
 1073    HB3  ASN  29           HB1      ASN  29  45.920  23.700  10.569
 1074   HD21  ASN  29          HD21      ASN  29  45.360  21.095   8.667
 1075   HD22  ASN  29          HD22      ASN  29  45.401  19.859   9.830
 1076    H    GLN  30           HN       GLN  30  45.160  25.525   9.565
 1077    HA   GLN  30           HA       GLN  30  45.202  27.479  11.699
 1078    HB2  GLN  30           HB2      GLN  30  46.368  27.324   8.932
 1079    HB3  GLN  30           HB1      GLN  30  46.398  28.833   9.846
 1080    HG2  GLN  30           HG2      GLN  30  47.471  27.563  11.744
 1081    HG3  GLN  30           HG1      GLN  30  47.596  26.174  10.665
 1082   HE21  GLN  30          HE21      GLN  30  50.028  26.534  11.056
 1083   HE22  GLN  30          HE22      GLN  30  50.823  27.659  10.064
 1084    H    ILE  31           HN       ILE  31  44.161  29.433  11.741
 1085    HA   ILE  31           HA       ILE  31  41.632  29.641  10.522
 1086    HB   ILE  31           HB       ILE  31  43.390  31.704  11.859
 1087   HG12  ILE  31          HG12      ILE  31  40.830  30.438  12.846
 1088   HG13  ILE  31          HG11      ILE  31  42.398  29.679  13.121
 1089   HG21  ILE  31          HG21      ILE  31  41.913  32.928  10.418
 1090   HG22  ILE  31          HG22      ILE  31  41.193  32.981  12.028
 1091   HG23  ILE  31          HG23      ILE  31  40.553  31.875  10.812
 1092   HD11  ILE  31          HD11      ILE  31  41.667  32.506  13.944
 1093   HD12  ILE  31          HD12      ILE  31  43.199  31.695  14.264
 1094   HD13  ILE  31          HD13      ILE  31  41.719  31.117  15.029
 1095    H    LYS  32           HN       LYS  32  44.752  31.146   9.738
 1096    HA   LYS  32           HA       LYS  32  45.505  32.210   7.849
 1097    HB2  LYS  32           HB2      LYS  32  43.423  30.331   6.774
 1098    HB3  LYS  32           HB1      LYS  32  44.239  31.462   5.695
 1099    HG2  LYS  32           HG2      LYS  32  46.382  30.547   6.191
 1100    HG3  LYS  32           HG1      LYS  32  45.760  29.648   7.577
 1101    HD2  LYS  32           HD2      LYS  32  44.373  28.277   6.053
 1102    HD3  LYS  32           HD1      LYS  32  45.029  29.160   4.673
 1103    HE2  LYS  32           HE2      LYS  32  47.265  28.360   5.144
 1104    HE3  LYS  32           HE1      LYS  32  46.730  27.624   6.655
 1105    HZ1  LYS  32           HZ1      LYS  32  46.949  26.157   4.577
 1106    HZ2  LYS  32           HZ2      LYS  32  45.482  26.863   4.095
 1107    HZ3  LYS  32           HZ3      LYS  32  45.568  25.984   5.545
 1108    H    ARG  33           HN       ARG  33  45.091  34.342   8.173
 1109    HA   ARG  33           HA       ARG  33  42.704  35.412   6.849
 1110    HB2  ARG  33           HB2      ARG  33  41.921  36.633   8.653
 1111    HB3  ARG  33           HB1      ARG  33  42.483  35.172   9.457
 1112    HG2  ARG  33           HG2      ARG  33  44.035  37.776   9.226
 1113    HG3  ARG  33           HG1      ARG  33  43.245  37.156  10.673
 1114    HD2  ARG  33           HD2      ARG  33  44.679  35.035  10.304
 1115    HD3  ARG  33           HD1      ARG  33  45.652  36.053   9.248
 1116    HE   ARG  33           HE       ARG  33  45.289  37.389  11.704
 1117   HH11  ARG  33          HH11      ARG  33  46.886  34.585  10.381
 1118   HH12  ARG  33          HH12      ARG  33  48.152  34.606  11.560
 1119   HH21  ARG  33          HH21      ARG  33  46.946  37.389  13.225
 1120   HH22  ARG  33          HH22      ARG  33  48.187  36.184  13.162
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1   3.619  18.397  -1.855
    2    H2   MET   1           HT2      MET   1   4.269  18.176  -3.409
    3    H3   MET   1           HT3      MET   1   5.283  18.137  -2.048
    4    HA   MET   1           HA       MET   1   3.240  16.241  -1.703
    5    HB2  MET   1           HB2      MET   1   4.438  16.449  -4.420
    6    HB3  MET   1           HB1      MET   1   4.365  14.833  -3.722
    7    HG2  MET   1           HG2      MET   1   1.892  15.504  -3.131
    8    HG3  MET   1           HG1      MET   1   2.116  16.692  -4.414
    9    HE1  MET   1           HE1      MET   1   1.768  16.305  -6.728
   10    HE2  MET   1           HE2      MET   1   2.306  14.882  -7.619
   11    HE3  MET   1           HE3      MET   1   3.476  15.843  -6.718
   12    H    PHE   2           HN       PHE   2   5.075  16.975  -0.002
   13    HA   PHE   2           HA       PHE   2   7.210  14.935  -0.196
   14    HB2  PHE   2           HB2      PHE   2   7.350  17.641   1.151
   15    HB3  PHE   2           HB1      PHE   2   8.631  16.428   1.145
   16    HD1  PHE   2           HD1      PHE   2   7.341  19.271  -0.520
   17    HD2  PHE   2           HD2      PHE   2   9.318  15.528  -1.249
   18    HE1  PHE   2           HE1      PHE   2   8.129  20.116  -2.714
   19    HE2  PHE   2           HE2      PHE   2  10.109  16.374  -3.442
   20    HZ   PHE   2           HZ       PHE   2   9.515  18.667  -4.175
   21    H    GLU   3           HN       GLU   3   7.160  13.429   1.337
   22    HA   GLU   3           HA       GLU   3   5.322  13.761   3.576
   23    HB2  GLU   3           HB2      GLU   3   6.825  11.394   2.465
   24    HB3  GLU   3           HB1      GLU   3   5.908  11.314   3.968
   25    HG2  GLU   3           HG2      GLU   3   3.871  12.001   2.795
   26    HG3  GLU   3           HG1      GLU   3   4.772  12.158   1.287
   27    HA   PRO   4           HA       PRO   4   8.219  14.557   6.789
   28    HB2  PRO   4           HB2      PRO   4   7.326  12.045   8.138
   29    HB3  PRO   4           HB1      PRO   4   7.391  13.703   8.769
   30    HG2  PRO   4           HG2      PRO   4   5.083  12.590   8.096
   31    HG3  PRO   4           HG1      PRO   4   5.404  14.302   7.768
   32    HD2  PRO   4           HD2      PRO   4   5.371  11.995   5.862
   33    HD3  PRO   4           HD1      PRO   4   4.884  13.685   5.601
   34    H    PHE   5           HN       PHE   5   8.023  11.042   6.157
   35    HA   PHE   5           HA       PHE   5  10.741  10.532   6.878
   36    HB2  PHE   5           HB2      PHE   5  10.118   8.375   6.703
   37    HB3  PHE   5           HB1      PHE   5   8.495   8.973   6.360
   38    HD1  PHE   5           HD1      PHE   5  11.549   7.532   4.949
   39    HD2  PHE   5           HD2      PHE   5   7.703   9.206   4.018
   40    HE1  PHE   5           HE1      PHE   5  11.712   6.624   2.647
   41    HE2  PHE   5           HE2      PHE   5   7.867   8.298   1.715
   42    HZ   PHE   5           HZ       PHE   5   9.872   7.008   1.030
   43    H    GLN   6           HN       GLN   6   9.091  11.385   3.913
   44    HA   GLN   6           HA       GLN   6  11.156  10.670   2.099
   45    HB2  GLN   6           HB2      GLN   6   8.749  11.185   1.512
   46    HB3  GLN   6           HB1      GLN   6   9.137  12.890   1.742
   47    HG2  GLN   6           HG2      GLN   6   9.436  12.507  -0.585
   48    HG3  GLN   6           HG1      GLN   6  11.064  12.509   0.090
   49   HE21  GLN   6          HE21      GLN   6  11.787  11.106  -1.721
   50   HE22  GLN   6          HE22      GLN   6  11.401   9.453  -1.722
   51    H    ILE   7           HN       ILE   7  10.404  13.643   3.877
   52    HA   ILE   7           HA       ILE   7  12.374  15.286   2.670
   53    HB   ILE   7           HB       ILE   7  11.043  15.430   5.384
   54   HG12  ILE   7          HG12      ILE   7  10.557  17.108   2.917
   55   HG13  ILE   7          HG11      ILE   7   9.669  15.613   3.220
   56   HG21  ILE   7          HG21      ILE   7  12.786  17.415   3.893
   57   HG22  ILE   7          HG22      ILE   7  13.120  16.687   5.463
   58   HG23  ILE   7          HG23      ILE   7  11.791  17.832   5.288
   59   HD11  ILE   7          HD11      ILE   7   8.518  17.703   4.055
   60   HD12  ILE   7          HD12      ILE   7   9.833  17.882   5.215
   61   HD13  ILE   7          HD13      ILE   7   8.781  16.469   5.286
   62    H    LEU   8           HN       LEU   8  12.374  13.326   5.640
   63    HA   LEU   8           HA       LEU   8  15.053  14.027   6.352
   64    HB2  LEU   8           HB2      LEU   8  13.329  13.169   7.959
   65    HB3  LEU   8           HB1      LEU   8  13.495  11.582   7.210
   66    HG   LEU   8           HG       LEU   8  15.990  11.751   7.691
   67   HD11  LEU   8          HD11      LEU   8  16.224  14.119   8.067
   68   HD12  LEU   8          HD12      LEU   8  16.532  13.319   9.607
   69   HD13  LEU   8          HD13      LEU   8  14.978  14.099   9.316
   70   HD21  LEU   8          HD21      LEU   8  13.971  11.698   9.950
   71   HD22  LEU   8          HD22      LEU   8  15.658  11.222  10.142
   72   HD23  LEU   8          HD23      LEU   8  14.605  10.319   9.053
   73    H    SER   9           HN       SER   9  13.592  11.560   4.376
   74    HA   SER   9           HA       SER   9  15.804   9.787   4.212
   75    HB2  SER   9           HB2      SER   9  13.592   9.037   3.576
   76    HB3  SER   9           HB1      SER   9  13.499  10.259   2.310
   77    HG   SER   9           HG       SER   9  15.469   8.215   2.469
   78    H    ILE  10           HN       ILE  10  14.682  12.371   2.025
   79    HA   ILE  10           HA       ILE  10  16.916  12.062   0.251
   80    HB   ILE  10           HB       ILE  10  16.049  14.111  -0.818
   81   HG12  ILE  10          HG12      ILE  10  13.659  14.663   0.403
   82   HG13  ILE  10          HG11      ILE  10  14.685  14.320   1.790
   83   HG21  ILE  10          HG21      ILE  10  13.811  12.225  -0.019
   84   HG22  ILE  10          HG22      ILE  10  15.018  11.860  -1.253
   85   HG23  ILE  10          HG23      ILE  10  13.896  13.201  -1.485
   86   HD11  ILE  10          HD11      ILE  10  15.034  16.448  -0.312
   87   HD12  ILE  10          HD12      ILE  10  16.397  15.915   0.673
   88   HD13  ILE  10          HD13      ILE  10  14.979  16.633   1.441
   89    H    CYS  11           HN       CYS  11  16.280  13.922   3.140
   90    HA   CYS  11           HA       CYS  11  18.278  15.912   2.764
   91    HB2  CYS  11           HB2      CYS  11  16.417  16.093   4.396
   92    HB3  CYS  11           HB1      CYS  11  17.148  14.793   5.340
   93    HG   CYS  11           HG       CYS  11  18.836  16.382   6.237
   94    H    SER  12           HN       SER  12  18.252  12.891   4.669
   95    HA   SER  12           HA       SER  12  21.000  13.044   5.397
   96    HB2  SER  12           HB2      SER  12  19.083  10.706   5.352
   97    HB3  SER  12           HB1      SER  12  20.705  10.646   6.038
   98    HG   SER  12           HG       SER  12  20.076  11.880   7.658
   99    H    PHE  13           HN       PHE  13  19.253  11.536   2.739
  100    HA   PHE  13           HA       PHE  13  21.309   9.941   1.696
  101    HB2  PHE  13           HB2      PHE  13  19.176   9.600   0.775
  102    HB3  PHE  13           HB1      PHE  13  18.938  11.319   0.459
  103    HD1  PHE  13           HD1      PHE  13  21.299   8.535  -0.435
  104    HD2  PHE  13           HD2      PHE  13  19.287  12.114  -1.694
  105    HE1  PHE  13           HE1      PHE  13  22.237   8.262  -2.715
  106    HE2  PHE  13           HE2      PHE  13  20.223  11.841  -3.973
  107    HZ   PHE  13           HZ       PHE  13  21.701   9.915  -4.483
  108    H    ILE  14           HN       ILE  14  20.451  13.329   0.970
  109    HA   ILE  14           HA       ILE  14  22.470  13.769  -0.949
  110    HB   ILE  14           HB       ILE  14  21.027  15.658   0.919
  111   HG12  ILE  14          HG12      ILE  14  20.734  15.314  -2.070
  112   HG13  ILE  14          HG11      ILE  14  19.810  14.333  -0.932
  113   HG21  ILE  14          HG21      ILE  14  22.962  16.182  -1.352
  114   HG22  ILE  14          HG22      ILE  14  23.090  16.737   0.316
  115   HG23  ILE  14          HG23      ILE  14  21.844  17.401  -0.742
  116   HD11  ILE  14          HD11      ILE  14  18.706  16.233  -0.026
  117   HD12  ILE  14          HD12      ILE  14  18.685  16.486  -1.771
  118   HD13  ILE  14          HD13      ILE  14  19.849  17.352  -0.769
  119    H    LEU  15           HN       LEU  15  22.395  14.338   2.569
  120    HA   LEU  15           HA       LEU  15  24.999  15.440   2.740
  121    HB2  LEU  15           HB2      LEU  15  22.932  14.497   4.586
  122    HB3  LEU  15           HB1      LEU  15  24.567  14.212   5.180
  123    HG   LEU  15           HG       LEU  15  24.269  16.869   3.988
  124   HD11  LEU  15          HD11      LEU  15  22.954  17.715   5.998
  125   HD12  LEU  15          HD12      LEU  15  22.498  16.039   6.295
  126   HD13  LEU  15          HD13      LEU  15  22.016  16.830   4.794
  127   HD21  LEU  15          HD21      LEU  15  26.167  16.105   5.393
  128   HD22  LEU  15          HD22      LEU  15  25.060  15.880   6.748
  129   HD23  LEU  15          HD23      LEU  15  25.357  17.498   6.110
  130    H    SER  16           HN       SER  16  23.869  12.175   2.476
  131    HA   SER  16           HA       SER  16  26.233  10.906   3.495
  132    HB2  SER  16           HB2      SER  16  24.010   9.874   1.726
  133    HB3  SER  16           HB1      SER  16  25.274   8.874   2.437
  134    HG   SER  16           HG       SER  16  23.025   9.498   3.534
  135    H    ALA  17           HN       ALA  17  25.018  11.750   0.273
  136    HA   ALA  17           HA       ALA  17  27.180  10.563  -1.165
  137    HB1  ALA  17           HB1      ALA  17  24.968  11.069  -2.180
  138    HB2  ALA  17           HB2      ALA  17  26.307  11.773  -3.086
  139    HB3  ALA  17           HB3      ALA  17  25.322  12.791  -2.034
  140    H    LEU  18           HN       LEU  18  26.593  13.760   0.233
  141    HA   LEU  18           HA       LEU  18  28.849  15.001  -1.026
  142    HB2  LEU  18           HB2      LEU  18  27.111  15.772   1.327
  143    HB3  LEU  18           HB1      LEU  18  28.379  16.800   0.657
  144    HG   LEU  18           HG       LEU  18  26.181  15.658  -1.073
  145   HD11  LEU  18          HD11      LEU  18  25.149  16.987   0.743
  146   HD12  LEU  18          HD12      LEU  18  25.007  17.806  -0.813
  147   HD13  LEU  18          HD13      LEU  18  26.217  18.337   0.355
  148   HD21  LEU  18          HD21      LEU  18  28.113  16.504  -2.276
  149   HD22  LEU  18          HD22      LEU  18  28.118  17.981  -1.314
  150   HD23  LEU  18          HD23      LEU  18  26.805  17.674  -2.450
  151    H    HIS  19           HN       HIS  19  28.253  13.293   2.016
  152    HA   HIS  19           HA       HIS  19  30.634  14.055   3.345
  153    HB2  HIS  19           HB2      HIS  19  28.753  13.075   4.551
  154    HB3  HIS  19           HB1      HIS  19  28.913  11.579   3.630
  155    HD2  HIS  19           HD2      HIS  19  30.728  13.443   6.575
  156    HE1  HIS  19           HE1      HIS  19  32.558   9.672   6.084
  157    HE2  HIS  19           HE2      HIS  19  32.449  11.741   7.552
  158    H    PHE  20           HN       PHE  20  29.787  11.202   1.371
  159    HA   PHE  20           HA       PHE  20  32.399  10.052   1.563
  160    HB2  PHE  20           HB2      PHE  20  29.876   9.422   0.222
  161    HB3  PHE  20           HB1      PHE  20  31.296   9.000  -0.735
  162    HD1  PHE  20           HD1      PHE  20  30.008   8.753   2.791
  163    HD2  PHE  20           HD2      PHE  20  32.383   6.979  -0.321
  164    HE1  PHE  20           HE1      PHE  20  30.418   6.771   4.229
  165    HE2  PHE  20           HE2      PHE  20  32.791   5.001   1.116
  166    HZ   PHE  20           HZ       PHE  20  31.818   4.891   3.392
  167    H    MET  21           HN       MET  21  30.892  12.393  -0.553
  168    HA   MET  21           HA       MET  21  32.680  12.265  -2.730
  169    HB2  MET  21           HB2      MET  21  30.647  14.101  -1.709
  170    HB3  MET  21           HB1      MET  21  31.973  14.929  -2.525
  171    HG2  MET  21           HG2      MET  21  30.675  12.504  -3.759
  172    HG3  MET  21           HG1      MET  21  29.979  14.113  -3.973
  173    HE1  MET  21           HE1      MET  21  31.615  13.548  -7.386
  174    HE2  MET  21           HE2      MET  21  30.333  14.457  -6.590
  175    HE3  MET  21           HE3      MET  21  30.459  12.719  -6.334
  176    H    ALA  22           HN       ALA  22  32.676  14.516   0.063
  177    HA   ALA  22           HA       ALA  22  35.179  15.673  -0.549
  178    HB1  ALA  22           HB1      ALA  22  33.297  16.413   1.123
  179    HB2  ALA  22           HB2      ALA  22  34.982  16.803   1.466
  180    HB3  ALA  22           HB3      ALA  22  34.210  15.439   2.276
  181    H    TRP  23           HN       TRP  23  34.256  12.916   1.473
  182    HA   TRP  23           HA       TRP  23  36.727  12.412   2.681
  183    HB2  TRP  23           HB2      TRP  23  34.215  11.064   2.361
  184    HB3  TRP  23           HB1      TRP  23  35.528   9.919   2.093
  185    HD1  TRP  23           HD1      TRP  23  34.351  12.494   4.718
  186    HE1  TRP  23           HE1      TRP  23  35.251  11.749   7.018
  187    HE3  TRP  23           HE3      TRP  23  37.178   8.480   3.310
  188    HZ2  TRP  23           HZ2      TRP  23  36.951   9.725   8.114
  189    HZ3  TRP  23           HZ3      TRP  23  38.424   7.160   4.996
  190    HH2  TRP  23           HH2      TRP  23  38.314   7.778   7.397
  191    H    THR  24           HN       THR  24  35.413  11.140  -0.374
  192    HA   THR  24           HA       THR  24  37.571   9.530  -1.094
  193    HB   THR  24           HB       THR  24  35.722  11.111  -2.899
  194    HG1  THR  24           HG1      THR  24  34.670   9.017  -2.949
  195   HG21  THR  24          HG21      THR  24  37.597  10.347  -4.185
  196   HG22  THR  24          HG22      THR  24  36.273   9.224  -4.496
  197   HG23  THR  24          HG23      THR  24  37.573   8.772  -3.394
  198    H    ILE  25           HN       ILE  25  36.981  12.987  -1.722
  199    HA   ILE  25           HA       ILE  25  39.299  13.404  -3.311
  200    HB   ILE  25           HB       ILE  25  37.714  15.326  -1.585
  201   HG12  ILE  25          HG12      ILE  25  37.623  14.899  -4.584
  202   HG13  ILE  25          HG11      ILE  25  36.539  14.063  -3.472
  203   HG21  ILE  25          HG21      ILE  25  39.883  15.724  -3.660
  204   HG22  ILE  25          HG22      ILE  25  39.805  16.378  -2.025
  205   HG23  ILE  25          HG23      ILE  25  38.722  16.993  -3.273
  206   HD11  ILE  25          HD11      ILE  25  35.688  16.199  -2.640
  207   HD12  ILE  25          HD12      ILE  25  35.519  16.139  -4.395
  208   HD13  ILE  25          HD13      ILE  25  36.823  17.076  -3.666
  209    H    GLY  26           HN       GLY  26  38.665  13.621   0.134
  210    HA2  GLY  26           HA2      GLY  26  41.054  14.798   1.006
  211    HA3  GLY  26           HA1      GLY  26  40.086  13.684   1.970
  212    H    HIS  27           HN       HIS  27  40.267  11.337   0.656
  213    HA   HIS  27           HA       HIS  27  42.840  10.382   1.361
  214    HB2  HIS  27           HB2      HIS  27  40.488   9.220  -0.093
  215    HB3  HIS  27           HB1      HIS  27  42.017   8.341  -0.043
  216    HD2  HIS  27           HD2      HIS  27  41.238   6.443   1.893
  217    HE1  HIS  27           HE1      HIS  27  40.312   9.218   4.936
  218    HE2  HIS  27           HE2      HIS  27  40.605   6.751   4.408
  219    H    LEU  28           HN       LEU  28  41.414  11.468  -1.662
  220    HA   LEU  28           HA       LEU  28  43.336  10.463  -3.437
  221    HB2  LEU  28           HB2      LEU  28  41.095  12.158  -3.592
  222    HB3  LEU  28           HB1      LEU  28  42.443  13.100  -4.221
  223    HG   LEU  28           HG       LEU  28  41.411  11.862  -6.047
  224   HD11  LEU  28          HD11      LEU  28  43.998  12.059  -5.780
  225   HD12  LEU  28          HD12      LEU  28  43.357  10.948  -6.989
  226   HD13  LEU  28          HD13      LEU  28  43.938  10.328  -5.443
  227   HD21  LEU  28          HD21      LEU  28  41.042   9.527  -6.030
  228   HD22  LEU  28          HD22      LEU  28  40.557  10.033  -4.413
  229   HD23  LEU  28          HD23      LEU  28  42.128   9.272  -4.664
  230    H    ASN  29           HN       ASN  29  43.362  13.286  -1.330
  231    HA   ASN  29           HA       ASN  29  45.026  14.821  -0.859
  232    HB2  ASN  29           HB2      ASN  29  46.787  12.492  -1.669
  233    HB3  ASN  29           HB1      ASN  29  47.301  13.897  -0.735
  234   HD21  ASN  29          HD21      ASN  29  46.720  10.790  -0.175
  235   HD22  ASN  29          HD22      ASN  29  45.934  10.862   1.328
  236    H    GLN  30           HN       GLN  30  43.986  15.451  -3.229
  237    HA   GLN  30           HA       GLN  30  45.510  15.383  -5.538
  238    HB2  GLN  30           HB2      GLN  30  44.261  17.262  -6.287
  239    HB3  GLN  30           HB1      GLN  30  43.186  16.396  -5.191
  240    HG2  GLN  30           HG2      GLN  30  43.988  17.931  -3.343
  241    HG3  GLN  30           HG1      GLN  30  44.809  18.879  -4.582
  242   HE21  GLN  30          HE21      GLN  30  43.577  20.672  -5.115
  243   HE22  GLN  30          HE22      GLN  30  41.885  20.686  -5.248
  244    H    ILE  31           HN       ILE  31  46.009  17.227  -2.624
  245    HA   ILE  31           HA       ILE  31  47.803  19.166  -3.671
  246    HB   ILE  31           HB       ILE  31  48.524  19.384  -1.261
  247   HG12  ILE  31          HG12      ILE  31  46.301  17.410  -0.711
  248   HG13  ILE  31          HG11      ILE  31  47.986  16.900  -0.820
  249   HG21  ILE  31          HG21      ILE  31  46.195  20.095  -0.499
  250   HG22  ILE  31          HG22      ILE  31  45.597  19.446  -2.026
  251   HG23  ILE  31          HG23      ILE  31  46.742  20.787  -2.026
  252   HD11  ILE  31          HD11      ILE  31  47.282  17.396   1.523
  253   HD12  ILE  31          HD12      ILE  31  46.962  19.062   1.042
  254   HD13  ILE  31          HD13      ILE  31  48.606  18.426   0.979
  255    H    LYS  32           HN       LYS  32  50.136  19.254  -2.786
  256    HA   LYS  32           HA       LYS  32  51.711  17.379  -4.049
  257    HB2  LYS  32           HB2      LYS  32  53.573  18.242  -2.758
  258    HB3  LYS  32           HB1      LYS  32  52.495  19.578  -3.164
  259    HG2  LYS  32           HG2      LYS  32  51.408  19.303  -0.917
  260    HG3  LYS  32           HG1      LYS  32  52.637  18.100  -0.521
  261    HD2  LYS  32           HD2      LYS  32  54.407  19.769  -0.861
  262    HD3  LYS  32           HD1      LYS  32  53.199  20.975  -1.304
  263    HE2  LYS  32           HE2      LYS  32  53.808  21.292   1.035
  264    HE3  LYS  32           HE1      LYS  32  52.153  20.690   0.948
  265    HZ1  LYS  32           HZ1      LYS  32  53.460  19.517   2.619
  266    HZ2  LYS  32           HZ2      LYS  32  54.561  19.019   1.424
  267    HZ3  LYS  32           HZ3      LYS  32  52.955  18.468   1.386
  268    H    ARG  33           HN       ARG  33  52.603  15.434  -3.544
  269    HA   ARG  33           HA       ARG  33  51.405  13.949  -1.372
  270    HB2  ARG  33           HB2      ARG  33  53.309  13.282  -3.604
  271    HB3  ARG  33           HB1      ARG  33  52.982  12.130  -2.309
  272    HG2  ARG  33           HG2      ARG  33  50.803  11.794  -2.968
  273    HG3  ARG  33           HG1      ARG  33  50.632  13.432  -3.603
  274    HD2  ARG  33           HD2      ARG  33  52.139  12.817  -5.490
  275    HD3  ARG  33           HD1      ARG  33  52.192  11.167  -4.879
  276    HE   ARG  33           HE       ARG  33  49.521  11.661  -5.157
  277   HH11  ARG  33          HH11      ARG  33  52.291  11.956  -7.258
  278   HH12  ARG  33          HH12      ARG  33  51.382  11.641  -8.696
  279   HH21  ARG  33          HH21      ARG  33  48.360  11.259  -7.055
  280   HH22  ARG  33          HH22      ARG  33  49.174  11.249  -8.585
  281    H1   MET   1           HT1      MET   1   6.514  -4.845  -0.553
  282    H2   MET   1           HT2      MET   1   7.365  -6.291  -0.281
  283    H3   MET   1           HT3      MET   1   8.161  -4.796  -0.147
  284    HA   MET   1           HA       MET   1   5.931  -4.781   1.560
  285    HB2  MET   1           HB2      MET   1   7.524  -7.294   1.452
  286    HB3  MET   1           HB1      MET   1   7.208  -6.639   3.057
  287    HG2  MET   1           HG2      MET   1   4.744  -6.400   2.167
  288    HG3  MET   1           HG1      MET   1   5.256  -7.619   1.000
  289    HE1  MET   1           HE1      MET   1   5.213  -9.965   1.348
  290    HE2  MET   1           HE2      MET   1   5.748 -10.791   2.809
  291    HE3  MET   1           HE3      MET   1   6.854  -9.716   1.959
  292    H    PHE   2           HN       PHE   2   7.555  -2.821   1.001
  293    HA   PHE   2           HA       PHE   2   9.509  -2.740   3.223
  294    HB2  PHE   2           HB2      PHE   2   9.691  -1.342   0.543
  295    HB3  PHE   2           HB1      PHE   2  10.846  -1.183   1.866
  296    HD1  PHE   2           HD1      PHE   2  10.069  -2.971  -1.086
  297    HD2  PHE   2           HD2      PHE   2  11.791  -3.467   2.818
  298    HE1  PHE   2           HE1      PHE   2  11.239  -5.014  -1.862
  299    HE2  PHE   2           HE2      PHE   2  12.964  -5.510   2.040
  300    HZ   PHE   2           HZ       PHE   2  12.687  -6.283  -0.301
  301    H    GLU   3           HN       GLU   3   9.104  -1.254   4.722
  302    HA   GLU   3           HA       GLU   3   6.995   0.701   4.235
  303    HB2  GLU   3           HB2      GLU   3   8.430  -0.219   6.722
  304    HB3  GLU   3           HB1      GLU   3   7.301   1.135   6.725
  305    HG2  GLU   3           HG2      GLU   3   5.525  -0.310   5.854
  306    HG3  GLU   3           HG1      GLU   3   6.646  -1.669   5.776
  307    HA   PRO   4           HA       PRO   4   9.456   4.310   3.712
  308    HB2  PRO   4           HB2      PRO   4   8.156   5.478   6.137
  309    HB3  PRO   4           HB1      PRO   4   8.276   6.138   4.496
  310    HG2  PRO   4           HG2      PRO   4   6.001   5.120   5.392
  311    HG3  PRO   4           HG1      PRO   4   6.517   4.869   3.714
  312    HD2  PRO   4           HD2      PRO   4   6.558   2.941   6.006
  313    HD3  PRO   4           HD1      PRO   4   6.264   2.640   4.278
  314    H    PHE   5           HN       PHE   5   9.043   3.598   7.194
  315    HA   PHE   5           HA       PHE   5  11.571   4.697   7.948
  316    HB2  PHE   5           HB2      PHE   5  10.792   4.398  10.038
  317    HB3  PHE   5           HB1      PHE   5   9.294   3.833   9.298
  318    HD1  PHE   5           HD1      PHE   5  12.383   2.855  11.002
  319    HD2  PHE   5           HD2      PHE   5   8.876   1.407   8.987
  320    HE1  PHE   5           HE1      PHE   5  12.799   0.585  11.909
  321    HE2  PHE   5           HE2      PHE   5   9.293  -0.864   9.896
  322    HZ   PHE   5           HZ       PHE   5  11.258  -1.278  11.353
  323    H    GLN   6           HN       GLN   6  10.450   1.538   6.945
  324    HA   GLN   6           HA       GLN   6  12.686   0.030   7.832
  325    HB2  GLN   6           HB2      GLN   6  10.444  -0.888   7.101
  326    HB3  GLN   6           HB1      GLN   6  10.942  -0.578   5.439
  327    HG2  GLN   6           HG2      GLN   6  11.539  -2.842   5.841
  328    HG3  GLN   6           HG1      GLN   6  13.047  -1.942   5.985
  329   HE21  GLN   6          HE21      GLN   6  13.899  -3.651   7.440
  330   HE22  GLN   6          HE22      GLN   6  13.373  -3.736   9.052
  331    H    ILE   7           HN       ILE   7  11.947   1.723   4.808
  332    HA   ILE   7           HA       ILE   7  14.212   0.844   3.347
  333    HB   ILE   7           HB       ILE   7  12.520   3.340   3.093
  334   HG12  ILE   7          HG12      ILE   7  12.548   0.856   1.366
  335   HG13  ILE   7          HG11      ILE   7  11.498   1.002   2.777
  336   HG21  ILE   7          HG21      ILE   7  14.629   2.150   1.267
  337   HG22  ILE   7          HG22      ILE   7  14.667   3.739   2.029
  338   HG23  ILE   7          HG23      ILE   7  13.485   3.393   0.768
  339   HD11  ILE   7          HD11      ILE   7  10.426   1.699   0.596
  340   HD12  ILE   7          HD12      ILE   7  11.570   3.041   0.543
  341   HD13  ILE   7          HD13      ILE   7  10.398   2.933   1.856
  342    H    LEU   8           HN       LEU   8  13.608   3.750   5.304
  343    HA   LEU   8           HA       LEU   8  16.207   4.855   4.853
  344    HB2  LEU   8           HB2      LEU   8  14.200   6.181   5.559
  345    HB3  LEU   8           HB1      LEU   8  14.332   5.437   7.152
  346    HG   LEU   8           HG       LEU   8  16.736   6.275   7.209
  347   HD11  LEU   8          HD11      LEU   8  17.122   6.717   4.873
  348   HD12  LEU   8          HD12      LEU   8  17.129   8.275   5.699
  349   HD13  LEU   8          HD13      LEU   8  15.710   7.771   4.782
  350   HD21  LEU   8          HD21      LEU   8  14.415   8.220   7.086
  351   HD22  LEU   8          HD22      LEU   8  16.008   8.645   7.712
  352   HD23  LEU   8          HD23      LEU   8  15.048   7.401   8.515
  353    H    SER   9           HN       SER   9  14.835   2.649   7.174
  354    HA   SER   9           HA       SER   9  16.882   2.775   9.138
  355    HB2  SER   9           HB2      SER   9  14.729   1.814   9.683
  356    HB3  SER   9           HB1      SER   9  14.930   0.569   8.453
  357    HG   SER   9           HG       SER   9  16.664   0.976  10.667
  358    H    ILE  10           HN       ILE  10  16.320   0.488   6.459
  359    HA   ILE  10           HA       ILE  10  18.751  -0.948   6.959
  360    HB   ILE  10           HB       ILE  10  18.235  -2.097   4.836
  361   HG12  ILE  10          HG12      ILE  10  15.751  -1.222   4.074
  362   HG13  ILE  10          HG11      ILE  10  16.532   0.290   4.514
  363   HG21  ILE  10          HG21      ILE  10  15.747  -1.658   6.516
  364   HG22  ILE  10          HG22      ILE  10  17.081  -2.712   6.983
  365   HG23  ILE  10          HG23      ILE  10  16.127  -3.081   5.546
  366   HD11  ILE  10          HD11      ILE  10  17.367  -1.703   2.417
  367   HD12  ILE  10          HD12      ILE  10  18.522  -0.544   3.076
  368   HD13  ILE  10          HD13      ILE  10  17.079   0.026   2.235
  369    H    CYS  11           HN       CYS  11  17.868   1.846   5.056
  370    HA   CYS  11           HA       CYS  11  20.071   1.797   3.255
  371    HB2  CYS  11           HB2      CYS  11  18.018   3.149   2.913
  372    HB3  CYS  11           HB1      CYS  11  18.484   4.166   4.275
  373    HG   CYS  11           HG       CYS  11  20.161   5.323   2.849
  374    H    SER  12           HN       SER  12  19.502   3.628   6.267
  375    HA   SER  12           HA       SER  12  22.119   4.749   6.364
  376    HB2  SER  12           HB2      SER  12  20.030   4.389   8.521
  377    HB3  SER  12           HB1      SER  12  21.524   5.299   8.728
  378    HG   SER  12           HG       SER  12  20.779   6.833   7.450
  379    H    PHE  13           HN       PHE  13  20.649   1.842   7.704
  380    HA   PHE  13           HA       PHE  13  22.687   1.079   9.470
  381    HB2  PHE  13           HB2      PHE  13  20.687  -0.146   9.614
  382    HB3  PHE  13           HB1      PHE  13  20.651  -0.464   7.880
  383    HD1  PHE  13           HD1      PHE  13  22.861  -1.053  10.862
  384    HD2  PHE  13           HD2      PHE  13  21.376  -2.531   7.112
  385    HE1  PHE  13           HE1      PHE  13  24.092  -3.179  11.210
  386    HE2  PHE  13           HE2      PHE  13  22.605  -4.655   7.461
  387    HZ   PHE  13           HZ       PHE  13  23.964  -4.980   9.509
  388    H    ILE  14           HN       ILE  14  22.245   0.289   6.019
  389    HA   ILE  14           HA       ILE  14  24.552  -1.310   5.754
  390    HB   ILE  14           HB       ILE  14  23.025   0.363   3.750
  391   HG12  ILE  14          HG12      ILE  14  23.140  -2.642   4.055
  392   HG13  ILE  14          HG11      ILE  14  21.977  -1.666   4.951
  393   HG21  ILE  14          HG21      ILE  14  25.307  -1.596   3.392
  394   HG22  ILE  14          HG22      ILE  14  25.240   0.083   2.857
  395   HG23  ILE  14          HG23      ILE  14  24.225  -1.131   2.080
  396   HD11  ILE  14          HD11      ILE  14  20.927  -0.898   2.964
  397   HD12  ILE  14          HD12      ILE  14  21.184  -2.623   2.704
  398   HD13  ILE  14          HD13      ILE  14  22.262  -1.449   1.949
  399    H    LEU  15           HN       LEU  15  24.018   2.164   5.192
  400    HA   LEU  15           HA       LEU  15  26.657   2.733   4.329
  401    HB2  LEU  15           HB2      LEU  15  24.270   4.247   5.087
  402    HB3  LEU  15           HB1      LEU  15  25.770   5.065   5.521
  403    HG   LEU  15           HG       LEU  15  25.885   3.887   2.843
  404   HD11  LEU  15          HD11      LEU  15  24.375   5.701   1.889
  405   HD12  LEU  15          HD12      LEU  15  23.733   5.902   3.519
  406   HD13  LEU  15          HD13      LEU  15  23.545   4.361   2.680
  407   HD21  LEU  15          HD21      LEU  15  27.485   5.535   3.780
  408   HD22  LEU  15          HD22      LEU  15  26.180   6.713   3.911
  409   HD23  LEU  15          HD23      LEU  15  26.706   6.154   2.324
  410    H    SER  16           HN       SER  16  25.295   2.251   7.476
  411    HA   SER  16           HA       SER  16  27.360   3.583   8.960
  412    HB2  SER  16           HB2      SER  16  25.332   1.495   9.782
  413    HB3  SER  16           HB1      SER  16  26.388   2.361  10.895
  414    HG   SER  16           HG       SER  16  24.069   3.139  10.069
  415    H    ALA  17           HN       ALA  17  26.705   0.234   8.000
  416    HA   ALA  17           HA       ALA  17  28.941  -0.897   9.369
  417    HB1  ALA  17           HB1      ALA  17  26.953  -2.211   8.660
  418    HB2  ALA  17           HB2      ALA  17  28.467  -2.903   8.078
  419    HB3  ALA  17           HB3      ALA  17  27.436  -1.987   6.978
  420    H    LEU  18           HN       LEU  18  28.440   0.448   6.137
  421    HA   LEU  18           HA       LEU  18  30.957  -0.444   5.099
  422    HB2  LEU  18           HB2      LEU  18  28.971   1.646   4.184
  423    HB3  LEU  18           HB1      LEU  18  30.409   1.183   3.270
  424    HG   LEU  18           HG       LEU  18  28.393  -0.864   4.203
  425   HD11  LEU  18          HD11      LEU  18  27.231   0.806   2.793
  426   HD12  LEU  18          HD12      LEU  18  27.389  -0.741   1.961
  427   HD13  LEU  18          HD13      LEU  18  28.460   0.596   1.545
  428   HD21  LEU  18          HD21      LEU  18  30.545  -1.763   3.533
  429   HD22  LEU  18          HD22      LEU  18  30.543  -0.786   2.066
  430   HD23  LEU  18          HD23      LEU  18  29.388  -2.104   2.249
  431    H    HIS  19           HN       HIS  19  29.780   2.449   6.763
  432    HA   HIS  19           HA       HIS  19  32.000   4.120   6.224
  433    HB2  HIS  19           HB2      HIS  19  29.886   5.027   7.032
  434    HB3  HIS  19           HB1      HIS  19  30.044   4.117   8.533
  435    HD2  HIS  19           HD2      HIS  19  31.569   7.322   6.849
  436    HE1  HIS  19           HE1      HIS  19  33.116   7.039  10.767
  437    HE2  HIS  19           HE2      HIS  19  32.974   8.509   8.701
  438    H    PHE  20           HN       PHE  20  31.200   1.993   8.977
  439    HA   PHE  20           HA       PHE  20  33.643   2.544  10.359
  440    HB2  PHE  20           HB2      PHE  20  31.296   0.843  10.750
  441    HB3  PHE  20           HB1      PHE  20  32.797   0.093  11.294
  442    HD1  PHE  20           HD1      PHE  20  30.994   3.391  11.441
  443    HD2  PHE  20           HD2      PHE  20  33.629   0.622  13.403
  444    HE1  PHE  20           HE1      PHE  20  31.013   4.836  13.459
  445    HE2  PHE  20           HE2      PHE  20  33.645   2.066  15.419
  446    HZ   PHE  20           HZ       PHE  20  32.347   4.172  15.451
  447    H    MET  21           HN       MET  21  32.670   0.270   7.887
  448    HA   MET  21           HA       MET  21  34.738  -1.625   8.162
  449    HB2  MET  21           HB2      MET  21  32.748  -0.876   6.155
  450    HB3  MET  21           HB1      MET  21  34.247  -1.478   5.445
  451    HG2  MET  21           HG2      MET  21  32.934  -2.928   7.740
  452    HG3  MET  21           HG1      MET  21  32.420  -3.212   6.076
  453    HE1  MET  21           HE1      MET  21  34.480  -6.362   6.776
  454    HE2  MET  21           HE2      MET  21  33.180  -5.748   5.756
  455    HE3  MET  21           HE3      MET  21  33.114  -5.503   7.500
  456    H    ALA  22           HN       ALA  22  34.526   1.170   5.933
  457    HA   ALA  22           HA       ALA  22  37.184   0.951   5.001
  458    HB1  ALA  22           HB1      ALA  22  35.153   2.345   4.100
  459    HB2  ALA  22           HB2      ALA  22  36.798   2.935   3.865
  460    HB3  ALA  22           HB3      ALA  22  35.799   3.602   5.155
  461    H    TRP  23           HN       TRP  23  35.740   2.769   7.674
  462    HA   TRP  23           HA       TRP  23  37.956   4.315   8.399
  463    HB2  TRP  23           HB2      TRP  23  35.408   3.617   9.518
  464    HB3  TRP  23           HB1      TRP  23  36.643   3.520  10.775
  465    HD1  TRP  23           HD1      TRP  23  35.329   5.988   8.113
  466    HE1  TRP  23           HE1      TRP  23  35.817   8.382   8.939
  467    HE3  TRP  23           HE3      TRP  23  37.964   4.941  12.360
  468    HZ2  TRP  23           HZ2      TRP  23  37.152   9.680  11.112
  469    HZ3  TRP  23           HZ3      TRP  23  38.830   6.772  13.790
  470    HH2  TRP  23           HH2      TRP  23  38.426   9.138  13.171
  471    H    THR  24           HN       THR  24  36.993   1.081   9.536
  472    HA   THR  24           HA       THR  24  39.081   0.653  11.332
  473    HB   THR  24           HB       THR  24  37.660  -1.371   9.583
  474    HG1  THR  24           HG1      THR  24  36.445  -1.608  11.573
  475   HG21  THR  24          HG21      THR  24  39.627  -2.387  10.509
  476   HG22  THR  24          HG22      THR  24  38.267  -2.906  11.504
  477   HG23  THR  24          HG23      THR  24  39.347  -1.634  12.080
  478    H    ILE  25           HN       ILE  25  38.896  -0.002   7.838
  479    HA   ILE  25           HA       ILE  25  41.447  -1.229   7.621
  480    HB   ILE  25           HB       ILE  25  39.805   0.282   5.571
  481   HG12  ILE  25          HG12      ILE  25  40.111  -2.705   5.977
  482   HG13  ILE  25          HG11      ILE  25  38.807  -1.776   6.717
  483   HG21  ILE  25          HG21      ILE  25  42.278  -1.452   5.362
  484   HG22  ILE  25          HG22      ILE  25  42.020   0.166   4.709
  485   HG23  ILE  25          HG23      ILE  25  41.188  -1.216   3.995
  486   HD11  ILE  25          HD11      ILE  25  38.039  -1.039   4.515
  487   HD12  ILE  25          HD12      ILE  25  38.119  -2.801   4.556
  488   HD13  ILE  25          HD13      ILE  25  39.382  -1.878   3.740
  489    H    GLY  26           HN       GLY  26  40.341   2.088   7.360
  490    HA2  GLY  26           HA2      GLY  26  42.672   3.320   6.406
  491    HA3  GLY  26           HA1      GLY  26  41.480   4.115   7.432
  492    H    HIS  27           HN       HIS  27  41.644   2.802   9.783
  493    HA   HIS  27           HA       HIS  27  43.992   3.856  10.966
  494    HB2  HIS  27           HB2      HIS  27  41.783   2.059  11.908
  495    HB3  HIS  27           HB1      HIS  27  43.205   2.315  12.919
  496    HD2  HIS  27           HD2      HIS  27  41.986   4.088  14.747
  497    HE1  HIS  27           HE1      HIS  27  40.878   7.011  11.909
  498    HE2  HIS  27           HE2      HIS  27  41.025   6.489  14.390
  499    H    LEU  28           HN       LEU  28  43.120   0.676   9.750
  500    HA   LEU  28           HA       LEU  28  45.182  -0.820  10.915
  501    HB2  LEU  28           HB2      LEU  28  43.146  -1.268   9.024
  502    HB3  LEU  28           HB1      LEU  28  44.650  -1.681   8.204
  503    HG   LEU  28           HG       LEU  28  43.787  -3.657   9.339
  504   HD11  LEU  28          HD11      LEU  28  46.317  -3.017   9.377
  505   HD12  LEU  28          HD12      LEU  28  45.760  -4.323  10.420
  506   HD13  LEU  28          HD13      LEU  28  46.054  -2.721  11.096
  507   HD21  LEU  28          HD21      LEU  28  43.217  -3.731  11.632
  508   HD22  LEU  28          HD22      LEU  28  42.546  -2.195  11.088
  509   HD23  LEU  28          HD23      LEU  28  44.063  -2.226  11.987
  510    H    ASN  29           HN       ASN  29  45.154   1.314   8.111
  511    HA   ASN  29           HA       ASN  29  46.860   2.045   6.736
  512    HB2  ASN  29           HB2      ASN  29  48.506   1.460   9.210
  513    HB3  ASN  29           HB1      ASN  29  49.003   2.479   7.859
  514   HD21  ASN  29          HD21      ASN  29  48.075   2.902  10.904
  515   HD22  ASN  29          HD22      ASN  29  47.090   4.278  10.767
  516    H    GLN  30           HN       GLN  30  46.234  -0.438   6.007
  517    HA   GLN  30           HA       GLN  30  48.063  -2.505   6.204
  518    HB2  GLN  30           HB2      GLN  30  47.107  -3.396   4.217
  519    HB3  GLN  30           HB1      GLN  30  45.813  -2.479   4.986
  520    HG2  GLN  30           HG2      GLN  30  46.474  -0.511   3.536
  521    HG3  GLN  30           HG1      GLN  30  47.545  -1.604   2.662
  522   HE21  GLN  30          HE21      GLN  30  46.565  -2.280   0.762
  523   HE22  GLN  30          HE22      GLN  30  44.918  -2.654   0.596
  524    H    ILE  31           HN       ILE  31  48.296   0.479   4.420
  525    HA   ILE  31           HA       ILE  31  50.387  -0.267   2.647
  526    HB   ILE  31           HB       ILE  31  50.770   2.225   2.502
  527   HG12  ILE  31          HG12      ILE  31  48.325   2.416   4.270
  528   HG13  ILE  31          HG11      ILE  31  49.957   2.542   4.930
  529   HG21  ILE  31          HG21      ILE  31  48.428   2.655   1.588
  530   HG22  ILE  31          HG22      ILE  31  48.002   1.047   2.174
  531   HG23  ILE  31          HG23      ILE  31  49.249   1.235   0.941
  532   HD11  ILE  31          HD11      ILE  31  48.967   4.769   4.380
  533   HD12  ILE  31          HD12      ILE  31  48.870   4.274   2.689
  534   HD13  ILE  31          HD13      ILE  31  50.442   4.437   3.473
  535    H    LYS  32           HN       LYS  32  52.567   0.946   2.772
  536    HA   LYS  32           HA       LYS  32  54.137  -0.109   4.777
  537    HB2  LYS  32           HB2      LYS  32  55.861   1.449   4.089
  538    HB3  LYS  32           HB1      LYS  32  54.973   0.917   2.659
  539    HG2  LYS  32           HG2      LYS  32  53.554   2.980   2.846
  540    HG3  LYS  32           HG1      LYS  32  54.602   3.527   4.155
  541    HD2  LYS  32           HD2      LYS  32  56.545   3.475   2.651
  542    HD3  LYS  32           HD1      LYS  32  55.526   2.882   1.339
  543    HE2  LYS  32           HE2      LYS  32  55.814   5.288   1.087
  544    HE3  LYS  32           HE1      LYS  32  54.141   4.954   1.536
  545    HZ1  LYS  32           HZ1      LYS  32  55.084   6.777   2.828
  546    HZ2  LYS  32           HZ2      LYS  32  56.298   5.745   3.419
  547    HZ3  LYS  32           HZ3      LYS  32  54.671   5.468   3.823
  548    H    ARG  33           HN       ARG  33  54.771   0.488   6.795
  549    HA   ARG  33           HA       ARG  33  53.143   2.441   8.173
  550    HB2  ARG  33           HB2      ARG  33  55.285   0.496   9.001
  551    HB3  ARG  33           HB1      ARG  33  54.674   1.712  10.125
  552    HG2  ARG  33           HG2      ARG  33  52.591   0.742  10.261
  553    HG3  ARG  33           HG1      ARG  33  52.660   0.114   8.612
  554    HD2  ARG  33           HD2      ARG  33  54.363  -1.546   9.354
  555    HD3  ARG  33           HD1      ARG  33  54.181  -0.962  11.003
  556    HE   ARG  33           HE       ARG  33  51.633  -1.613  10.270
  557   HH11  ARG  33          HH11      ARG  33  54.694  -3.286  10.222
  558   HH12  ARG  33          HH12      ARG  33  53.977  -4.846  10.449
  559   HH21  ARG  33          HH21      ARG  33  50.728  -3.664  10.562
  560   HH22  ARG  33          HH22      ARG  33  51.751  -5.059  10.641
  561    H1   MET   1           HT1      MET   1   7.380  -3.916  23.187
  562    H2   MET   1           HT2      MET   1   8.057  -3.510  24.692
  563    H3   MET   1           HT3      MET   1   8.935  -3.244  23.261
  564    HA   MET   1           HA       MET   1   6.462  -1.929  23.056
  565    HB2  MET   1           HB2      MET   1   7.849  -1.778  25.685
  566    HB3  MET   1           HB1      MET   1   7.326  -0.244  24.992
  567    HG2  MET   1           HG2      MET   1   5.070  -1.527  24.571
  568    HG3  MET   1           HG1      MET   1   5.668  -2.595  25.839
  569    HE1  MET   1           HE1      MET   1   5.387  -2.263  28.170
  570    HE2  MET   1           HE2      MET   1   5.607  -0.735  29.020
  571    HE3  MET   1           HE3      MET   1   6.919  -1.390  28.043
  572    H    PHE   2           HN       PHE   2   8.309  -2.211  21.236
  573    HA   PHE   2           HA       PHE   2   9.869   0.305  21.281
  574    HB2  PHE   2           HB2      PHE   2  10.598  -2.306  19.931
  575    HB3  PHE   2           HB1      PHE   2  11.529  -0.810  19.847
  576    HD1  PHE   2           HD1      PHE   2  11.109  -3.853  21.603
  577    HD2  PHE   2           HD2      PHE   2  12.123   0.279  22.188
  578    HE1  PHE   2           HE1      PHE   2  12.227  -4.430  23.739
  579    HE2  PHE   2           HE2      PHE   2  13.242  -0.298  24.325
  580    HZ   PHE   2           HZ       PHE   2  13.293  -2.653  25.100
  581    H    GLU   3           HN       GLU   3   9.340   1.720  19.751
  582    HA   GLU   3           HA       GLU   3   7.502   0.893  17.641
  583    HB2  GLU   3           HB2      GLU   3   8.431   3.582  18.643
  584    HB3  GLU   3           HB1      GLU   3   7.425   3.400  17.206
  585    HG2  GLU   3           HG2      GLU   3   5.710   2.245  18.519
  586    HG3  GLU   3           HG1      GLU   3   6.720   2.352  19.961
  587    HA   PRO   4           HA       PRO   4  10.290   0.792  14.243
  588    HB2  PRO   4           HB2      PRO   4   8.706   2.969  12.950
  589    HB3  PRO   4           HB1      PRO   4   9.148   1.370  12.322
  590    HG2  PRO   4           HG2      PRO   4   6.681   1.878  13.147
  591    HG3  PRO   4           HG1      PRO   4   7.446   0.309  13.455
  592    HD2  PRO   4           HD2      PRO   4   6.955   2.571  15.355
  593    HD3  PRO   4           HD1      PRO   4   6.928   0.818  15.652
  594    H    PHE   5           HN       PHE   5   9.256   4.156  14.877
  595    HA   PHE   5           HA       PHE   5  11.704   5.316  13.970
  596    HB2  PHE   5           HB2      PHE   5  10.571   7.249  14.185
  597    HB3  PHE   5           HB1      PHE   5   9.178   6.270  14.641
  598    HD1  PHE   5           HD1      PHE   5  11.856   8.459  15.834
  599    HD2  PHE   5           HD2      PHE   5   8.625   5.892  17.031
  600    HE1  PHE   5           HE1      PHE   5  11.935   9.425  18.116
  601    HE2  PHE   5           HE2      PHE   5   8.704   6.859  19.315
  602    HZ   PHE   5           HZ       PHE   5  10.360   8.627  19.856
  603    H    GLN   6           HN       GLN   6  10.516   4.144  17.048
  604    HA   GLN   6           HA       GLN   6  12.453   5.378  18.713
  605    HB2  GLN   6           HB2      GLN   6  10.297   4.287  19.463
  606    HB3  GLN   6           HB1      GLN   6  11.086   2.729  19.211
  607    HG2  GLN   6           HG2      GLN   6  11.430   3.221  21.511
  608    HG3  GLN   6           HG1      GLN   6  12.960   3.614  20.726
  609   HE21  GLN   6          HE21      GLN   6  13.422   5.189  22.480
  610   HE22  GLN   6          HE22      GLN   6  12.633   6.692  22.504
  611    H    ILE   7           HN       ILE   7  12.358   2.277  16.995
  612    HA   ILE   7           HA       ILE   7  14.753   1.208  18.070
  613    HB   ILE   7           HB       ILE   7  13.327   0.680  15.452
  614   HG12  ILE   7          HG12      ILE   7  13.442  -1.018  17.951
  615   HG13  ILE   7          HG11      ILE   7  12.189   0.199  17.706
  616   HG21  ILE   7          HG21      ILE   7  15.607  -0.774  16.827
  617   HG22  ILE   7          HG22      ILE   7  15.645  -0.014  15.235
  618   HG23  ILE   7          HG23      ILE   7  14.662  -1.453  15.503
  619   HD11  ILE   7          HD11      ILE   7  11.551  -2.129  16.955
  620   HD12  ILE   7          HD12      ILE   7  12.790  -1.993  15.709
  621   HD13  ILE   7          HD13      ILE   7  11.412  -0.892  15.707
  622    H    LEU   8           HN       LEU   8  14.071   3.050  15.094
  623    HA   LEU   8           HA       LEU   8  16.784   3.026  14.211
  624    HB2  LEU   8           HB2      LEU   8  14.799   3.396  12.723
  625    HB3  LEU   8           HB1      LEU   8  14.610   4.988  13.459
  626    HG   LEU   8           HG       LEU   8  17.030   5.441  12.806
  627   HD11  LEU   8          HD11      LEU   8  17.826   3.199  12.421
  628   HD12  LEU   8          HD12      LEU   8  17.822   4.021  10.861
  629   HD13  LEU   8          HD13      LEU   8  16.538   2.882  11.262
  630   HD21  LEU   8          HD21      LEU   8  14.918   4.939  10.692
  631   HD22  LEU   8          HD22      LEU   8  16.415   5.820  10.383
  632   HD23  LEU   8          HD23      LEU   8  15.243   6.452  11.539
  633    H    SER   9           HN       SER   9  14.875   5.099  16.267
  634    HA   SER   9           HA       SER   9  16.581   7.364  16.285
  635    HB2  SER   9           HB2      SER   9  14.297   7.543  17.071
  636    HB3  SER   9           HB1      SER   9  14.601   6.362  18.342
  637    HG   SER   9           HG       SER   9  15.973   8.833  18.045
  638    H    ILE  10           HN       ILE  10  16.283   4.630  18.556
  639    HA   ILE  10           HA       ILE  10  18.484   5.513  20.166
  640    HB   ILE  10           HB       ILE  10  18.234   3.334  21.297
  641   HG12  ILE  10          HG12      ILE  10  15.986   2.176  20.241
  642   HG13  ILE  10          HG11      ILE  10  16.800   2.740  18.789
  643   HG21  ILE  10          HG21      ILE  10  15.546   4.582  20.647
  644   HG22  ILE  10          HG22      ILE  10  16.700   5.262  21.796
  645   HG23  ILE  10          HG23      ILE  10  15.968   3.687  22.107
  646   HD11  ILE  10          HD11      ILE  10  17.810   0.807  20.865
  647   HD12  ILE  10          HD12      ILE  10  18.927   1.648  19.789
  648   HD13  ILE  10          HD13      ILE  10  17.691   0.583  19.120
  649    H    CYS  11           HN       CYS  11  18.152   3.504  17.327
  650    HA   CYS  11           HA       CYS  11  20.605   2.084  17.577
  651    HB2  CYS  11           HB2      CYS  11  18.750   1.409  16.074
  652    HB3  CYS  11           HB1      CYS  11  19.066   2.831  15.080
  653    HG   CYS  11           HG       CYS  11  21.040   1.703  14.075
  654    H    SER  12           HN       SER  12  19.697   4.967  15.660
  655    HA   SER  12           HA       SER  12  22.341   5.488  14.757
  656    HB2  SER  12           HB2      SER  12  19.907   7.275  14.929
  657    HB3  SER  12           HB1      SER  12  21.414   7.724  14.135
  658    HG   SER  12           HG       SER  12  21.007   6.343  12.561
  659    H    PHE  13           HN       PHE  13  20.443   6.575  17.522
  660    HA   PHE  13           HA       PHE  13  22.101   8.644  18.422
  661    HB2  PHE  13           HB2      PHE  13  20.015   8.455  19.485
  662    HB3  PHE  13           HB1      PHE  13  20.240   6.737  19.820
  663    HD1  PHE  13           HD1      PHE  13  21.873  10.044  20.546
  664    HD2  PHE  13           HD2      PHE  13  20.917   6.097  21.946
  665    HE1  PHE  13           HE1      PHE  13  22.858  10.588  22.756
  666    HE2  PHE  13           HE2      PHE  13  21.902   6.640  24.155
  667    HZ   PHE  13           HZ       PHE  13  22.873   8.886  24.561
  668    H    ILE  14           HN       ILE  14  22.167   5.167  19.219
  669    HA   ILE  14           HA       ILE  14  24.357   5.282  20.990
  670    HB   ILE  14           HB       ILE  14  23.316   3.055  19.229
  671   HG12  ILE  14          HG12      ILE  14  23.144   3.370  22.230
  672   HG13  ILE  14          HG11      ILE  14  21.930   4.065  21.156
  673   HG21  ILE  14          HG21      ILE  14  25.465   3.078  21.364
  674   HG22  ILE  14          HG22      ILE  14  25.621   2.542  19.691
  675   HG23  ILE  14          HG23      ILE  14  24.655   1.605  20.831
  676   HD11  ILE  14          HD11      ILE  14  21.285   1.933  20.330
  677   HD12  ILE  14          HD12      ILE  14  21.441   1.716  22.072
  678   HD13  ILE  14          HD13      ILE  14  22.720   1.151  20.996
  679    H    LEU  15           HN       LEU  15  24.198   4.644  17.488
  680    HA   LEU  15           HA       LEU  15  26.978   4.231  17.142
  681    HB2  LEU  15           HB2      LEU  15  24.627   4.589  15.437
  682    HB3  LEU  15           HB1      LEU  15  26.095   5.264  14.734
  683    HG   LEU  15           HG       LEU  15  26.555   2.638  15.948
  684   HD11  LEU  15          HD11      LEU  15  25.365   1.450  14.036
  685   HD12  LEU  15          HD12      LEU  15  24.483   2.954  13.766
  686   HD13  LEU  15          HD13      LEU  15  24.316   2.095  15.298
  687   HD21  LEU  15          HD21      LEU  15  28.102   3.828  14.417
  688   HD22  LEU  15          HD22      LEU  15  26.889   3.742  13.139
  689   HD23  LEU  15          HD23      LEU  15  27.623   2.263  13.759
  690    H    SER  16           HN       SER  16  25.079   7.112  17.468
  691    HA   SER  16           HA       SER  16  26.975   8.916  16.295
  692    HB2  SER  16           HB2      SER  16  24.684   9.391  18.211
  693    HB3  SER  16           HB1      SER  16  25.606  10.663  17.414
  694    HG   SER  16           HG       SER  16  23.521   9.469  16.472
  695    H    ALA  17           HN       ALA  17  26.220   7.866  19.596
  696    HA   ALA  17           HA       ALA  17  28.111   9.572  20.879
  697    HB1  ALA  17           HB1      ALA  17  26.169   8.544  22.042
  698    HB2  ALA  17           HB2      ALA  17  27.698   8.219  22.857
  699    HB3  ALA  17           HB3      ALA  17  26.938   6.966  21.876
  700    H    LEU  18           HN       LEU  18  28.258   6.303  19.535
  701    HA   LEU  18           HA       LEU  18  30.832   5.695  20.634
  702    HB2  LEU  18           HB2      LEU  18  29.193   4.467  18.409
  703    HB3  LEU  18           HB1      LEU  18  30.720   3.802  18.992
  704    HG   LEU  18           HG       LEU  18  28.425   4.387  20.865
  705   HD11  LEU  18          HD11      LEU  18  27.644   2.807  19.127
  706   HD12  LEU  18          HD12      LEU  18  27.814   2.011  20.690
  707   HD13  LEU  18          HD13      LEU  18  29.040   1.779  19.445
  708   HD21  LEU  18          HD21      LEU  18  30.581   4.079  21.935
  709   HD22  LEU  18          HD22      LEU  18  30.895   2.632  20.978
  710   HD23  LEU  18          HD23      LEU  18  29.626   2.622  22.202
  711    H    HIS  19           HN       HIS  19  29.626   7.157  17.644
  712    HA   HIS  19           HA       HIS  19  32.029   6.981  16.152
  713    HB2  HIS  19           HB2      HIS  19  29.890   7.433  15.074
  714    HB3  HIS  19           HB1      HIS  19  29.725   8.938  15.977
  715    HD2  HIS  19           HD2      HIS  19  31.751   7.535  12.918
  716    HE1  HIS  19           HE1      HIS  19  32.608  11.651  13.277
  717    HE2  HIS  19           HE2      HIS  19  32.922   9.594  11.822
  718    H    PHE  20           HN       PHE  20  30.623   9.565  18.173
  719    HA   PHE  20           HA       PHE  20  32.842  11.328  17.803
  720    HB2  PHE  20           HB2      PHE  20  30.338  11.323  19.314
  721    HB3  PHE  20           HB1      PHE  20  31.665  12.110  20.169
  722    HD1  PHE  20           HD1      PHE  20  30.126  11.949  16.742
  723    HD2  PHE  20           HD2      PHE  20  32.175  14.330  19.675
  724    HE1  PHE  20           HE1      PHE  20  29.918  13.939  15.276
  725    HE2  PHE  20           HE2      PHE  20  31.965  16.317  18.207
  726    HZ   PHE  20           HZ       PHE  20  30.837  16.121  16.011
  727    H    MET  21           HN       MET  21  32.111   8.729  20.027
  728    HA   MET  21           HA       MET  21  33.953   9.339  22.069
  729    HB2  MET  21           HB2      MET  21  32.386   7.031  21.194
  730    HB3  MET  21           HB1      MET  21  33.930   6.578  21.920
  731    HG2  MET  21           HG2      MET  21  32.144   8.622  23.234
  732    HG3  MET  21           HG1      MET  21  31.892   6.897  23.499
  733    HE1  MET  21           HE1      MET  21  33.551   7.924  26.788
  734    HE2  MET  21           HE2      MET  21  32.493   6.703  26.088
  735    HE3  MET  21           HE3      MET  21  32.156   8.410  25.816
  736    H    ALA  22           HN       ALA  22  34.328   7.107  19.291
  737    HA   ALA  22           HA       ALA  22  37.080   6.626  19.727
  738    HB1  ALA  22           HB1      ALA  22  35.340   5.405  18.190
  739    HB2  ALA  22           HB2      ALA  22  37.043   5.444  17.734
  740    HB3  ALA  22           HB3      ALA  22  35.901   6.554  16.975
  741    H    TRP  23           HN       TRP  23  35.363   9.026  17.770
  742    HA   TRP  23           HA       TRP  23  37.544  10.110  16.394
  743    HB2  TRP  23           HB2      TRP  23  34.801  10.795  16.880
  744    HB3  TRP  23           HB1      TRP  23  35.801  12.236  17.058
  745    HD1  TRP  23           HD1      TRP  23  35.143   9.396  14.527
  746    HE1  TRP  23           HE1      TRP  23  35.674  10.295  12.167
  747    HE3  TRP  23           HE3      TRP  23  36.946  14.021  15.725
  748    HZ2  TRP  23           HZ2      TRP  23  36.730  12.661  10.951
  749    HZ3  TRP  23           HZ3      TRP  23  37.705  15.578  13.955
  750    HH2  TRP  23           HH2      TRP  23  37.600  14.902  11.568
  751    H    THR  24           HN       THR  24  36.151  11.080  19.525
  752    HA   THR  24           HA       THR  24  37.882  13.184  20.098
  753    HB   THR  24           HB       THR  24  36.611  11.221  22.026
  754    HG1  THR  24           HG1      THR  24  35.070  12.982  22.145
  755   HG21  THR  24          HG21      THR  24  38.313  12.457  23.182
  756   HG22  THR  24          HG22      THR  24  36.772  13.215  23.582
  757   HG23  THR  24          HG23      THR  24  37.838  13.962  22.391
  758    H    ILE  25           HN       ILE  25  38.215   9.709  20.780
  759    HA   ILE  25           HA       ILE  25  40.666   9.908  22.200
  760    HB   ILE  25           HB       ILE  25  39.507   7.618  20.591
  761   HG12  ILE  25          HG12      ILE  25  39.507   8.066  23.589
  762   HG13  ILE  25          HG11      ILE  25  38.177   8.582  22.552
  763   HG21  ILE  25          HG21      ILE  25  41.838   7.818  22.514
  764   HG22  ILE  25          HG22      ILE  25  41.819   7.133  20.889
  765   HG23  ILE  25          HG23      ILE  25  41.011   6.291  22.210
  766   HD11  ILE  25          HD11      ILE  25  37.842   6.285  21.783
  767   HD12  ILE  25          HD12      ILE  25  37.776   6.334  23.546
  768   HD13  ILE  25          HD13      ILE  25  39.225   5.742  22.732
  769    H    GLY  26           HN       GLY  26  39.883   9.479  18.805
  770    HA2  GLY  26           HA2      GLY  26  42.432   8.919  17.778
  771    HA3  GLY  26           HA1      GLY  26  41.154   9.734  16.878
  772    H    HIS  27           HN       HIS  27  40.824  12.077  18.172
  773    HA   HIS  27           HA       HIS  27  43.020  13.634  17.292
  774    HB2  HIS  27           HB2      HIS  27  40.553  14.197  18.902
  775    HB3  HIS  27           HB1      HIS  27  41.806  15.429  18.743
  776    HD2  HIS  27           HD2      HIS  27  40.444  17.034  16.861
  777    HE1  HIS  27           HE1      HIS  27  40.053  14.056  13.895
  778    HE2  HIS  27           HE2      HIS  27  39.747  16.527  14.396
  779    H    LEU  28           HN       LEU  28  42.109  12.295  20.411
  780    HA   LEU  28           HA       LEU  28  43.834  13.774  22.047
  781    HB2  LEU  28           HB2      LEU  28  42.106  11.572  22.356
  782    HB3  LEU  28           HB1      LEU  28  43.687  11.012  22.894
  783    HG   LEU  28           HG       LEU  28  42.496  11.986  24.784
  784   HD11  LEU  28          HD11      LEU  28  45.028  12.440  24.341
  785   HD12  LEU  28          HD12      LEU  28  44.206  13.376  25.588
  786   HD13  LEU  28          HD13      LEU  28  44.510  14.094  24.007
  787   HD21  LEU  28          HD21      LEU  28  41.553  14.153  24.786
  788   HD22  LEU  28          HD22      LEU  28  41.104  13.510  23.208
  789   HD23  LEU  28          HD23      LEU  28  42.446  14.646  23.349
  790    H    ASN  29           HN       ASN  29  44.432  11.006  19.948
  791    HA   ASN  29           HA       ASN  29  46.394   9.932  19.367
  792    HB2  ASN  29           HB2      ASN  29  47.560  12.644  20.049
  793    HB3  ASN  29           HB1      ASN  29  48.350  11.395  19.088
  794   HD21  ASN  29          HD21      ASN  29  46.967  14.245  18.560
  795   HD22  ASN  29          HD22      ASN  29  46.131  13.949  17.114
  796    H    GLN  30           HN       GLN  30  45.705   9.106  21.805
  797    HA   GLN  30           HA       GLN  30  47.309   9.600  24.003
  798    HB2  GLN  30           HB2      GLN  30  46.626   7.482  24.841
  799    HB3  GLN  30           HB1      GLN  30  45.297   8.029  23.818
  800    HG2  GLN  30           HG2      GLN  30  46.339   6.709  21.923
  801    HG3  GLN  30           HG1      GLN  30  47.451   6.023  23.105
  802   HE21  GLN  30          HE21      GLN  30  46.748   3.988  23.726
  803   HE22  GLN  30          HE22      GLN  30  45.127   3.550  23.974
  804    H    ILE  31           HN       ILE  31  48.064   7.883  21.068
  805    HA   ILE  31           HA       ILE  31  50.353   6.478  21.994
  806    HB   ILE  31           HB       ILE  31  50.948   6.402  19.540
  807   HG12  ILE  31          HG12      ILE  31  48.268   7.743  19.140
  808   HG13  ILE  31          HG11      ILE  31  49.773   8.663  19.133
  809   HG21  ILE  31          HG21      ILE  31  48.829   5.115  18.940
  810   HG22  ILE  31          HG22      ILE  31  48.187   5.620  20.503
  811   HG23  ILE  31          HG23      ILE  31  49.632   4.611  20.427
  812   HD11  ILE  31          HD11      ILE  31  49.065   7.960  16.843
  813   HD12  ILE  31          HD12      ILE  31  49.208   6.276  17.347
  814   HD13  ILE  31          HD13      ILE  31  50.640   7.308  17.297
  815    H    LYS  32           HN       LYS  32  52.571   6.963  20.952
  816    HA   LYS  32           HA       LYS  32  53.701   9.197  22.102
  817    HB2  LYS  32           HB2      LYS  32  55.634   8.804  20.689
  818    HB3  LYS  32           HB1      LYS  32  54.954   7.250  21.169
  819    HG2  LYS  32           HG2      LYS  32  53.690   7.200  19.001
  820    HG3  LYS  32           HG1      LYS  32  54.547   8.664  18.519
  821    HD2  LYS  32           HD2      LYS  32  56.700   7.501  18.741
  822    HD3  LYS  32           HD1      LYS  32  55.866   6.039  19.267
  823    HE2  LYS  32           HE2      LYS  32  56.381   5.842  16.894
  824    HE3  LYS  32           HE1      LYS  32  54.636   6.008  17.092
  825    HZ1  LYS  32           HZ1      LYS  32  55.494   7.440  15.334
  826    HZ2  LYS  32           HZ2      LYS  32  56.509   8.221  16.449
  827    HZ3  LYS  32           HZ3      LYS  32  54.822   8.352  16.597
  828    H    ARG  33           HN       ARG  33  54.041  11.294  21.533
  829    HA   ARG  33           HA       ARG  33  52.367  12.387  19.443
  830    HB2  ARG  33           HB2      ARG  33  54.184  13.554  21.540
  831    HB3  ARG  33           HB1      ARG  33  53.495  14.562  20.267
  832    HG2  ARG  33           HG2      ARG  33  51.347  14.354  21.071
  833    HG3  ARG  33           HG1      ARG  33  51.637  12.738  21.720
  834    HD2  ARG  33           HD2      ARG  33  53.059  13.747  23.500
  835    HD3  ARG  33           HD1      ARG  33  52.654  15.345  22.883
  836    HE   ARG  33           HE       ARG  33  50.219  14.203  23.343
  837   HH11  ARG  33          HH11      ARG  33  53.105  14.653  25.251
  838   HH12  ARG  33          HH12      ARG  33  52.241  14.756  26.747
  839   HH21  ARG  33          HH21      ARG  33  49.121  14.337  25.313
  840   HH22  ARG  33          HH22      ARG  33  50.003  14.579  26.785
  841    H1   MET   1           HT1      MET   1   4.227  19.529  21.904
  842    H2   MET   1           HT2      MET   1   4.700  21.138  21.640
  843    H3   MET   1           HT3      MET   1   5.807  19.873  21.395
  844    HA   MET   1           HA       MET   1   3.526  19.386  19.831
  845    HB2  MET   1           HB2      MET   1   4.505  22.194  19.943
  846    HB3  MET   1           HB1      MET   1   4.235  21.527  18.334
  847    HG2  MET   1           HG2      MET   1   1.961  20.701  19.366
  848    HG3  MET   1           HG1      MET   1   2.260  21.975  20.547
  849    HE1  MET   1           HE1      MET   1   1.658  24.257  20.298
  850    HE2  MET   1           HE2      MET   1   1.887  25.220  18.841
  851    HE3  MET   1           HE3      MET   1   3.267  24.409  19.576
  852    H    PHE   2           HN       PHE   2   5.593  17.843  20.211
  853    HA   PHE   2           HA       PHE   2   7.353  18.270  17.869
  854    HB2  PHE   2           HB2      PHE   2   8.037  16.884  20.473
  855    HB3  PHE   2           HB1      PHE   2   9.103  17.032  19.075
  856    HD1  PHE   2           HD1      PHE   2   8.142  18.515  22.141
  857    HD2  PHE   2           HD2      PHE   2   9.433  19.496  18.163
  858    HE1  PHE   2           HE1      PHE   2   8.863  20.753  22.928
  859    HE2  PHE   2           HE2      PHE   2  10.155  21.734  18.950
  860    HZ   PHE   2           HZ       PHE   2   9.870  22.362  21.332
  861    H    GLU   3           HN       GLU   3   7.195  16.769  16.338
  862    HA   GLU   3           HA       GLU   3   5.631  14.367  16.876
  863    HB2  GLU   3           HB2      GLU   3   6.640  15.659  14.345
  864    HB3  GLU   3           HB1      GLU   3   5.854  14.079  14.356
  865    HG2  GLU   3           HG2      GLU   3   3.859  15.051  15.394
  866    HG3  GLU   3           HG1      GLU   3   4.641  16.630  15.457
  867    HA   PRO   4           HA       PRO   4   8.883  11.412  17.098
  868    HB2  PRO   4           HB2      PRO   4   7.720  10.040  14.712
  869    HB3  PRO   4           HB1      PRO   4   8.102   9.384  16.317
  870    HG2  PRO   4           HG2      PRO   4   5.597   9.869  15.604
  871    HG3  PRO   4           HG1      PRO   4   6.158  10.190  17.255
  872    HD2  PRO   4           HD2      PRO   4   5.595  12.132  15.046
  873    HD3  PRO   4           HD1      PRO   4   5.361  12.314  16.799
  874    H    PHE   5           HN       PHE   5   8.078  12.097  13.680
  875    HA   PHE   5           HA       PHE   5  10.731  11.634  12.728
  876    HB2  PHE   5           HB2      PHE   5   9.759  11.796  10.704
  877    HB3  PHE   5           HB1      PHE   5   8.229  11.982  11.559
  878    HD1  PHE   5           HD1      PHE   5  10.885  13.687   9.708
  879    HD2  PHE   5           HD2      PHE   5   7.289  14.239  11.992
  880    HE1  PHE   5           HE1      PHE   5  10.704  16.011   8.861
  881    HE2  PHE   5           HE2      PHE   5   7.108  16.563  11.145
  882    HZ   PHE   5           HZ       PHE   5   8.817  17.447   9.578
  883    H    GLN   6           HN       GLN   6   8.988  14.419  13.927
  884    HA   GLN   6           HA       GLN   6  10.751  16.428  12.964
  885    HB2  GLN   6           HB2      GLN   6   8.415  16.785  13.866
  886    HB3  GLN   6           HB1      GLN   6   9.086  16.555  15.483
  887    HG2  GLN   6           HG2      GLN   6   9.121  18.907  15.137
  888    HG3  GLN   6           HG1      GLN   6  10.781  18.381  14.863
  889   HE21  GLN   6          HE21      GLN   6  11.116  20.277  13.428
  890   HE22  GLN   6          HE22      GLN   6  10.473  20.279  11.856
  891    H    ILE   7           HN       ILE   7  10.635  14.527  15.955
  892    HA   ILE   7           HA       ILE   7  12.730  15.874  17.309
  893    HB   ILE   7           HB       ILE   7  11.678  13.048  17.566
  894   HG12  ILE   7          HG12      ILE   7  11.255  15.426  19.386
  895   HG13  ILE   7          HG11      ILE   7  10.170  15.076  18.038
  896   HG21  ILE   7          HG21      ILE   7  13.579  14.650  19.305
  897   HG22  ILE   7          HG22      ILE   7  13.928  13.132  18.478
  898   HG23  ILE   7          HG23      ILE   7  12.788  13.161  19.822
  899   HD11  ILE   7          HD11      ILE   7   9.441  14.096  20.252
  900   HD12  ILE   7          HD12      ILE   7  10.864  13.056  20.183
  901   HD13  ILE   7          HD13      ILE   7   9.610  12.920  18.949
  902    H    LEU   8           HN       LEU   8  12.676  12.953  15.274
  903    HA   LEU   8           HA       LEU   8  15.484  12.476  15.523
  904    HB2  LEU   8           HB2      LEU   8  13.789  10.737  14.888
  905    HB3  LEU   8           HB1      LEU   8  13.638  11.532  13.320
  906    HG   LEU   8           HG       LEU   8  16.161  11.274  13.083
  907   HD11  LEU   8          HD11      LEU   8  16.797  10.871  15.372
  908   HD12  LEU   8          HD12      LEU   8  17.107   9.383  14.481
  909   HD13  LEU   8          HD13      LEU   8  15.676   9.516  15.504
  910   HD21  LEU   8          HD21      LEU   8  14.361   8.842  13.269
  911   HD22  LEU   8          HD22      LEU   8  15.960   8.814  12.528
  912   HD23  LEU   8          HD23      LEU   8  14.687   9.822  11.839
  913    H    SER   9           HN       SER   9  13.484  14.359  13.379
  914    HA   SER   9           HA       SER   9  15.365  14.760  11.291
  915    HB2  SER   9           HB2      SER   9  13.016  15.209  10.920
  916    HB3  SER   9           HB1      SER   9  13.011  16.436  12.185
  917    HG   SER   9           HG       SER   9  14.638  16.500   9.855
  918    H    ILE  10           HN       ILE  10  14.483  16.785  14.092
  919    HA   ILE  10           HA       ILE  10  16.479  18.757  13.501
  920    HB   ILE  10           HB       ILE  10  15.861  19.704  15.695
  921   HG12  ILE  10          HG12      ILE  10  13.703  18.260  16.572
  922   HG13  ILE  10          HG11      ILE  10  14.775  16.979  16.025
  923   HG21  ILE  10          HG21      ILE  10  13.429  18.743  14.157
  924   HG22  ILE  10          HG22      ILE  10  14.451  20.088  13.648
  925   HG23  ILE  10          HG23      ILE  10  13.541  20.192  15.155
  926   HD11  ILE  10          HD11      ILE  10  15.276  19.057  18.145
  927   HD12  ILE  10          HD12      ILE  10  16.617  18.213  17.370
  928   HD13  ILE  10          HD13      ILE  10  15.405  17.305  18.274
  929    H    CYS  11           HN       CYS  11  16.397  15.784  15.334
  930    HA   CYS  11           HA       CYS  11  18.646  16.299  17.002
  931    HB2  CYS  11           HB2      CYS  11  16.986  14.501  17.414
  932    HB3  CYS  11           HB1      CYS  11  17.578  13.655  15.985
  933    HG   CYS  11           HG       CYS  11  19.569  12.884  17.257
  934    H    SER  12           HN       SER  12  18.305  14.460  13.956
  935    HA   SER  12           HA       SER  12  21.095  13.982  13.656
  936    HB2  SER  12           HB2      SER  12  18.836  13.902  11.648
  937    HB3  SER  12           HB1      SER  12  20.481  13.368  11.313
  938    HG   SER  12           HG       SER  12  20.197  11.670  12.570
  939    H    PHE  13           HN       PHE  13  18.908  16.501  12.526
  940    HA   PHE  13           HA       PHE  13  20.589  17.760  10.670
  941    HB2  PHE  13           HB2      PHE  13  18.357  18.490  10.700
  942    HB3  PHE  13           HB1      PHE  13  18.370  18.748  12.445
  943    HD1  PHE  13           HD1      PHE  13  20.171  19.909   9.357
  944    HD2  PHE  13           HD2      PHE  13  18.654  20.908  13.249
  945    HE1  PHE  13           HE1      PHE  13  20.855  22.270   9.019
  946    HE2  PHE  13           HE2      PHE  13  19.336  23.267  12.912
  947    HZ   PHE  13           HZ       PHE  13  20.438  23.948  10.797
  948    H    ILE  14           HN       ILE  14  20.219  18.336  14.174
  949    HA   ILE  14           HA       ILE  14  22.110  20.419  14.357
  950    HB   ILE  14           HB       ILE  14  21.151  18.391  16.384
  951   HG12  ILE  14          HG12      ILE  14  20.554  21.348  16.196
  952   HG13  ILE  14          HG11      ILE  14  19.586  20.152  15.332
  953   HG21  ILE  14          HG21      ILE  14  22.943  20.815  16.678
  954   HG22  ILE  14          HG22      ILE  14  23.301  19.153  17.147
  955   HG23  ILE  14          HG23      ILE  14  22.091  20.079  18.035
  956   HD11  ILE  14          HD11      ILE  14  18.879  19.111  17.348
  957   HD12  ILE  14          HD12      ILE  14  18.751  20.841  17.662
  958   HD13  ILE  14          HD13      ILE  14  20.119  19.929  18.300
  959    H    LEU  15           HN       LEU  15  22.430  16.898  14.812
  960    HA   LEU  15           HA       LEU  15  25.181  16.942  15.486
  961    HB2  LEU  15           HB2      LEU  15  23.158  14.935  14.813
  962    HB3  LEU  15           HB1      LEU  15  24.773  14.498  14.256
  963    HG   LEU  15           HG       LEU  15  24.800  15.600  16.969
  964   HD11  LEU  15          HD11      LEU  15  23.810  13.465  17.938
  965   HD12  LEU  15          HD12      LEU  15  23.121  13.163  16.344
  966   HD13  LEU  15          HD13      LEU  15  22.645  14.598  17.254
  967   HD21  LEU  15          HD21      LEU  15  26.664  14.389  15.868
  968   HD22  LEU  15          HD22      LEU  15  25.656  12.946  15.771
  969   HD23  LEU  15          HD23      LEU  15  26.149  13.572  17.344
  970    H    SER  16           HN       SER  16  23.528  17.165  12.448
  971    HA   SER  16           HA       SER  16  25.737  16.392  10.790
  972    HB2  SER  16           HB2      SER  16  23.235  17.974  10.180
  973    HB3  SER  16           HB1      SER  16  24.381  17.405   8.970
  974    HG   SER  16           HG       SER  16  22.363  16.091   9.901
  975    H    ALA  17           HN       ALA  17  24.398  19.473  11.922
  976    HA   ALA  17           HA       ALA  17  26.216  21.125  10.465
  977    HB1  ALA  17           HB1      ALA  17  24.033  21.923  11.348
  978    HB2  ALA  17           HB2      ALA  17  25.384  22.934  11.862
  979    HB3  ALA  17           HB3      ALA  17  24.671  21.777  12.986
  980    H    LEU  18           HN       LEU  18  26.267  19.615  13.665
  981    HA   LEU  18           HA       LEU  18  28.575  21.045  14.579
  982    HB2  LEU  18           HB2      LEU  18  27.190  18.530  15.532
  983    HB3  LEU  18           HB1      LEU  18  28.542  19.291  16.372
  984    HG   LEU  18           HG       LEU  18  26.050  20.838  15.647
  985   HD11  LEU  18          HD11      LEU  18  25.402  18.910  17.059
  986   HD12  LEU  18          HD12      LEU  18  25.258  20.431  17.941
  987   HD13  LEU  18          HD13      LEU  18  26.633  19.367  18.238
  988   HD21  LEU  18          HD21      LEU  18  27.982  22.193  16.221
  989   HD22  LEU  18          HD22      LEU  18  28.302  21.206  17.646
  990   HD23  LEU  18          HD23      LEU  18  26.866  22.228  17.585
  991    H    HIS  19           HN       HIS  19  27.978  18.003  12.874
  992    HA   HIS  19           HA       HIS  19  30.554  16.875  13.210
  993    HB2  HIS  19           HB2      HIS  19  28.652  15.524  12.497
  994    HB3  HIS  19           HB1      HIS  19  28.492  16.483  11.026
  995    HD2  HIS  19           HD2      HIS  19  30.825  13.678  12.485
  996    HE1  HIS  19           HE1      HIS  19  31.988  14.406   8.494
  997    HE2  HIS  19           HE2      HIS  19  32.333  12.894  10.504
  998    H    PHE  20           HN       PHE  20  29.098  18.823  10.596
  999    HA   PHE  20           HA       PHE  20  31.500  18.892   9.047
 1000    HB2  PHE  20           HB2      PHE  20  28.803  20.013   8.866
 1001    HB3  PHE  20           HB1      PHE  20  30.051  21.099   8.256
 1002    HD1  PHE  20           HD1      PHE  20  29.045  17.479   8.106
 1003    HD2  PHE  20           HD2      PHE  20  30.835  20.815   6.072
 1004    HE1  PHE  20           HE1      PHE  20  29.261  16.110   6.048
 1005    HE2  PHE  20           HE2      PHE  20  31.050  19.443   4.014
 1006    HZ   PHE  20           HZ       PHE  20  30.277  17.071   4.000
 1007    H    MET  21           HN       MET  21  30.208  20.814  11.666
 1008    HA   MET  21           HA       MET  21  31.762  23.144  11.337
 1009    HB2  MET  21           HB2      MET  21  30.141  21.910  13.432
 1010    HB3  MET  21           HB1      MET  21  31.508  22.824  14.070
 1011    HG2  MET  21           HG2      MET  21  29.740  23.986  11.922
 1012    HG3  MET  21           HG1      MET  21  29.293  24.102  13.625
 1013    HE1  MET  21           HE1      MET  21  30.518  27.658  12.930
 1014    HE2  MET  21           HE2      MET  21  29.472  26.733  14.005
 1015    HE3  MET  21           HE3      MET  21  29.338  26.523  12.260
 1016    H    ALA  22           HN       ALA  22  32.355  20.317  13.464
 1017    HA   ALA  22           HA       ALA  22  34.949  21.128  14.233
 1018    HB1  ALA  22           HB1      ALA  22  33.363  19.281  15.204
 1019    HB2  ALA  22           HB2      ALA  22  35.112  19.085  15.312
 1020    HB3  ALA  22           HB3      ALA  22  34.206  18.235  14.061
 1021    H    TRP  23           HN       TRP  23  33.776  19.089  11.588
 1022    HA   TRP  23           HA       TRP  23  36.231  18.118  10.663
 1023    HB2  TRP  23           HB2      TRP  23  33.520  18.234   9.733
 1024    HB3  TRP  23           HB1      TRP  23  34.608  18.648   8.408
 1025    HD1  TRP  23           HD1      TRP  23  34.088  15.877  11.045
 1026    HE1  TRP  23           HE1      TRP  23  35.058  13.682  10.098
 1027    HE3  TRP  23           HE3      TRP  23  36.104  17.609   6.685
 1028    HZ2  TRP  23           HZ2      TRP  23  36.499  12.784   7.795
 1029    HZ3  TRP  23           HZ3      TRP  23  37.266  16.066   5.134
 1030    HH2  TRP  23           HH2      TRP  23  37.466  13.656   5.683
 1031    H    THR  24           HN       THR  24  34.472  21.064   9.715
 1032    HA   THR  24           HA       THR  24  36.281  22.012   7.817
 1033    HB   THR  24           HB       THR  24  34.558  23.608   9.731
 1034    HG1  THR  24           HG1      THR  24  33.185  23.608   7.832
 1035   HG21  THR  24          HG21      THR  24  36.172  25.073   8.726
 1036   HG22  THR  24          HG22      THR  24  34.663  25.289   7.839
 1037   HG23  THR  24          HG23      THR  24  35.963  24.317   7.148
 1038    H    ILE  25           HN       ILE  25  36.193  22.516  11.342
 1039    HA   ILE  25           HA       ILE  25  38.401  24.296  11.449
 1040    HB   ILE  25           HB       ILE  25  37.297  22.396  13.532
 1041   HG12  ILE  25          HG12      ILE  25  36.883  25.382  13.230
 1042   HG13  ILE  25          HG11      ILE  25  35.778  24.196  12.536
 1043   HG21  ILE  25          HG21      ILE  25  39.315  24.648  13.657
 1044   HG22  ILE  25          HG22      ILE  25  39.482  22.999  14.260
 1045   HG23  ILE  25          HG23      ILE  25  38.409  24.131  15.081
 1046   HD11  ILE  25          HD11      ILE  25  35.353  23.245  14.749
 1047   HD12  ILE  25          HD12      ILE  25  35.026  24.977  14.774
 1048   HD13  ILE  25          HD13      ILE  25  36.519  24.352  15.472
 1049    H    GLY  26           HN       GLY  26  38.110  20.802  11.641
 1050    HA2  GLY  26           HA2      GLY  26  40.722  20.127  12.401
 1051    HA3  GLY  26           HA1      GLY  26  39.677  19.102  11.421
 1052    H    HIS  27           HN       HIS  27  39.369  20.474   9.120
 1053    HA   HIS  27           HA       HIS  27  41.807  20.024   7.751
 1054    HB2  HIS  27           HB2      HIS  27  39.185  21.284   7.021
 1055    HB3  HIS  27           HB1      HIS  27  40.554  21.389   5.913
 1056    HD2  HIS  27           HD2      HIS  27  39.648  19.430   4.095
 1057    HE1  HIS  27           HE1      HIS  27  39.442  16.259   6.875
 1058    HE2  HIS  27           HE2      HIS  27  39.292  16.862   4.413
 1059    H    LEU  28           HN       LEU  28  40.317  22.883   9.147
 1060    HA   LEU  28           HA       LEU  28  41.896  24.846   7.917
 1061    HB2  LEU  28           HB2      LEU  28  39.948  24.762   9.945
 1062    HB3  LEU  28           HB1      LEU  28  41.370  25.490  10.688
 1063    HG   LEU  28           HG       LEU  28  40.001  27.242   9.690
 1064   HD11  LEU  28          HD11      LEU  28  42.600  27.205   9.471
 1065   HD12  LEU  28          HD12      LEU  28  41.689  28.373   8.516
 1066   HD13  LEU  28          HD13      LEU  28  42.294  26.899   7.760
 1067   HD21  LEU  28          HD21      LEU  28  39.270  27.240   7.441
 1068   HD22  LEU  28          HD22      LEU  28  39.010  25.577   7.962
 1069   HD23  LEU  28          HD23      LEU  28  40.414  25.981   6.973
 1070    H    ASN  29           HN       ASN  29  42.551  22.692  10.628
 1071    HA   ASN  29           HA       ASN  29  44.471  22.341  11.867
 1072    HB2  ASN  29           HB2      ASN  29  45.765  23.353   9.321
 1073    HB3  ASN  29           HB1      ASN  29  46.572  22.442  10.595
 1074   HD21  ASN  29          HD21      ASN  29  45.557  21.895   7.599
 1075   HD22  ASN  29          HD22      ASN  29  44.924  20.326   7.740
 1076    H    GLN  30           HN       GLN  30  43.345  24.594  12.733
 1077    HA   GLN  30           HA       GLN  30  44.635  27.031  12.506
 1078    HB2  GLN  30           HB2      GLN  30  43.640  27.628  14.583
 1079    HB3  GLN  30           HB1      GLN  30  42.539  26.455  13.859
 1080    HG2  GLN  30           HG2      GLN  30  43.734  24.657  15.185
 1081    HG3  GLN  30           HG1      GLN  30  44.584  25.948  16.034
 1082   HE21  GLN  30          HE21      GLN  30  43.610  26.328  18.016
 1083   HE22  GLN  30          HE22      GLN  30  41.935  26.307  18.299
 1084    H    ILE  31           HN       ILE  31  45.669  24.139  14.149
 1085    HA   ILE  31           HA       ILE  31  47.651  25.304  15.819
 1086    HB   ILE  31           HB       ILE  31  48.603  22.964  15.837
 1087   HG12  ILE  31          HG12      ILE  31  46.150  22.257  14.217
 1088   HG13  ILE  31          HG11      ILE  31  47.717  22.527  13.454
 1089   HG21  ILE  31          HG21      ILE  31  46.491  21.981  16.876
 1090   HG22  ILE  31          HG22      ILE  31  45.668  23.461  16.385
 1091   HG23  ILE  31          HG23      ILE  31  47.008  23.536  17.528
 1092   HD11  ILE  31          HD11      ILE  31  47.305  20.120  13.973
 1093   HD12  ILE  31          HD12      ILE  31  47.214  20.536  15.684
 1094   HD13  ILE  31          HD13      ILE  31  48.723  20.761  14.802
 1095    H    LYS  32           HN       LYS  32  50.036  24.630  15.510
 1096    HA   LYS  32           HA       LYS  32  51.179  26.069  13.456
 1097    HB2  LYS  32           HB2      LYS  32  53.258  24.935  13.973
 1098    HB3  LYS  32           HB1      LYS  32  52.373  25.211  15.474
 1099    HG2  LYS  32           HG2      LYS  32  51.456  22.882  15.293
 1100    HG3  LYS  32           HG1      LYS  32  52.507  22.625  13.901
 1101    HD2  LYS  32           HD2      LYS  32  54.485  23.086  15.283
 1102    HD3  LYS  32           HD1      LYS  32  53.451  23.395  16.678
 1103    HE2  LYS  32           HE2      LYS  32  54.299  21.115  16.813
 1104    HE3  LYS  32           HE1      LYS  32  52.567  21.065  16.482
 1105    HZ1  LYS  32           HZ1      LYS  32  53.812  19.542  15.063
 1106    HZ2  LYS  32           HZ2      LYS  32  54.712  20.841  14.441
 1107    HZ3  LYS  32           HZ3      LYS  32  53.041  20.746  14.149
 1108    H    ARG  33           HN       ARG  33  51.793  25.686  11.380
 1109    HA   ARG  33           HA       ARG  33  50.564  23.445  10.028
 1110    HB2  ARG  33           HB2      ARG  33  52.140  25.853   9.147
 1111    HB3  ARG  33           HB1      ARG  33  51.746  24.556   8.018
 1112    HG2  ARG  33           HG2      ARG  33  49.493  25.023   8.049
 1113    HG3  ARG  33           HG1      ARG  33  49.530  25.608   9.714
 1114    HD2  ARG  33           HD2      ARG  33  50.752  27.635   8.935
 1115    HD3  ARG  33           HD1      ARG  33  50.594  27.064   7.278
 1116    HE   ARG  33           HE       ARG  33  48.022  27.090   8.193
 1117   HH11  ARG  33          HH11      ARG  33  50.614  29.425   8.121
 1118   HH12  ARG  33          HH12      ARG  33  49.545  30.782   8.001
 1119   HH21  ARG  33          HH21      ARG  33  46.654  28.884   8.043
 1120   HH22  ARG  33          HH22      ARG  33  47.322  30.480   7.958
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1  -1.698  17.608   0.934
    2    H2   MET   1           HT2      MET   1  -0.084  18.007   0.579
    3    H3   MET   1           HT3      MET   1  -0.679  18.191   2.159
    4    HA   MET   1           HA       MET   1  -0.599  15.979   2.629
    5    HB2  MET   1           HB2      MET   1  -1.974  15.634   0.392
    6    HB3  MET   1           HB1      MET   1  -0.405  15.146  -0.247
    7    HG2  MET   1           HG2      MET   1  -1.373  13.136   0.568
    8    HG3  MET   1           HG1      MET   1  -0.228  13.620   1.819
    9    HE1  MET   1           HE1      MET   1  -2.184  11.575   2.371
   10    HE2  MET   1           HE2      MET   1  -3.151  12.011   3.776
   11    HE3  MET   1           HE3      MET   1  -1.405  12.244   3.812
   12    H    PHE   2           HN       PHE   2   1.469  17.085   3.209
   13    HA   PHE   2           HA       PHE   2   3.701  16.229   1.473
   14    HB2  PHE   2           HB2      PHE   2   3.527  18.427   3.544
   15    HB3  PHE   2           HB1      PHE   2   5.031  17.925   2.767
   16    HD1  PHE   2           HD1      PHE   2   1.886  19.733   2.364
   17    HD2  PHE   2           HD2      PHE   2   5.307  18.153   0.303
   18    HE1  PHE   2           HE1      PHE   2   1.351  21.141   0.394
   19    HE2  PHE   2           HE2      PHE   2   4.772  19.562  -1.666
   20    HZ   PHE   2           HZ       PHE   2   2.794  21.056  -1.621
   21    H    GLU   3           HN       GLU   3   5.205  14.824   2.239
   22    HA   GLU   3           HA       GLU   3   4.730  13.777   4.929
   23    HB2  GLU   3           HB2      GLU   3   6.225  12.594   2.603
   24    HB3  GLU   3           HB1      GLU   3   6.073  11.830   4.186
   25    HG2  GLU   3           HG2      GLU   3   3.631  11.851   3.983
   26    HG3  GLU   3           HG1      GLU   3   3.752  12.646   2.415
   27    HA   PRO   4           HA       PRO   4   8.448  16.119   6.072
   28    HB2  PRO   4           HB2      PRO   4   8.638  15.127   8.647
   29    HB3  PRO   4           HB1      PRO   4   7.604  16.485   8.165
   30    HG2  PRO   4           HG2      PRO   4   6.892  13.626   8.595
   31    HG3  PRO   4           HG1      PRO   4   5.999  15.094   9.034
   32    HD2  PRO   4           HD2      PRO   4   5.321  13.614   6.881
   33    HD3  PRO   4           HD1      PRO   4   5.145  15.384   6.886
   34    H    PHE   5           HN       PHE   5   8.019  12.665   6.357
   35    HA   PHE   5           HA       PHE   5  10.664  11.934   7.003
   36    HB2  PHE   5           HB2      PHE   5   9.052  10.244   7.236
   37    HB3  PHE   5           HB1      PHE   5   8.407  10.512   5.616
   38    HD1  PHE   5           HD1      PHE   5  11.365   9.241   7.501
   39    HD2  PHE   5           HD2      PHE   5   9.354   9.455   3.711
   40    HE1  PHE   5           HE1      PHE   5  12.916   7.535   6.579
   41    HE2  PHE   5           HE2      PHE   5  10.900   7.751   2.791
   42    HZ   PHE   5           HZ       PHE   5  12.680   6.779   4.217
   43    H    GLN   6           HN       GLN   6   9.079  12.563   3.898
   44    HA   GLN   6           HA       GLN   6  11.130  11.601   2.212
   45    HB2  GLN   6           HB2      GLN   6   9.004  13.709   1.828
   46    HB3  GLN   6           HB1      GLN   6  10.080  13.178   0.533
   47    HG2  GLN   6           HG2      GLN   6   9.283  10.909   0.708
   48    HG3  GLN   6           HG1      GLN   6   8.357  11.294   2.159
   49   HE21  GLN   6          HE21      GLN   6   7.520  10.392  -0.696
   50   HE22  GLN   6          HE22      GLN   6   6.321  11.516  -1.123
   51    H    ILE   7           HN       ILE   7  10.541  14.763   3.611
   52    HA   ILE   7           HA       ILE   7  12.575  16.138   2.198
   53    HB   ILE   7           HB       ILE   7  12.002  18.004   3.400
   54   HG12  ILE   7          HG12      ILE   7  11.878  16.200   5.821
   55   HG13  ILE   7          HG11      ILE   7  13.042  17.469   5.485
   56   HG21  ILE   7          HG21      ILE   7   9.870  16.708   2.740
   57   HG22  ILE   7          HG22      ILE   7   9.697  18.016   3.911
   58   HG23  ILE   7          HG23      ILE   7   9.721  16.340   4.455
   59   HD11  ILE   7          HD11      ILE   7  11.000  19.061   5.510
   60   HD12  ILE   7          HD12      ILE   7  11.569  18.439   7.058
   61   HD13  ILE   7          HD13      ILE   7  10.147  17.732   6.295
   62    H    LEU   8           HN       LEU   8  12.546  14.354   5.248
   63    HA   LEU   8           HA       LEU   8  15.206  15.092   5.979
   64    HB2  LEU   8           HB2      LEU   8  13.547  14.372   7.640
   65    HB3  LEU   8           HB1      LEU   8  13.484  12.776   6.893
   66    HG   LEU   8           HG       LEU   8  15.902  12.473   7.374
   67   HD11  LEU   8          HD11      LEU   8  16.873  14.149   9.067
   68   HD12  LEU   8          HD12      LEU   8  15.560  15.223   8.586
   69   HD13  LEU   8          HD13      LEU   8  16.750  14.697   7.395
   70   HD21  LEU   8          HD21      LEU   8  15.670  12.285   9.847
   71   HD22  LEU   8          HD22      LEU   8  14.259  11.655   8.997
   72   HD23  LEU   8          HD23      LEU   8  14.194  13.245   9.757
   73    H    SER   9           HN       SER   9  13.775  12.519   4.123
   74    HA   SER   9           HA       SER   9  16.096  10.839   4.050
   75    HB2  SER   9           HB2      SER   9  13.814   9.993   3.598
   76    HB3  SER   9           HB1      SER   9  13.759  10.967   2.133
   77    HG   SER   9           HG       SER   9  14.577   8.592   2.196
   78    H    ILE  10           HN       ILE  10  14.693  13.248   1.836
   79    HA   ILE  10           HA       ILE  10  16.578  12.970  -0.233
   80    HB   ILE  10           HB       ILE  10  14.965  15.385   0.638
   81   HG12  ILE  10          HG12      ILE  10  13.828  13.196  -0.159
   82   HG13  ILE  10          HG11      ILE  10  13.359  14.692  -0.961
   83   HG21  ILE  10          HG21      ILE  10  16.727  14.885  -1.771
   84   HG22  ILE  10          HG22      ILE  10  16.730  16.268  -0.678
   85   HG23  ILE  10          HG23      ILE  10  15.405  16.051  -1.819
   86   HD11  ILE  10          HD11      ILE  10  14.608  14.179  -2.896
   87   HD12  ILE  10          HD12      ILE  10  13.895  12.633  -2.439
   88   HD13  ILE  10          HD13      ILE  10  15.582  12.971  -2.060
   89    H    CYS  11           HN       CYS  11  16.509  15.221   2.548
   90    HA   CYS  11           HA       CYS  11  18.936  16.520   1.918
   91    HB2  CYS  11           HB2      CYS  11  17.342  17.437   3.524
   92    HB3  CYS  11           HB1      CYS  11  17.631  16.075   4.609
   93    HG   CYS  11           HG       CYS  11  19.172  18.298   5.100
   94    H    SER  12           HN       SER  12  18.294  13.845   4.217
   95    HA   SER  12           HA       SER  12  20.893  13.454   5.090
   96    HB2  SER  12           HB2      SER  12  18.885  12.334   6.030
   97    HB3  SER  12           HB1      SER  12  18.806  11.316   4.594
   98    HG   SER  12           HG       SER  12  20.817  11.444   6.583
   99    H    PHE  13           HN       PHE  13  19.258  12.002   2.278
  100    HA   PHE  13           HA       PHE  13  21.350  10.347   1.431
  101    HB2  PHE  13           HB2      PHE  13  18.917  11.511   0.230
  102    HB3  PHE  13           HB1      PHE  13  20.177  11.055  -0.918
  103    HD1  PHE  13           HD1      PHE  13  17.411   9.860   0.933
  104    HD2  PHE  13           HD2      PHE  13  21.312   8.709  -0.444
  105    HE1  PHE  13           HE1      PHE  13  16.793   7.470   1.176
  106    HE2  PHE  13           HE2      PHE  13  20.694   6.321  -0.203
  107    HZ   PHE  13           HZ       PHE  13  18.435   5.701   0.606
  108    H    ILE  14           HN       ILE  14  20.614  13.723   0.616
  109    HA   ILE  14           HA       ILE  14  22.668  14.123  -1.261
  110    HB   ILE  14           HB       ILE  14  21.292  16.039   0.635
  111   HG12  ILE  14          HG12      ILE  14  21.045  15.784  -2.368
  112   HG13  ILE  14          HG11      ILE  14  20.035  14.849  -1.267
  113   HG21  ILE  14          HG21      ILE  14  22.214  17.812  -0.892
  114   HG22  ILE  14          HG22      ILE  14  23.246  16.582  -1.619
  115   HG23  ILE  14          HG23      ILE  14  23.446  17.008   0.080
  116   HD11  ILE  14          HD11      ILE  14  20.244  17.873  -1.355
  117   HD12  ILE  14          HD12      ILE  14  19.274  16.959  -0.200
  118   HD13  ILE  14          HD13      ILE  14  18.877  16.912  -1.918
  119    H    LEU  15           HN       LEU  15  22.627  14.501   2.274
  120    HA   LEU  15           HA       LEU  15  25.226  15.558   2.531
  121    HB2  LEU  15           HB2      LEU  15  23.260  14.247   4.327
  122    HB3  LEU  15           HB1      LEU  15  24.942  14.259   4.863
  123    HG   LEU  15           HG       LEU  15  24.136  16.837   3.757
  124   HD11  LEU  15          HD11      LEU  15  22.637  17.453   5.621
  125   HD12  LEU  15          HD12      LEU  15  22.669  15.784   6.195
  126   HD13  LEU  15          HD13      LEU  15  21.935  16.169   4.638
  127   HD21  LEU  15          HD21      LEU  15  25.134  17.614   5.866
  128   HD22  LEU  15          HD22      LEU  15  26.162  16.386   5.126
  129   HD23  LEU  15          HD23      LEU  15  25.127  15.967   6.492
  130    H    SER  16           HN       SER  16  24.135  12.200   3.096
  131    HA   SER  16           HA       SER  16  26.552  10.987   3.528
  132    HB2  SER  16           HB2      SER  16  24.230   9.898   1.919
  133    HB3  SER  16           HB1      SER  16  25.545   8.926   2.572
  134    HG   SER  16           HG       SER  16  24.137   8.843   4.185
  135    H    ALA  17           HN       ALA  17  25.116  11.822   0.399
  136    HA   ALA  17           HA       ALA  17  27.077  10.609  -1.233
  137    HB1  ALA  17           HB1      ALA  17  25.415  13.078  -1.800
  138    HB2  ALA  17           HB2      ALA  17  24.877  11.418  -2.051
  139    HB3  ALA  17           HB3      ALA  17  26.216  12.062  -3.000
  140    H    LEU  18           HN       LEU  18  26.802  13.907   0.096
  141    HA   LEU  18           HA       LEU  18  29.201  14.853  -1.112
  142    HB2  LEU  18           HB2      LEU  18  27.600  15.883   1.234
  143    HB3  LEU  18           HB1      LEU  18  28.950  16.744   0.497
  144    HG   LEU  18           HG       LEU  18  26.510  15.826  -1.048
  145   HD11  LEU  18          HD11      LEU  18  25.834  17.481   0.622
  146   HD12  LEU  18          HD12      LEU  18  25.834  18.222  -0.979
  147   HD13  LEU  18          HD13      LEU  18  27.160  18.542   0.139
  148   HD21  LEU  18          HD21      LEU  18  28.358  16.150  -2.525
  149   HD22  LEU  18          HD22      LEU  18  28.893  17.591  -1.661
  150   HD23  LEU  18          HD23      LEU  18  27.419  17.638  -2.628
  151    H    HIS  19           HN       HIS  19  28.527  13.001   1.733
  152    HA   HIS  19           HA       HIS  19  30.852  13.645   3.246
  153    HB2  HIS  19           HB2      HIS  19  28.866  11.393   3.266
  154    HB3  HIS  19           HB1      HIS  19  30.307  11.319   4.273
  155    HD2  HIS  19           HD2      HIS  19  26.795  12.668   4.557
  156    HE1  HIS  19           HE1      HIS  19  29.094  15.010   7.213
  157    HE2  HIS  19           HE2      HIS  19  26.732  14.389   6.521
  158    H    PHE  20           HN       PHE  20  30.043  10.858   1.149
  159    HA   PHE  20           HA       PHE  20  32.685   9.777   1.318
  160    HB2  PHE  20           HB2      PHE  20  30.194   9.120  -0.095
  161    HB3  PHE  20           HB1      PHE  20  31.659   8.712  -0.988
  162    HD1  PHE  20           HD1      PHE  20  29.498   7.801   1.772
  163    HD2  PHE  20           HD2      PHE  20  33.471   7.346   0.191
  164    HE1  PHE  20           HE1      PHE  20  29.862   5.835   3.243
  165    HE2  PHE  20           HE2      PHE  20  33.829   5.382   1.663
  166    HZ   PHE  20           HZ       PHE  20  32.034   4.621   3.198
  167    H    MET  21           HN       MET  21  31.140  12.173  -0.685
  168    HA   MET  21           HA       MET  21  32.932  12.172  -2.875
  169    HB2  MET  21           HB2      MET  21  30.991  14.065  -1.682
  170    HB3  MET  21           HB1      MET  21  32.215  14.758  -2.739
  171    HG2  MET  21           HG2      MET  21  31.594  13.099  -4.490
  172    HG3  MET  21           HG1      MET  21  30.318  12.494  -3.434
  173    HE1  MET  21           HE1      MET  21  28.695  13.087  -5.708
  174    HE2  MET  21           HE2      MET  21  27.549  14.209  -4.980
  175    HE3  MET  21           HE3      MET  21  28.216  12.893  -4.017
  176    H    ALA  22           HN       ALA  22  32.922  14.115   0.129
  177    HA   ALA  22           HA       ALA  22  35.344  15.459  -0.428
  178    HB1  ALA  22           HB1      ALA  22  33.799  14.899   2.090
  179    HB2  ALA  22           HB2      ALA  22  34.088  16.439   1.280
  180    HB3  ALA  22           HB3      ALA  22  35.392  15.651   2.168
  181    H    TRP  23           HN       TRP  23  34.591  12.394   1.148
  182    HA   TRP  23           HA       TRP  23  37.149  11.823   2.180
  183    HB2  TRP  23           HB2      TRP  23  34.946   9.998   1.202
  184    HB3  TRP  23           HB1      TRP  23  36.394   9.427   2.029
  185    HD1  TRP  23           HD1      TRP  23  35.638  12.664   3.472
  186    HE1  TRP  23           HE1      TRP  23  34.337  12.436   5.685
  187    HE3  TRP  23           HE3      TRP  23  34.222   7.770   3.159
  188    HZ2  TRP  23           HZ2      TRP  23  32.891  10.439   7.132
  189    HZ3  TRP  23           HZ3      TRP  23  32.885   6.725   4.961
  190    HH2  TRP  23           HH2      TRP  23  32.218   8.058   6.953
  191    H    THR  24           HN       THR  24  35.710  10.984  -0.975
  192    HA   THR  24           HA       THR  24  37.862   9.505  -1.976
  193    HB   THR  24           HB       THR  24  36.944  10.015  -4.206
  194    HG1  THR  24           HG1      THR  24  35.335  11.545  -4.399
  195   HG21  THR  24          HG21      THR  24  34.340   9.741  -3.243
  196   HG22  THR  24          HG22      THR  24  35.322   9.037  -1.959
  197   HG23  THR  24          HG23      THR  24  35.447   8.425  -3.609
  198    H    ILE  25           HN       ILE  25  37.223  13.005  -2.053
  199    HA   ILE  25           HA       ILE  25  39.505  13.661  -3.630
  200    HB   ILE  25           HB       ILE  25  37.887  15.302  -1.672
  201   HG12  ILE  25          HG12      ILE  25  37.969  15.299  -4.705
  202   HG13  ILE  25          HG11      ILE  25  36.771  14.421  -3.752
  203   HG21  ILE  25          HG21      ILE  25  38.971  17.254  -2.795
  204   HG22  ILE  25          HG22      ILE  25  40.044  16.138  -3.636
  205   HG23  ILE  25          HG23      ILE  25  40.121  16.277  -1.880
  206   HD11  ILE  25          HD11      ILE  25  36.206  16.628  -2.631
  207   HD12  ILE  25          HD12      ILE  25  35.773  16.523  -4.337
  208   HD13  ILE  25          HD13      ILE  25  37.214  17.412  -3.846
  209    H    GLY  26           HN       GLY  26  38.932  13.415  -0.176
  210    HA2  GLY  26           HA2      GLY  26  41.353  14.463   0.780
  211    HA3  GLY  26           HA1      GLY  26  40.387  13.258   1.627
  212    H    HIS  27           HN       HIS  27  40.512  11.103  -0.037
  213    HA   HIS  27           HA       HIS  27  43.091  10.041   0.530
  214    HB2  HIS  27           HB2      HIS  27  40.930   8.729   0.383
  215    HB3  HIS  27           HB1      HIS  27  41.049   8.878  -1.370
  216    HD2  HIS  27           HD2      HIS  27  42.346   6.672  -2.395
  217    HE1  HIS  27           HE1      HIS  27  44.883   5.874   0.884
  218    HE2  HIS  27           HE2      HIS  27  44.205   5.105  -1.439
  219    H    LEU  28           HN       LEU  28  41.574  11.377  -2.348
  220    HA   LEU  28           HA       LEU  28  43.660  10.606  -4.155
  221    HB2  LEU  28           HB2      LEU  28  41.400  12.598  -4.334
  222    HB3  LEU  28           HB1      LEU  28  42.552  12.342  -5.645
  223    HG   LEU  28           HG       LEU  28  41.038  10.052  -4.381
  224   HD11  LEU  28          HD11      LEU  28  39.376  10.240  -6.116
  225   HD12  LEU  28          HD12      LEU  28  40.259  11.552  -6.896
  226   HD13  LEU  28          HD13      LEU  28  39.487  11.816  -5.333
  227   HD21  LEU  28          HD21      LEU  28  41.534   9.077  -6.675
  228   HD22  LEU  28          HD22      LEU  28  42.956   9.373  -5.677
  229   HD23  LEU  28          HD23      LEU  28  42.544  10.491  -6.976
  230    H    ASN  29           HN       ASN  29  43.457  12.961  -1.728
  231    HA   ASN  29           HA       ASN  29  44.943  14.574  -1.053
  232    HB2  ASN  29           HB2      ASN  29  46.539  12.857  -2.387
  233    HB3  ASN  29           HB1      ASN  29  46.723  14.284  -3.405
  234   HD21  ASN  29          HD21      ASN  29  48.819  14.935  -2.743
  235   HD22  ASN  29          HD22      ASN  29  49.199  15.376  -1.149
  236    H    GLN  30           HN       GLN  30  46.180  16.594  -2.110
  237    HA   GLN  30           HA       GLN  30  44.111  18.107  -3.417
  238    HB2  GLN  30           HB2      GLN  30  46.975  18.875  -2.801
  239    HB3  GLN  30           HB1      GLN  30  45.670  19.980  -3.239
  240    HG2  GLN  30           HG2      GLN  30  45.020  20.085  -1.092
  241    HG3  GLN  30           HG1      GLN  30  44.765  18.341  -1.075
  242   HE21  GLN  30          HE21      GLN  30  47.437  20.749  -0.789
  243   HE22  GLN  30          HE22      GLN  30  48.345  19.822   0.304
  244    H    ILE  31           HN       ILE  31  44.688  19.511  -5.336
  245    HA   ILE  31           HA       ILE  31  46.020  17.825  -7.362
  246    HB   ILE  31           HB       ILE  31  44.055  20.068  -7.844
  247   HG12  ILE  31          HG12      ILE  31  42.925  18.365  -6.522
  248   HG13  ILE  31          HG11      ILE  31  42.390  18.230  -8.196
  249   HG21  ILE  31          HG21      ILE  31  43.815  18.918 -10.036
  250   HG22  ILE  31          HG22      ILE  31  45.076  17.782  -9.554
  251   HG23  ILE  31          HG23      ILE  31  45.459  19.491  -9.759
  252   HD11  ILE  31          HD11      ILE  31  42.838  16.000  -7.389
  253   HD12  ILE  31          HD12      ILE  31  44.420  16.479  -6.779
  254   HD13  ILE  31          HD13      ILE  31  44.126  16.419  -8.516
  255    H    LYS  32           HN       LYS  32  47.814  18.541  -8.318
  256    HA   LYS  32           HA       LYS  32  49.197  20.814  -7.427
  257    HB2  LYS  32           HB2      LYS  32  49.510  19.188  -9.960
  258    HB3  LYS  32           HB1      LYS  32  50.659  20.412  -9.420
  259    HG2  LYS  32           HG2      LYS  32  51.080  19.183  -7.364
  260    HG3  LYS  32           HG1      LYS  32  49.827  18.010  -7.768
  261    HD2  LYS  32           HD2      LYS  32  51.875  16.967  -8.390
  262    HD3  LYS  32           HD1      LYS  32  51.173  17.540  -9.901
  263    HE2  LYS  32           HE2      LYS  32  53.531  18.139  -9.859
  264    HE3  LYS  32           HE1      LYS  32  52.569  19.610  -9.709
  265    HZ1  LYS  32           HZ1      LYS  32  53.368  18.211  -7.263
  266    HZ2  LYS  32           HZ2      LYS  32  53.129  19.871  -7.531
  267    HZ3  LYS  32           HZ3      LYS  32  54.545  19.112  -8.087
  268    H    ARG  33           HN       ARG  33  49.319  22.881  -8.126
  269    HA   ARG  33           HA       ARG  33  48.680  24.831  -9.155
  270    HB2  ARG  33           HB2      ARG  33  49.664  23.276 -11.097
  271    HB3  ARG  33           HB1      ARG  33  48.003  23.404 -11.676
  272    HG2  ARG  33           HG2      ARG  33  48.141  25.867 -11.530
  273    HG3  ARG  33           HG1      ARG  33  49.811  25.735 -10.976
  274    HD2  ARG  33           HD2      ARG  33  49.897  26.166 -13.335
  275    HD3  ARG  33           HD1      ARG  33  50.312  24.469 -13.110
  276    HE   ARG  33           HE       ARG  33  48.374  23.900 -14.242
  277   HH11  ARG  33          HH11      ARG  33  48.211  27.222 -13.194
  278   HH12  ARG  33          HH12      ARG  33  46.752  27.548 -14.065
  279   HH21  ARG  33          HH21      ARG  33  46.473  24.358 -15.373
  280   HH22  ARG  33          HH22      ARG  33  45.775  25.941 -15.289
  281    H1   MET   1           HT1      MET   1   1.068  -3.761  -0.659
  282    H2   MET   1           HT2      MET   1   2.751  -3.828  -0.894
  283    H3   MET   1           HT3      MET   1   1.915  -2.367  -1.129
  284    HA   MET   1           HA       MET   1   1.692  -1.941   1.083
  285    HB2  MET   1           HB2      MET   1   0.693  -4.386   1.273
  286    HB3  MET   1           HB1      MET   1   2.290  -4.762   1.915
  287    HG2  MET   1           HG2      MET   1   1.004  -4.168   3.821
  288    HG3  MET   1           HG1      MET   1   1.958  -2.729   3.461
  289    HE1  MET   1           HE1      MET   1  -0.257  -2.564   5.300
  290    HE2  MET   1           HE2      MET   1  -1.402  -1.332   4.774
  291    HE3  MET   1           HE3      MET   1   0.326  -0.998   4.721
  292    H    PHE   2           HN       PHE   2   3.734  -0.996   0.197
  293    HA   PHE   2           HA       PHE   2   6.131  -2.348   1.268
  294    HB2  PHE   2           HB2      PHE   2   5.829  -0.285  -0.924
  295    HB3  PHE   2           HB1      PHE   2   7.384  -0.809  -0.275
  296    HD1  PHE   2           HD1      PHE   2   4.550  -1.695  -2.397
  297    HD2  PHE   2           HD2      PHE   2   8.099  -3.186  -0.488
  298    HE1  PHE   2           HE1      PHE   2   4.501  -3.696  -3.864
  299    HE2  PHE   2           HE2      PHE   2   8.049  -5.184  -1.957
  300    HZ   PHE   2           HZ       PHE   2   6.251  -5.438  -3.645
  301    H    GLU   3           HN       GLU   3   7.336  -1.369   2.821
  302    HA   GLU   3           HA       GLU   3   6.305   1.177   3.830
  303    HB2  GLU   3           HB2      GLU   3   8.050  -0.888   5.148
  304    HB3  GLU   3           HB1      GLU   3   7.553   0.630   5.900
  305    HG2  GLU   3           HG2      GLU   3   5.195   0.015   5.628
  306    HG3  GLU   3           HG1      GLU   3   5.664  -1.492   4.842
  307    HA   PRO   4           HA       PRO   4   9.986   2.987   1.888
  308    HB2  PRO   4           HB2      PRO   4   9.635   5.532   2.910
  309    HB3  PRO   4           HB1      PRO   4   8.840   4.916   1.451
  310    HG2  PRO   4           HG2      PRO   4   7.782   5.151   4.223
  311    HG3  PRO   4           HG1      PRO   4   6.979   5.468   2.674
  312    HD2  PRO   4           HD2      PRO   4   6.535   3.195   4.066
  313    HD3  PRO   4           HD1      PRO   4   6.537   3.212   2.286
  314    H    PHE   5           HN       PHE   5   9.174   3.114   5.280
  315    HA   PHE   5           HA       PHE   5  11.583   4.182   6.283
  316    HB2  PHE   5           HB2      PHE   5   9.790   4.105   7.797
  317    HB3  PHE   5           HB1      PHE   5   9.461   2.404   7.460
  318    HD1  PHE   5           HD1      PHE   5  11.910   4.738   9.027
  319    HD2  PHE   5           HD2      PHE   5  10.610   0.665   8.601
  320    HE1  PHE   5           HE1      PHE   5  13.431   4.058  10.866
  321    HE2  PHE   5           HE2      PHE   5  12.128  -0.013  10.440
  322    HZ   PHE   5           HZ       PHE   5  13.543   1.683  11.569
  323    H    GLN   6           HN       GLN   6  10.620   0.869   5.482
  324    HA   GLN   6           HA       GLN   6  12.821  -0.467   6.636
  325    HB2  GLN   6           HB2      GLN   6  11.014  -1.158   4.321
  326    HB3  GLN   6           HB1      GLN   6  12.236  -2.264   4.951
  327    HG2  GLN   6           HG2      GLN   6  11.198  -2.276   7.129
  328    HG3  GLN   6           HG1      GLN   6  10.082  -0.995   6.658
  329   HE21  GLN   6          HE21      GLN   6   9.658  -3.967   7.455
  330   HE22  GLN   6          HE22      GLN   6   8.666  -4.566   6.214
  331    H    ILE   7           HN       ILE   7  12.327   0.893   3.441
  332    HA   ILE   7           HA       ILE   7  14.697  -0.129   2.274
  333    HB   ILE   7           HB       ILE   7  14.116   1.001   0.367
  334   HG12  ILE   7          HG12      ILE   7  13.405   3.325   2.163
  335   HG13  ILE   7          HG11      ILE   7  14.730   3.218   1.015
  336   HG21  ILE   7          HG21      ILE   7  12.009  -0.036   1.433
  337   HG22  ILE   7          HG22      ILE   7  11.774   1.120   0.122
  338   HG23  ILE   7          HG23      ILE   7  11.536   1.621   1.794
  339   HD11  ILE   7          HD11      ILE   7  12.881   2.936  -0.774
  340   HD12  ILE   7          HD12      ILE   7  13.111   4.543  -0.087
  341   HD13  ILE   7          HD13      ILE   7  11.778   3.531   0.466
  342    H    LEU   8           HN       LEU   8  13.973   2.835   4.071
  343    HA   LEU   8           HA       LEU   8  16.526   4.016   3.603
  344    HB2  LEU   8           HB2      LEU   8  14.542   5.350   4.155
  345    HB3  LEU   8           HB1      LEU   8  14.444   4.567   5.732
  346    HG   LEU   8           HG       LEU   8  16.698   5.450   6.290
  347   HD11  LEU   8          HD11      LEU   8  17.531   7.320   4.736
  348   HD12  LEU   8          HD12      LEU   8  16.436   6.651   3.526
  349   HD13  LEU   8          HD13      LEU   8  17.752   5.665   4.166
  350   HD21  LEU   8          HD21      LEU   8  16.015   7.847   6.458
  351   HD22  LEU   8          HD22      LEU   8  14.725   6.745   6.946
  352   HD23  LEU   8          HD23      LEU   8  14.676   7.517   5.360
  353    H    SER   9           HN       SER   9  15.179   1.890   6.013
  354    HA   SER   9           HA       SER   9  17.302   2.167   7.914
  355    HB2  SER   9           HB2      SER   9  15.056   1.318   8.520
  356    HB3  SER   9           HB1      SER   9  15.349  -0.113   7.535
  357    HG   SER   9           HG       SER   9  15.903   0.036   9.983
  358    H    ILE  10           HN       ILE  10  16.544  -0.198   5.362
  359    HA   ILE  10           HA       ILE  10  18.718  -1.922   5.821
  360    HB   ILE  10           HB       ILE  10  17.230  -1.286   3.258
  361   HG12  ILE  10          HG12      ILE  10  16.034  -2.311   5.316
  362   HG13  ILE  10          HG11      ILE  10  15.861  -3.148   3.777
  363   HG21  ILE  10          HG21      ILE  10  19.319  -3.368   3.925
  364   HG22  ILE  10          HG22      ILE  10  19.272  -2.262   2.554
  365   HG23  ILE  10          HG23      ILE  10  18.148  -3.617   2.630
  366   HD11  ILE  10          HD11      ILE  10  17.365  -4.854   4.404
  367   HD12  ILE  10          HD12      ILE  10  16.433  -4.560   5.872
  368   HD13  ILE  10          HD13      ILE  10  18.055  -3.891   5.711
  369    H    CYS  11           HN       CYS  11  18.404   0.862   3.587
  370    HA   CYS  11           HA       CYS  11  21.020   0.675   2.544
  371    HB2  CYS  11           HB2      CYS  11  19.277   2.010   1.477
  372    HB3  CYS  11           HB1      CYS  11  19.237   3.096   2.866
  373    HG   CYS  11           HG       CYS  11  20.891   3.888   0.813
  374    H    SER  12           HN       SER  12  19.730   2.779   5.142
  375    HA   SER  12           HA       SER  12  22.088   4.063   5.810
  376    HB2  SER  12           HB2      SER  12  19.846   4.624   6.722
  377    HB3  SER  12           HB1      SER  12  19.913   3.173   7.720
  378    HG   SER  12           HG       SER  12  21.559   5.475   7.809
  379    H    PHE  13           HN       PHE  13  20.817   0.984   7.079
  380    HA   PHE  13           HA       PHE  13  22.850   0.463   8.928
  381    HB2  PHE  13           HB2      PHE  13  20.785  -1.106   7.516
  382    HB3  PHE  13           HB1      PHE  13  22.169  -2.032   8.092
  383    HD1  PHE  13           HD1      PHE  13  19.024  -0.701   9.007
  384    HD2  PHE  13           HD2      PHE  13  22.969  -1.425  10.544
  385    HE1  PHE  13           HE1      PHE  13  18.137  -0.621  11.322
  386    HE2  PHE  13           HE2      PHE  13  22.083  -1.344  12.857
  387    HZ   PHE  13           HZ       PHE  13  19.667  -0.942  13.247
  388    H    ILE  14           HN       ILE  14  22.604  -0.386   5.489
  389    HA   ILE  14           HA       ILE  14  24.976  -1.878   5.293
  390    HB   ILE  14           HB       ILE  14  23.496  -0.202   3.255
  391   HG12  ILE  14          HG12      ILE  14  23.743  -3.209   3.467
  392   HG13  ILE  14          HG11      ILE  14  22.473  -2.318   4.302
  393   HG21  ILE  14          HG21      ILE  14  24.840  -1.510   1.578
  394   HG22  ILE  14          HG22      ILE  14  25.851  -2.082   2.904
  395   HG23  ILE  14          HG23      ILE  14  25.803  -0.363   2.511
  396   HD11  ILE  14          HD11      ILE  14  22.990  -2.302   1.315
  397   HD12  ILE  14          HD12      ILE  14  21.755  -1.346   2.132
  398   HD13  ILE  14          HD13      ILE  14  21.651  -3.106   2.131
  399    H    LEU  15           HN       LEU  15  24.375   1.614   4.925
  400    HA   LEU  15           HA       LEU  15  26.985   2.322   4.146
  401    HB2  LEU  15           HB2      LEU  15  24.618   3.729   5.260
  402    HB3  LEU  15           HB1      LEU  15  26.176   4.542   5.424
  403    HG   LEU  15           HG       LEU  15  25.832   3.377   2.771
  404   HD11  LEU  15          HD11      LEU  15  24.107   4.972   2.014
  405   HD12  LEU  15          HD12      LEU  15  23.875   5.507   3.677
  406   HD13  LEU  15          HD13      LEU  15  23.458   3.857   3.216
  407   HD21  LEU  15          HD21      LEU  15  26.528   5.642   2.111
  408   HD22  LEU  15          HD22      LEU  15  27.539   5.058   3.432
  409   HD23  LEU  15          HD23      LEU  15  26.252   6.219   3.754
  410    H    SER  16           HN       SER  16  25.482   2.628   7.377
  411    HA   SER  16           HA       SER  16  27.653   3.428   8.836
  412    HB2  SER  16           HB2      SER  16  25.539   1.427   9.671
  413    HB3  SER  16           HB1      SER  16  26.621   2.268  10.778
  414    HG   SER  16           HG       SER  16  24.957   3.617  10.725
  415    H    ALA  17           HN       ALA  17  26.861   0.120   7.846
  416    HA   ALA  17           HA       ALA  17  28.942  -1.181   9.240
  417    HB1  ALA  17           HB1      ALA  17  27.657  -1.968   6.613
  418    HB2  ALA  17           HB2      ALA  17  27.005  -2.343   8.209
  419    HB3  ALA  17           HB3      ALA  17  28.544  -3.037   7.700
  420    H    LEU  18           HN       LEU  18  28.777   0.157   5.938
  421    HA   LEU  18           HA       LEU  18  31.429  -0.610   5.239
  422    HB2  LEU  18           HB2      LEU  18  29.563   1.453   4.059
  423    HB3  LEU  18           HB1      LEU  18  31.100   0.974   3.338
  424    HG   LEU  18           HG       LEU  18  28.880  -0.981   3.994
  425   HD11  LEU  18          HD11      LEU  18  28.101   0.590   2.286
  426   HD12  LEU  18          HD12      LEU  18  28.444  -0.972   1.544
  427   HD13  LEU  18          HD13      LEU  18  29.587   0.359   1.365
  428   HD21  LEU  18          HD21      LEU  18  30.977  -2.116   3.854
  429   HD22  LEU  18          HD22      LEU  18  31.496  -1.141   2.478
  430   HD23  LEU  18          HD23      LEU  18  30.220  -2.344   2.277
  431    H    HIS  19           HN       HIS  19  30.101   2.034   7.029
  432    HA   HIS  19           HA       HIS  19  32.185   3.934   6.630
  433    HB2  HIS  19           HB2      HIS  19  30.011   3.569   8.669
  434    HB3  HIS  19           HB1      HIS  19  31.246   4.802   8.896
  435    HD2  HIS  19           HD2      HIS  19  27.887   4.521   7.197
  436    HE1  HIS  19           HE1      HIS  19  29.922   7.581   5.117
  437    HE2  HIS  19           HE2      HIS  19  27.662   6.485   5.489
  438    H    PHE  20           HN       PHE  20  31.468   1.677   9.313
  439    HA   PHE  20           HA       PHE  20  33.923   2.258  10.656
  440    HB2  PHE  20           HB2      PHE  20  31.657   0.430  11.051
  441    HB3  PHE  20           HB1      PHE  20  33.205  -0.209  11.603
  442    HD1  PHE  20           HD1      PHE  20  30.525   2.127  12.300
  443    HD2  PHE  20           HD2      PHE  20  34.643   1.229  13.152
  444    HE1  PHE  20           HE1      PHE  20  30.437   3.597  14.298
  445    HE2  PHE  20           HE2      PHE  20  34.550   2.698  15.148
  446    HZ   PHE  20           HZ       PHE  20  32.455   3.904  15.728
  447    H    MET  21           HN       MET  21  32.989   0.083   8.103
  448    HA   MET  21           HA       MET  21  35.116  -1.776   8.271
  449    HB2  MET  21           HB2      MET  21  33.198  -0.877   6.202
  450    HB3  MET  21           HB1      MET  21  34.647  -1.696   5.627
  451    HG2  MET  21           HG2      MET  21  34.175  -3.565   7.204
  452    HG3  MET  21           HG1      MET  21  32.682  -2.758   7.682
  453    HE1  MET  21           HE1      MET  21  31.543  -5.268   6.911
  454    HE2  MET  21           HE2      MET  21  30.403  -4.711   5.688
  455    HE3  MET  21           HE3      MET  21  30.767  -3.686   7.075
  456    H    ALA  22           HN       ALA  22  34.795   1.235   6.358
  457    HA   ALA  22           HA       ALA  22  37.397   1.117   5.267
  458    HB1  ALA  22           HB1      ALA  22  35.397   3.323   5.679
  459    HB2  ALA  22           HB2      ALA  22  35.972   2.609   4.171
  460    HB3  ALA  22           HB3      ALA  22  37.020   3.686   5.092
  461    H    TRP  23           HN       TRP  23  36.084   2.472   8.247
  462    HA   TRP  23           HA       TRP  23  38.354   3.907   9.083
  463    HB2  TRP  23           HB2      TRP  23  36.178   2.529  10.666
  464    HB3  TRP  23           HB1      TRP  23  37.399   3.578  11.387
  465    HD1  TRP  23           HD1      TRP  23  36.735   4.942   8.093
  466    HE1  TRP  23           HE1      TRP  23  35.062   6.898   8.197
  467    HE3  TRP  23           HE3      TRP  23  34.913   4.295  12.821
  468    HZ2  TRP  23           HZ2      TRP  23  33.202   8.040  10.040
  469    HZ3  TRP  23           HZ3      TRP  23  33.193   5.834  13.725
  470    HH2  TRP  23           HH2      TRP  23  32.336   7.704  12.341
  471    H    THR  24           HN       THR  24  37.398   0.538   9.759
  472    HA   THR  24           HA       THR  24  39.532  -0.121  11.439
  473    HB   THR  24           HB       THR  24  39.060  -2.462  10.829
  474    HG1  THR  24           HG1      THR  24  37.673  -2.889   9.141
  475   HG21  THR  24          HG21      THR  24  36.317  -1.960  10.839
  476   HG22  THR  24          HG22      THR  24  36.989  -0.538  11.640
  477   HG23  THR  24          HG23      THR  24  37.334  -2.154  12.261
  478    H    ILE  25           HN       ILE  25  39.268  -0.218   7.894
  479    HA   ILE  25           HA       ILE  25  41.841  -1.375   7.466
  480    HB   ILE  25           HB       ILE  25  40.084   0.317   5.677
  481   HG12  ILE  25          HG12      ILE  25  40.682  -2.657   5.675
  482   HG13  ILE  25          HG11      ILE  25  39.257  -1.940   6.429
  483   HG21  ILE  25          HG21      ILE  25  41.535  -0.563   3.841
  484   HG22  ILE  25          HG22      ILE  25  42.618  -1.237   5.058
  485   HG23  ILE  25          HG23      ILE  25  42.408   0.510   4.935
  486   HD11  ILE  25          HD11      ILE  25  38.734  -0.881   4.182
  487   HD12  ILE  25          HD12      ILE  25  38.587  -2.637   4.234
  488   HD13  ILE  25          HD13      ILE  25  40.006  -1.892   3.499
  489    H    GLY  26           HN       GLY  26  40.667   1.932   7.667
  490    HA2  GLY  26           HA2      GLY  26  42.982   3.302   6.880
  491    HA3  GLY  26           HA1      GLY  26  41.770   3.945   7.987
  492    H    HIS  27           HN       HIS  27  41.957   2.282  10.133
  493    HA   HIS  27           HA       HIS  27  44.282   3.247  11.457
  494    HB2  HIS  27           HB2      HIS  27  42.060   2.709  12.540
  495    HB3  HIS  27           HB1      HIS  27  42.489   1.003  12.395
  496    HD2  HIS  27           HD2      HIS  27  43.715   0.163  14.716
  497    HE1  HIS  27           HE1      HIS  27  45.563   3.804  15.789
  498    HE2  HIS  27           HE2      HIS  27  45.217   1.382  16.470
  499    H    LEU  28           HN       LEU  28  43.421   0.185   9.957
  500    HA   LEU  28           HA       LEU  28  45.698  -1.258  10.927
  501    HB2  LEU  28           HB2      LEU  28  43.712  -1.773   8.715
  502    HB3  LEU  28           HB1      LEU  28  45.039  -2.875   9.081
  503    HG   LEU  28           HG       LEU  28  43.112  -1.936  11.210
  504   HD11  LEU  28          HD11      LEU  28  41.798  -3.924  10.846
  505   HD12  LEU  28          HD12      LEU  28  42.927  -4.514   9.628
  506   HD13  LEU  28          HD13      LEU  28  41.929  -3.098   9.294
  507   HD21  LEU  28          HD21      LEU  28  43.893  -4.134  12.221
  508   HD22  LEU  28          HD22      LEU  28  45.147  -2.904  12.075
  509   HD23  LEU  28          HD23      LEU  28  45.074  -4.231  10.916
  510    H    ASN  29           HN       ASN  29  45.324   1.153   8.579
  511    HA   ASN  29           HA       ASN  29  46.825   2.105   7.126
  512    HB2  ASN  29           HB2      ASN  29  48.445   1.022   8.994
  513    HB3  ASN  29           HB1      ASN  29  48.943   0.083   7.589
  514   HD21  ASN  29          HD21      ASN  29  50.949   1.105   7.159
  515   HD22  ASN  29          HD22      ASN  29  51.091   2.750   6.765
  516    H    GLN  30           HN       GLN  30  48.418   1.318   5.239
  517    HA   GLN  30           HA       GLN  30  46.765  -0.284   3.516
  518    HB2  GLN  30           HB2      GLN  30  49.543   0.823   3.049
  519    HB3  GLN  30           HB1      GLN  30  48.451   0.195   1.815
  520    HG2  GLN  30           HG2      GLN  30  47.456   2.203   1.654
  521    HG3  GLN  30           HG1      GLN  30  47.029   2.137   3.362
  522   HE21  GLN  30          HE21      GLN  30  49.839   2.928   1.242
  523   HE22  GLN  30          HE22      GLN  30  50.449   4.138   2.263
  524    H    ILE  31           HN       ILE  31  47.797  -2.048   2.170
  525    HA   ILE  31           HA       ILE  31  49.280  -3.856   3.973
  526    HB   ILE  31           HB       ILE  31  47.662  -4.613   1.537
  527   HG12  ILE  31          HG12      ILE  31  46.159  -3.542   3.124
  528   HG13  ILE  31          HG11      ILE  31  45.906  -5.283   3.194
  529   HG21  ILE  31          HG21      ILE  31  47.688  -6.840   2.644
  530   HG22  ILE  31          HG22      ILE  31  48.725  -6.178   3.907
  531   HG23  ILE  31          HG23      ILE  31  49.310  -6.273   2.246
  532   HD11  ILE  31          HD11      ILE  31  45.985  -4.466   5.461
  533   HD12  ILE  31          HD12      ILE  31  47.477  -3.584   5.151
  534   HD13  ILE  31          HD13      ILE  31  47.484  -5.347   5.171
  535    H    LYS  32           HN       LYS  32  51.272  -4.480   3.439
  536    HA   LYS  32           HA       LYS  32  52.705  -3.315   1.325
  537    HB2  LYS  32           HB2      LYS  32  53.283  -5.796   2.961
  538    HB3  LYS  32           HB1      LYS  32  54.438  -5.041   1.865
  539    HG2  LYS  32           HG2      LYS  32  54.377  -2.973   3.141
  540    HG3  LYS  32           HG1      LYS  32  53.099  -3.608   4.177
  541    HD2  LYS  32           HD2      LYS  32  55.108  -3.898   5.423
  542    HD3  LYS  32           HD1      LYS  32  54.734  -5.494   4.772
  543    HE2  LYS  32           HE2      LYS  32  57.099  -5.039   4.422
  544    HE3  LYS  32           HE1      LYS  32  56.280  -5.022   2.860
  545    HZ1  LYS  32           HZ1      LYS  32  56.502  -2.507   4.344
  546    HZ2  LYS  32           HZ2      LYS  32  56.483  -2.777   2.666
  547    HZ3  LYS  32           HZ3      LYS  32  57.888  -3.099   3.566
  548    H    ARG  33           HN       ARG  33  53.149  -3.936  -0.723
  549    HA   ARG  33           HA       ARG  33  52.895  -5.016  -2.733
  550    HB2  ARG  33           HB2      ARG  33  54.032  -6.798  -1.093
  551    HB3  ARG  33           HB1      ARG  33  52.515  -7.646  -1.397
  552    HG2  ARG  33           HG2      ARG  33  52.878  -7.423  -3.830
  553    HG3  ARG  33           HG1      ARG  33  54.406  -6.596  -3.523
  554    HD2  ARG  33           HD2      ARG  33  54.937  -8.899  -3.956
  555    HD3  ARG  33           HD1      ARG  33  55.133  -8.644  -2.223
  556    HE   ARG  33           HE       ARG  33  53.370 -10.100  -1.863
  557   HH11  ARG  33          HH11      ARG  33  53.365  -9.019  -5.179
  558   HH12  ARG  33          HH12      ARG  33  52.116 -10.115  -5.657
  559   HH21  ARG  33          HH21      ARG  33  51.745 -11.524  -2.520
  560   HH22  ARG  33          HH22      ARG  33  51.204 -11.525  -4.166
  561    H1   MET   1           HT1      MET   1   1.559  -3.773  20.726
  562    H2   MET   1           HT2      MET   1   3.238  -3.775  20.992
  563    H3   MET   1           HT3      MET   1   2.619  -4.156  19.457
  564    HA   MET   1           HA       MET   1   2.159  -2.006  18.922
  565    HB2  MET   1           HB2      MET   1   0.863  -1.894  21.227
  566    HB3  MET   1           HB1      MET   1   2.308  -1.034  21.756
  567    HG2  MET   1           HG2      MET   1   0.861   0.667  20.947
  568    HG3  MET   1           HG1      MET   1   2.018   0.405  19.641
  569    HE1  MET   1           HE1      MET   1  -0.385   1.924  19.155
  570    HE2  MET   1           HE2      MET   1  -1.300   1.220  17.823
  571    HE3  MET   1           HE3      MET   1   0.448   1.392  17.688
  572    H    PHE   2           HN       PHE   2   4.395  -2.632  18.249
  573    HA   PHE   2           HA       PHE   2   6.456  -1.215  19.822
  574    HB2  PHE   2           HB2      PHE   2   6.688  -3.477  17.826
  575    HB3  PHE   2           HB1      PHE   2   8.073  -2.614  18.496
  576    HD1  PHE   2           HD1      PHE   2   5.457  -5.075  19.139
  577    HD2  PHE   2           HD2      PHE   2   8.523  -2.669  20.947
  578    HE1  PHE   2           HE1      PHE   2   5.365  -6.487  21.176
  579    HE2  PHE   2           HE2      PHE   2   8.432  -4.083  22.983
  580    HZ   PHE   2           HZ       PHE   2   6.854  -5.992  23.098
  581    H    GLU   3           HN       GLU   3   7.550   0.464  18.926
  582    HA   GLU   3           HA       GLU   3   6.706   1.263  16.243
  583    HB2  GLU   3           HB2      GLU   3   8.007   2.852  18.440
  584    HB3  GLU   3           HB1      GLU   3   7.600   3.495  16.848
  585    HG2  GLU   3           HG2      GLU   3   5.242   2.925  17.199
  586    HG3  GLU   3           HG1      GLU   3   5.628   2.241  18.778
  587    HA   PRO   4           HA       PRO   4  10.796  -0.210  14.945
  588    HB2  PRO   4           HB2      PRO   4  10.620   0.693  12.336
  589    HB3  PRO   4           HB1      PRO   4   9.952  -0.845  12.916
  590    HG2  PRO   4           HG2      PRO   4   8.580   1.755  12.450
  591    HG3  PRO   4           HG1      PRO   4   8.028   0.105  12.106
  592    HD2  PRO   4           HD2      PRO   4   7.140   1.479  14.256
  593    HD3  PRO   4           HD1      PRO   4   7.377  -0.284  14.310
  594    H    PHE   5           HN       PHE   5   9.570   3.038  14.591
  595    HA   PHE   5           HA       PHE   5  11.934   4.331  13.766
  596    HB2  PHE   5           HB2      PHE   5   9.962   5.589  13.581
  597    HB3  PHE   5           HB1      PHE   5   9.480   5.249  15.245
  598    HD1  PHE   5           HD1      PHE   5  11.947   7.079  13.142
  599    HD2  PHE   5           HD2      PHE   5  10.265   6.573  17.062
  600    HE1  PHE   5           HE1      PHE   5  13.109   9.125  13.911
  601    HE2  PHE   5           HE2      PHE   5  11.433   8.621  17.828
  602    HZ   PHE   5           HZ       PHE   5  12.858   9.901  16.254
  603    H    GLN   6           HN       GLN   6  10.712   3.464  16.972
  604    HA   GLN   6           HA       GLN   6  12.562   4.957  18.506
  605    HB2  GLN   6           HB2      GLN   6  11.007   2.436  19.077
  606    HB3  GLN   6           HB1      GLN   6  11.997   3.252  20.289
  607    HG2  GLN   6           HG2      GLN   6  10.687   5.269  20.099
  608    HG3  GLN   6           HG1      GLN   6   9.802   4.622  18.717
  609   HE21  GLN   6          HE21      GLN   6   8.930   5.425  21.591
  610   HE22  GLN   6          HE22      GLN   6   8.045   4.075  22.121
  611    H    ILE   7           HN       ILE   7  12.652   1.688  17.236
  612    HA   ILE   7           HA       ILE   7  15.022   0.878  18.558
  613    HB   ILE   7           HB       ILE   7  14.831  -1.117  17.442
  614   HG12  ILE   7          HG12      ILE   7  14.163   0.510  14.986
  615   HG13  ILE   7          HG11      ILE   7  15.606  -0.444  15.284
  616   HG21  ILE   7          HG21      ILE   7  12.495  -0.318  18.198
  617   HG22  ILE   7          HG22      ILE   7  12.568  -1.679  17.077
  618   HG23  ILE   7          HG23      ILE   7  12.172  -0.066  16.485
  619   HD11  ILE   7          HD11      ILE   7  13.989  -2.461  15.430
  620   HD12  ILE   7          HD12      ILE   7  14.318  -1.791  13.833
  621   HD13  ILE   7          HD13      ILE   7  12.810  -1.398  14.662
  622    H    LEU   8           HN       LEU   8  14.413   2.470  15.479
  623    HA   LEU   8           HA       LEU   8  17.130   2.350  14.593
  624    HB2  LEU   8           HB2      LEU   8  15.259   2.592  13.021
  625    HB3  LEU   8           HB1      LEU   8  14.865   4.160  13.723
  626    HG   LEU   8           HG       LEU   8  17.116   4.993  13.083
  627   HD11  LEU   8          HD11      LEU   8  18.359   3.520  11.380
  628   HD12  LEU   8          HD12      LEU   8  17.361   2.191  11.972
  629   HD13  LEU   8          HD13      LEU   8  18.457   3.028  13.071
  630   HD21  LEU   8          HD21      LEU   8  16.707   5.003  10.616
  631   HD22  LEU   8          HD22      LEU   8  15.254   5.361  11.548
  632   HD23  LEU   8          HD23      LEU   8  15.479   3.759  10.844
  633    H    SER   9           HN       SER   9  15.250   4.580  16.478
  634    HA   SER   9           HA       SER   9  17.112   6.761  16.350
  635    HB2  SER   9           HB2      SER   9  14.724   7.082  16.916
  636    HB3  SER   9           HB1      SER   9  14.971   6.180  18.406
  637    HG   SER   9           HG       SER   9  15.218   8.676  18.228
  638    H    ILE  10           HN       ILE  10  16.431   4.180  18.706
  639    HA   ILE  10           HA       ILE  10  18.302   4.976  20.653
  640    HB   ILE  10           HB       ILE  10  17.249   2.223  19.950
  641   HG12  ILE  10          HG12      ILE  10  15.678   4.119  20.751
  642   HG13  ILE  10          HG11      ILE  10  15.614   2.592  21.623
  643   HG21  ILE  10          HG21      ILE  10  18.972   3.211  22.231
  644   HG22  ILE  10          HG22      ILE  10  19.237   1.822  21.176
  645   HG23  ILE  10          HG23      ILE  10  17.960   1.774  22.391
  646   HD11  ILE  10          HD11      ILE  10  16.808   3.457  23.462
  647   HD12  ILE  10          HD12      ILE  10  15.734   4.778  23.007
  648   HD13  ILE  10          HD13      ILE  10  17.431   4.823  22.536
  649    H    CYS  11           HN       CYS  11  18.610   2.659  17.944
  650    HA   CYS  11           HA       CYS  11  21.301   1.978  18.461
  651    HB2  CYS  11           HB2      CYS  11  19.879   0.655  16.981
  652    HB3  CYS  11           HB1      CYS  11  19.787   2.001  15.842
  653    HG   CYS  11           HG       CYS  11  21.773   0.170  15.322
  654    H    SER  12           HN       SER  12  19.937   4.341  16.136
  655    HA   SER  12           HA       SER  12  22.326   5.278  15.094
  656    HB2  SER  12           HB2      SER  12  20.068   5.865  14.244
  657    HB3  SER  12           HB1      SER  12  19.829   6.896  15.653
  658    HG   SER  12           HG       SER  12  21.712   7.152  13.554
  659    H    PHE  13           HN       PHE  13  20.557   6.413  17.964
  660    HA   PHE  13           HA       PHE  13  22.243   8.552  18.632
  661    HB2  PHE  13           HB2      PHE  13  20.210   6.913  20.009
  662    HB3  PHE  13           HB1      PHE  13  21.390   7.690  21.064
  663    HD1  PHE  13           HD1      PHE  13  18.330   8.145  19.353
  664    HD2  PHE  13           HD2      PHE  13  21.929  10.213  20.456
  665    HE1  PHE  13           HE1      PHE  13  17.164  10.318  19.082
  666    HE2  PHE  13           HE2      PHE  13  20.765  12.384  20.187
  667    HZ   PHE  13           HZ       PHE  13  18.383  12.438  19.500
  668    H    ILE  14           HN       ILE  14  22.359   5.127  19.575
  669    HA   ILE  14           HA       ILE  14  24.541   5.294  21.341
  670    HB   ILE  14           HB       ILE  14  23.548   3.038  19.587
  671   HG12  ILE  14          HG12      ILE  14  23.403   3.352  22.590
  672   HG13  ILE  14          HG11      ILE  14  22.150   3.986  21.525
  673   HG21  ILE  14          HG21      ILE  14  24.931   1.586  21.104
  674   HG22  ILE  14          HG22      ILE  14  25.689   3.049  21.734
  675   HG23  ILE  14          HG23      ILE  14  25.892   2.611  20.037
  676   HD11  ILE  14          HD11      ILE  14  23.054   1.094  21.689
  677   HD12  ILE  14          HD12      ILE  14  21.841   1.715  20.568
  678   HD13  ILE  14          HD13      ILE  14  21.533   1.741  22.303
  679    H    LEU  15           HN       LEU  15  24.398   4.773  17.833
  680    HA   LEU  15           HA       LEU  15  27.157   4.329  17.441
  681    HB2  LEU  15           HB2      LEU  15  24.847   5.078  15.732
  682    HB3  LEU  15           HB1      LEU  15  26.454   5.432  15.095
  683    HG   LEU  15           HG       LEU  15  26.329   2.786  16.319
  684   HD11  LEU  15          HD11      LEU  15  24.917   1.765  14.571
  685   HD12  LEU  15          HD12      LEU  15  24.533   3.369  13.945
  686   HD13  LEU  15          HD13      LEU  15  23.988   2.896  15.555
  687   HD21  LEU  15          HD21      LEU  15  27.367   2.173  14.174
  688   HD22  LEU  15          HD22      LEU  15  28.119   3.633  14.816
  689   HD23  LEU  15          HD23      LEU  15  26.945   3.749  13.506
  690    H    SER  16           HN       SER  16  25.288   7.324  16.855
  691    HA   SER  16           HA       SER  16  27.334   9.037  16.239
  692    HB2  SER  16           HB2      SER  16  24.909   9.628  17.952
  693    HB3  SER  16           HB1      SER  16  25.927  10.850  17.196
  694    HG   SER  16           HG       SER  16  24.450  10.540  15.674
  695    H    ALA  17           HN       ALA  17  26.307   8.006  19.466
  696    HA   ALA  17           HA       ALA  17  28.008   9.720  20.945
  697    HB1  ALA  17           HB1      ALA  17  26.994   6.964  21.683
  698    HB2  ALA  17           HB2      ALA  17  26.098   8.466  21.918
  699    HB3  ALA  17           HB3      ALA  17  27.599   8.186  22.801
  700    H    LEU  18           HN       LEU  18  28.435   6.394  19.721
  701    HA   LEU  18           HA       LEU  18  31.043   6.075  20.819
  702    HB2  LEU  18           HB2      LEU  18  29.607   4.611  18.601
  703    HB3  LEU  18           HB1      LEU  18  31.156   4.113  19.278
  704    HG   LEU  18           HG       LEU  18  28.654   4.510  20.942
  705   HD11  LEU  18          HD11      LEU  18  28.291   2.677  19.363
  706   HD12  LEU  18          HD12      LEU  18  28.549   2.023  20.980
  707   HD13  LEU  18          HD13      LEU  18  29.850   1.970  19.791
  708   HD21  LEU  18          HD21      LEU  18  30.603   4.678  22.313
  709   HD22  LEU  18          HD22      LEU  18  31.410   3.363  21.458
  710   HD23  LEU  18          HD23      LEU  18  30.039   3.019  22.512
  711    H    HIS  19           HN       HIS  19  29.811   7.587  17.959
  712    HA   HIS  19           HA       HIS  19  32.140   7.450  16.334
  713    HB2  HIS  19           HB2      HIS  19  29.689   9.184  16.373
  714    HB3  HIS  19           HB1      HIS  19  31.021   9.546  15.280
  715    HD2  HIS  19           HD2      HIS  19  27.903   7.421  15.240
  716    HE1  HIS  19           HE1      HIS  19  30.540   5.556  12.523
  717    HE2  HIS  19           HE2      HIS  19  28.136   5.652  13.334
  718    H    PHE  20           HN       PHE  20  30.822  10.058  18.405
  719    HA   PHE  20           HA       PHE  20  33.132  11.707  18.040
  720    HB2  PHE  20           HB2      PHE  20  30.633  11.831  19.581
  721    HB3  PHE  20           HB1      PHE  20  32.010  12.601  20.373
  722    HD1  PHE  20           HD1      PHE  20  29.557  12.873  17.727
  723    HD2  PHE  20           HD2      PHE  20  33.390  14.295  19.051
  724    HE1  PHE  20           HE1      PHE  20  29.365  14.820  16.198
  725    HE2  PHE  20           HE2      PHE  20  33.197  16.240  17.522
  726    HZ   PHE  20           HZ       PHE  20  31.184  16.503  16.099
  727    H    MET  21           HN       MET  21  32.294   9.101  20.184
  728    HA   MET  21           HA       MET  21  34.139   9.602  22.273
  729    HB2  MET  21           HB2      MET  21  32.630   7.274  21.239
  730    HB3  MET  21           HB1      MET  21  34.035   6.917  22.238
  731    HG2  MET  21           HG2      MET  21  33.145   8.460  23.981
  732    HG3  MET  21           HG1      MET  21  31.709   8.716  22.991
  733    HE1  MET  21           HE1      MET  21  30.391   7.861  25.384
  734    HE2  MET  21           HE2      MET  21  29.492   6.485  24.751
  735    HE3  MET  21           HE3      MET  21  29.791   7.881  23.718
  736    H    ALA  22           HN       ALA  22  34.426   7.593  19.332
  737    HA   ALA  22           HA       ALA  22  37.120   6.865  19.775
  738    HB1  ALA  22           HB1      ALA  22  35.353   6.953  17.345
  739    HB2  ALA  22           HB2      ALA  22  36.034   5.553  18.176
  740    HB3  ALA  22           HB3      ALA  22  37.071   6.582  17.187
  741    H    TRP  23           HN       TRP  23  35.597   9.611  18.172
  742    HA   TRP  23           HA       TRP  23  37.891  10.709  16.965
  743    HB2  TRP  23           HB2      TRP  23  35.379  12.013  18.023
  744    HB3  TRP  23           HB1      TRP  23  36.607  12.869  17.091
  745    HD1  TRP  23           HD1      TRP  23  36.549   9.484  15.791
  746    HE1  TRP  23           HE1      TRP  23  35.117   9.319  13.654
  747    HE3  TRP  23           HE3      TRP  23  34.062  13.935  16.052
  748    HZ2  TRP  23           HZ2      TRP  23  33.176  10.872  12.241
  749    HZ3  TRP  23           HZ3      TRP  23  32.431  14.574  14.305
  750    HH2  TRP  23           HH2      TRP  23  31.986  13.044  12.395
  751    H    THR  24           HN       THR  24  36.476  11.304  20.182
  752    HA   THR  24           HA       THR  24  38.266  13.295  21.005
  753    HB   THR  24           HB       THR  24  37.610  12.681  23.300
  754    HG1  THR  24           HG1      THR  24  36.416  10.833  23.633
  755   HG21  THR  24          HG21      THR  24  34.967  12.318  22.492
  756   HG22  THR  24          HG22      THR  24  35.690  13.166  21.126
  757   HG23  THR  24          HG23      THR  24  35.762  13.867  22.744
  758    H    ILE  25           HN       ILE  25  38.467   9.745  21.209
  759    HA   ILE  25           HA       ILE  25  40.916   9.701  22.672
  760    HB   ILE  25           HB       ILE  25  39.619   7.655  20.861
  761   HG12  ILE  25          HG12      ILE  25  39.857   7.800  23.880
  762   HG13  ILE  25          HG11      ILE  25  38.440   8.341  22.978
  763   HG21  ILE  25          HG21      ILE  25  41.182   6.049  21.969
  764   HG22  ILE  25          HG22      ILE  25  42.010   7.414  22.715
  765   HG23  ILE  25          HG23      ILE  25  42.025   7.225  20.962
  766   HD11  ILE  25          HD11      ILE  25  38.344   6.017  21.954
  767   HD12  ILE  25          HD12      ILE  25  37.984   6.093  23.679
  768   HD13  ILE  25          HD13      ILE  25  39.565   5.537  23.131
  769    H    GLY  26           HN       GLY  26  40.119   9.658  19.259
  770    HA2  GLY  26           HA2      GLY  26  42.659   9.163  18.177
  771    HA3  GLY  26           HA1      GLY  26  41.395  10.080  17.361
  772    H    HIS  27           HN       HIS  27  41.110  12.270  18.958
  773    HA   HIS  27           HA       HIS  27  43.339  13.873  18.203
  774    HB2  HIS  27           HB2      HIS  27  40.946  14.661  18.439
  775    HB3  HIS  27           HB1      HIS  27  41.185  14.615  20.188
  776    HD2  HIS  27           HD2      HIS  27  41.992  17.098  21.072
  777    HE1  HIS  27           HE1      HIS  27  44.102  18.322  17.626
  778    HE2  HIS  27           HE2      HIS  27  43.385  19.008  19.964
  779    H    LEU  28           HN       LEU  28  42.334  12.329  21.194
  780    HA   LEU  28           HA       LEU  28  44.269  13.643  22.855
  781    HB2  LEU  28           HB2      LEU  28  42.544  11.196  23.226
  782    HB3  LEU  28           HB1      LEU  28  43.673  11.763  24.458
  783    HG   LEU  28           HG       LEU  28  41.608  13.592  23.226
  784   HD11  LEU  28          HD11      LEU  28  40.128  13.102  25.064
  785   HD12  LEU  28          HD12      LEU  28  41.329  12.054  25.823
  786   HD13  LEU  28          HD13      LEU  28  40.556  11.562  24.316
  787   HD21  LEU  28          HD21      LEU  28  41.986  14.748  25.458
  788   HD22  LEU  28          HD22      LEU  28  43.384  14.744  24.385
  789   HD23  LEU  28          HD23      LEU  28  43.309  13.615  25.737
  790    H    ASN  29           HN       ASN  29  44.494  11.209  20.512
  791    HA   ASN  29           HA       ASN  29  46.273   9.953  19.793
  792    HB2  ASN  29           HB2      ASN  29  47.494  12.043  20.983
  793    HB3  ASN  29           HB1      ASN  29  48.057  10.739  22.025
  794   HD21  ASN  29          HD21      ASN  29  50.209  10.558  21.254
  795   HD22  ASN  29          HD22      ASN  29  50.594  10.153  19.653
  796    H    GLN  30           HN       GLN  30  47.996   8.316  20.830
  797    HA   GLN  30           HA       GLN  30  46.404   6.424  22.301
  798    HB2  GLN  30           HB2      GLN  30  49.331   6.308  21.534
  799    HB3  GLN  30           HB1      GLN  30  48.342   4.952  22.081
  800    HG2  GLN  30           HG2      GLN  30  47.621   4.613  19.981
  801    HG3  GLN  30           HG1      GLN  30  46.969   6.250  19.931
  802   HE21  GLN  30          HE21      GLN  30  50.107   4.510  19.551
  803   HE22  GLN  30          HE22      GLN  30  50.717   5.576  18.378
  804    H    ILE  31           HN       ILE  31  47.390   5.269  24.220
  805    HA   ILE  31           HA       ILE  31  48.402   7.297  26.113
  806    HB   ILE  31           HB       ILE  31  47.036   4.685  26.775
  807   HG12  ILE  31          HG12      ILE  31  45.475   6.029  25.479
  808   HG13  ILE  31          HG11      ILE  31  45.013   6.106  27.177
  809   HG21  ILE  31          HG21      ILE  31  46.654   5.837  28.947
  810   HG22  ILE  31          HG22      ILE  31  47.588   7.212  28.358
  811   HG23  ILE  31          HG23      ILE  31  48.370   5.648  28.584
  812   HD11  ILE  31          HD11      ILE  31  44.892   8.346  26.284
  813   HD12  ILE  31          HD12      ILE  31  46.506   8.217  25.593
  814   HD13  ILE  31          HD13      ILE  31  46.299   8.278  27.343
  815    H    LYS  32           HN       LYS  32  50.359   7.051  26.978
  816    HA   LYS  32           HA       LYS  32  52.183   5.121  26.068
  817    HB2  LYS  32           HB2      LYS  32  52.243   6.879  28.532
  818    HB3  LYS  32           HB1      LYS  32  53.614   5.930  27.957
  819    HG2  LYS  32           HG2      LYS  32  53.631   7.138  25.846
  820    HG3  LYS  32           HG1      LYS  32  52.163   8.007  26.293
  821    HD2  LYS  32           HD2      LYS  32  53.945   9.517  26.759
  822    HD3  LYS  32           HD1      LYS  32  53.475   8.859  28.328
  823    HE2  LYS  32           HE2      LYS  32  55.902   8.817  28.158
  824    HE3  LYS  32           HE1      LYS  32  55.302   7.161  28.107
  825    HZ1  LYS  32           HZ1      LYS  32  55.623   8.605  25.580
  826    HZ2  LYS  32           HZ2      LYS  32  55.790   6.947  25.907
  827    HZ3  LYS  32           HZ3      LYS  32  57.018   8.031  26.354
  828    H    ARG  33           HN       ARG  33  52.815   3.169  26.814
  829    HA   ARG  33           HA       ARG  33  52.700   1.167  27.935
  830    HB2  ARG  33           HB2      ARG  33  53.396   2.987  29.771
  831    HB3  ARG  33           HB1      ARG  33  51.843   2.503  30.452
  832    HG2  ARG  33           HG2      ARG  33  52.543   0.134  30.366
  833    HG3  ARG  33           HG1      ARG  33  54.105   0.624  29.707
  834    HD2  ARG  33           HD2      ARG  33  54.412   0.321  32.070
  835    HD3  ARG  33           HD1      ARG  33  54.409   2.058  31.772
  836    HE   ARG  33           HE       ARG  33  52.454   2.211  33.003
  837   HH11  ARG  33          HH11      ARG  33  53.010  -1.100  32.059
  838   HH12  ARG  33          HH12      ARG  33  51.715  -1.716  33.024
  839   HH21  ARG  33          HH21      ARG  33  50.773   1.376  34.259
  840   HH22  ARG  33          HH22      ARG  33  50.457  -0.328  34.262
  841    H1   MET   1           HT1      MET   1  -0.676  16.568  22.147
  842    H2   MET   1           HT2      MET   1   0.940  17.079  22.268
  843    H3   MET   1           HT3      MET   1   0.533  15.456  22.567
  844    HA   MET   1           HA       MET   1   0.294  14.937  20.376
  845    HB2  MET   1           HB2      MET   1  -1.323  17.031  20.240
  846    HB3  MET   1           HB1      MET   1   0.077  17.797  19.493
  847    HG2  MET   1           HG2      MET   1  -1.125  16.846  17.678
  848    HG3  MET   1           HG1      MET   1   0.195  15.717  17.982
  849    HE1  MET   1           HE1      MET   1  -2.014  14.941  16.294
  850    HE2  MET   1           HE2      MET   1  -2.760  13.464  16.898
  851    HE3  MET   1           HE3      MET   1  -1.005  13.593  16.835
  852    H    PHE   2           HN       PHE   2   2.562  14.577  21.127
  853    HA   PHE   2           HA       PHE   2   4.448  16.488  19.893
  854    HB2  PHE   2           HB2      PHE   2   4.836  14.465  22.111
  855    HB3  PHE   2           HB1      PHE   2   6.156  15.363  21.359
  856    HD1  PHE   2           HD1      PHE   2   3.327  15.525  23.659
  857    HD2  PHE   2           HD2      PHE   2   6.235  17.848  21.512
  858    HE1  PHE   2           HE1      PHE   2   2.848  17.474  25.116
  859    HE2  PHE   2           HE2      PHE   2   5.756  19.795  22.970
  860    HZ   PHE   2           HZ       PHE   2   4.063  19.610  24.772
  861    H    GLU   3           HN       GLU   3   5.763  15.825  18.265
  862    HA   GLU   3           HA       GLU   3   5.378  13.078  17.340
  863    HB2  GLU   3           HB2      GLU   3   6.432  15.499  15.903
  864    HB3  GLU   3           HB1      GLU   3   6.307  13.888  15.190
  865    HG2  GLU   3           HG2      GLU   3   3.894  13.868  15.611
  866    HG3  GLU   3           HG1      GLU   3   3.996  15.460  16.361
  867    HA   PRO   4           HA       PRO   4   9.519  12.337  19.042
  868    HB2  PRO   4           HB2      PRO   4   9.785   9.766  18.058
  869    HB3  PRO   4           HB1      PRO   4   8.949  10.185  19.564
  870    HG2  PRO   4           HG2      PRO   4   7.819   9.620  16.868
  871    HG3  PRO   4           HG1      PRO   4   7.225   9.139  18.468
  872    HD2  PRO   4           HD2      PRO   4   6.114  11.184  17.100
  873    HD3  PRO   4           HD1      PRO   4   6.233  11.208  18.875
  874    H    PHE   5           HN       PHE   5   8.557  11.929  15.714
  875    HA   PHE   5           HA       PHE   5  11.093  11.505  14.556
  876    HB2  PHE   5           HB2      PHE   5   9.250  11.083  13.166
  877    HB3  PHE   5           HB1      PHE   5   8.508  12.644  13.520
  878    HD1  PHE   5           HD1      PHE   5  11.365  10.995  11.796
  879    HD2  PHE   5           HD2      PHE   5   9.092  14.604  12.302
  880    HE1  PHE   5           HE1      PHE   5  12.520  11.999   9.849
  881    HE2  PHE   5           HE2      PHE   5  10.251  15.608  10.355
  882    HZ   PHE   5           HZ       PHE   5  11.967  14.306   9.125
  883    H    GLN   6           HN       GLN   6   9.350  14.471  15.406
  884    HA   GLN   6           HA       GLN   6  11.047  16.308  14.103
  885    HB2  GLN   6           HB2      GLN   6   9.273  16.551  16.531
  886    HB3  GLN   6           HB1      GLN   6  10.119  17.924  15.816
  887    HG2  GLN   6           HG2      GLN   6   8.980  17.621  13.712
  888    HG3  GLN   6           HG1      GLN   6   8.271  16.102  14.261
  889   HE21  GLN   6          HE21      GLN   6   7.033  18.845  13.482
  890   HE22  GLN   6          HE22      GLN   6   5.999  19.190  14.784
  891    H    ILE   7           HN       ILE   7  11.123  14.946  17.333
  892    HA   ILE   7           HA       ILE   7  13.216  16.570  18.334
  893    HB   ILE   7           HB       ILE   7  13.075  15.370  20.281
  894   HG12  ILE   7          HG12      ILE   7  12.879  12.902  18.548
  895   HG13  ILE   7          HG11      ILE   7  14.200  13.374  19.604
  896   HG21  ILE   7          HG21      ILE   7  10.707  15.807  19.358
  897   HG22  ILE   7          HG22      ILE   7  10.862  14.656  20.686
  898   HG23  ILE   7          HG23      ILE   7  10.655  14.076  19.034
  899   HD11  ILE   7          HD11      ILE   7  12.455  13.205  21.511
  900   HD12  ILE   7          HD12      ILE   7  13.062  11.700  20.821
  901   HD13  ILE   7          HD13      ILE   7  11.476  12.310  20.350
  902    H    LEU   8           HN       LEU   8  13.179  13.482  16.611
  903    HA   LEU   8           HA       LEU   8  15.980  13.017  16.904
  904    HB2  LEU   8           HB2      LEU   8  14.387  11.195  16.489
  905    HB3  LEU   8           HB1      LEU   8  13.990  11.891  14.918
  906    HG   LEU   8           HG       LEU   8  16.362  11.626  14.225
  907   HD11  LEU   8          HD11      LEU   8  17.747  10.067  15.728
  908   HD12  LEU   8          HD12      LEU   8  16.590  10.452  17.002
  909   HD13  LEU   8          HD13      LEU   8  17.561  11.733  16.276
  910   HD21  LEU   8          HD21      LEU   8  16.333   9.123  14.124
  911   HD22  LEU   8          HD22      LEU   8  14.796   9.852  13.670
  912   HD23  LEU   8          HD23      LEU   8  14.990   9.128  15.268
  913    H    SER   9           HN       SER   9  13.974  14.667  14.584
  914    HA   SER   9           HA       SER   9  15.971  14.910  12.544
  915    HB2  SER   9           HB2      SER   9  13.548  15.132  12.085
  916    HB3  SER   9           HB1      SER   9  13.520  16.611  13.041
  917    HG   SER   9           HG       SER   9  13.936  16.560  10.562
  918    H    ILE  10           HN       ILE  10  14.780  17.054  15.126
  919    HA   ILE  10           HA       ILE  10  16.395  19.274  14.520
  920    HB   ILE  10           HB       ILE  10  15.291  18.325  17.180
  921   HG12  ILE  10          HG12      ILE  10  13.740  18.956  15.203
  922   HG13  ILE  10          HG11      ILE  10  13.451  19.751  16.746
  923   HG21  ILE  10          HG21      ILE  10  16.714  20.867  16.368
  924   HG22  ILE  10          HG22      ILE  10  17.045  19.815  17.744
  925   HG23  ILE  10          HG23      ILE  10  15.602  20.827  17.737
  926   HD11  ILE  10          HD11      ILE  10  14.410  21.776  16.012
  927   HD12  ILE  10          HD12      ILE  10  13.498  21.217  14.612
  928   HD13  ILE  10          HD13      ILE  10  15.247  21.002  14.667
  929    H    CYS  11           HN       CYS  11  16.959  16.558  16.779
  930    HA   CYS  11           HA       CYS  11  19.496  17.435  17.652
  931    HB2  CYS  11           HB2      CYS  11  18.232  15.715  18.834
  932    HB3  CYS  11           HB1      CYS  11  18.393  14.627  17.454
  933    HG   CYS  11           HG       CYS  11  20.320  14.339  19.400
  934    H    SER  12           HN       SER  12  18.641  15.022  15.144
  935    HA   SER  12           HA       SER  12  21.210  14.380  14.333
  936    HB2  SER  12           HB2      SER  12  19.144  13.230  13.573
  937    HB3  SER  12           HB1      SER  12  18.761  14.625  12.569
  938    HG   SER  12           HG       SER  12  20.946  12.836  12.378
  939    H    PHE  13           HN       PHE  13  19.100  16.993  13.140
  940    HA   PHE  13           HA       PHE  13  20.802  17.985  11.157
  941    HB2  PHE  13           HB2      PHE  13  18.492  18.990  12.697
  942    HB3  PHE  13           HB1      PHE  13  19.547  20.234  12.027
  943    HD1  PHE  13           HD1      PHE  13  16.809  18.107  11.328
  944    HD2  PHE  13           HD2      PHE  13  20.320  19.804   9.530
  945    HE1  PHE  13           HE1      PHE  13  15.830  17.749   9.077
  946    HE2  PHE  13           HE2      PHE  13  19.344  19.446   7.281
  947    HZ   PHE  13           HZ       PHE  13  17.099  18.418   7.054
  948    H    ILE  14           HN       ILE  14  20.557  18.816  14.597
  949    HA   ILE  14           HA       ILE  14  22.468  20.877  14.632
  950    HB   ILE  14           HB       ILE  14  21.609  18.917  16.772
  951   HG12  ILE  14          HG12      ILE  14  21.043  21.878  16.529
  952   HG13  ILE  14          HG11      ILE  14  20.002  20.668  15.783
  953   HG21  ILE  14          HG21      ILE  14  22.664  20.568  18.350
  954   HG22  ILE  14          HG22      ILE  14  23.404  21.354  16.955
  955   HG23  ILE  14          HG23      ILE  14  23.833  19.692  17.359
  956   HD11  ILE  14          HD11      ILE  14  20.690  20.855  18.732
  957   HD12  ILE  14          HD12      ILE  14  19.704  19.588  18.003
  958   HD13  ILE  14          HD13      ILE  14  19.137  21.259  18.001
  959    H    LEU  15           HN       LEU  15  22.823  17.360  15.043
  960    HA   LEU  15           HA       LEU  15  25.574  17.378  15.662
  961    HB2  LEU  15           HB2      LEU  15  23.597  15.373  14.717
  962    HB3  LEU  15           HB1      LEU  15  25.299  14.993  14.455
  963    HG   LEU  15           HG       LEU  15  24.829  16.088  17.119
  964   HD11  LEU  15          HD11      LEU  15  23.629  14.114  17.993
  965   HD12  LEU  15          HD12      LEU  15  23.443  13.502  16.349
  966   HD13  LEU  15          HD13      LEU  15  22.638  14.995  16.831
  967   HD21  LEU  15          HD21      LEU  15  26.133  14.097  17.741
  968   HD22  LEU  15          HD22      LEU  15  26.870  14.894  16.350
  969   HD23  LEU  15          HD23      LEU  15  25.911  13.431  16.122
  970    H    SER  16           HN       SER  16  23.991  16.639  12.542
  971    HA   SER  16           HA       SER  16  26.206  16.385  10.949
  972    HB2  SER  16           HB2      SER  16  23.599  17.751  10.238
  973    HB3  SER  16           HB1      SER  16  24.793  17.192   9.070
  974    HG   SER  16           HG       SER  16  23.539  15.461   9.239
  975    H    ALA  17           HN       ALA  17  24.644  19.394  11.970
  976    HA   ALA  17           HA       ALA  17  26.220  21.163  10.437
  977    HB1  ALA  17           HB1      ALA  17  24.941  21.641  13.141
  978    HB2  ALA  17           HB2      ALA  17  24.116  21.799  11.590
  979    HB3  ALA  17           HB3      ALA  17  25.449  22.881  11.994
  980    H    LEU  18           HN       LEU  18  26.615  19.902  13.747
  981    HA   LEU  18           HA       LEU  18  29.017  21.343  14.269
  982    HB2  LEU  18           HB2      LEU  18  27.834  18.890  15.576
  983    HB3  LEU  18           HB1      LEU  18  29.233  19.768  16.192
  984    HG   LEU  18           HG       LEU  18  26.539  21.059  15.676
  985   HD11  LEU  18          HD11      LEU  18  26.310  19.377  17.440
  986   HD12  LEU  18          HD12      LEU  18  26.277  20.990  18.152
  987   HD13  LEU  18          HD13      LEU  18  27.738  20.008  18.259
  988   HD21  LEU  18          HD21      LEU  18  28.269  22.707  15.673
  989   HD22  LEU  18          HD22      LEU  18  29.112  21.934  17.015
  990   HD23  LEU  18          HD23      LEU  18  27.582  22.763  17.295
  991    H    HIS  19           HN       HIS  19  28.318  18.404  12.581
  992    HA   HIS  19           HA       HIS  19  30.849  17.125  12.846
  993    HB2  HIS  19           HB2      HIS  19  28.529  16.867  10.956
  994    HB3  HIS  19           HB1      HIS  19  30.026  15.996  10.652
  995    HD2  HIS  19           HD2      HIS  19  26.825  15.420  12.565
  996    HE1  HIS  19           HE1      HIS  19  29.720  13.053  14.525
  997    HE2  HIS  19           HE2      HIS  19  27.230  13.504  14.294
  998    H    PHE  20           HN       PHE  20  29.397  19.071  10.213
  999    HA   PHE  20           HA       PHE  20  31.828  19.114   8.708
 1000    HB2  PHE  20           HB2      PHE  20  29.141  20.279   8.465
 1001    HB3  PHE  20           HB1      PHE  20  30.430  21.290   7.811
 1002    HD1  PHE  20           HD1      PHE  20  28.417  18.326   7.304
 1003    HD2  PHE  20           HD2      PHE  20  32.091  20.248   6.174
 1004    HE1  PHE  20           HE1      PHE  20  28.581  16.850   5.316
 1005    HE2  PHE  20           HE2      PHE  20  32.253  18.771   4.188
 1006    HZ   PHE  20           HZ       PHE  20  30.502  17.066   3.759
 1007    H    MET  21           HN       MET  21  30.516  21.030  11.306
 1008    HA   MET  21           HA       MET  21  32.071  23.370  10.989
 1009    HB2  MET  21           HB2      MET  21  30.590  22.050  13.188
 1010    HB3  MET  21           HB1      MET  21  31.807  23.232  13.660
 1011    HG2  MET  21           HG2      MET  21  30.762  24.878  12.110
 1012    HG3  MET  21           HG1      MET  21  29.508  23.697  11.734
 1013    HE1  MET  21           HE1      MET  21  27.797  25.831  12.567
 1014    HE2  MET  21           HE2      MET  21  26.923  25.023  13.866
 1015    HE3  MET  21           HE3      MET  21  27.455  24.098  12.465
 1016    H    ALA  22           HN       ALA  22  32.665  20.430  12.932
 1017    HA   ALA  22           HA       ALA  22  35.213  21.237  13.848
 1018    HB1  ALA  22           HB1      ALA  22  33.843  18.575  13.579
 1019    HB2  ALA  22           HB2      ALA  22  34.302  19.448  15.042
 1020    HB3  ALA  22           HB3      ALA  22  35.537  18.663  14.058
 1021    H    TRP  23           HN       TRP  23  34.116  19.524  10.965
 1022    HA   TRP  23           HA       TRP  23  36.629  18.714   9.988
 1023    HB2  TRP  23           HB2      TRP  23  34.074  19.440   8.544
 1024    HB3  TRP  23           HB1      TRP  23  35.481  18.735   7.748
 1025    HD1  TRP  23           HD1      TRP  23  35.409  17.315  11.081
 1026    HE1  TRP  23           HE1      TRP  23  34.302  14.988  11.099
 1027    HE3  TRP  23           HE3      TRP  23  33.180  17.360   6.485
 1028    HZ2  TRP  23           HZ2      TRP  23  32.689  13.361   9.394
 1029    HZ3  TRP  23           HZ3      TRP  23  31.866  15.407   5.707
 1030    HH2  TRP  23           HH2      TRP  23  31.620  13.409   7.156
 1031    H    THR  24           HN       THR  24  34.782  21.701   9.366
 1032    HA   THR  24           HA       THR  24  36.556  22.860   7.546
 1033    HB   THR  24           HB       THR  24  35.529  25.008   8.175
 1034    HG1  THR  24           HG1      THR  24  34.189  25.097   9.951
 1035   HG21  THR  24          HG21      THR  24  33.017  23.806   8.349
 1036   HG22  THR  24          HG22      THR  24  33.986  22.594   7.512
 1037   HG23  THR  24          HG23      THR  24  33.858  24.230   6.861
 1038    H    ILE  25           HN       ILE  25  36.497  22.965  11.097
 1039    HA   ILE  25           HA       ILE  25  38.702  24.758  11.353
 1040    HB   ILE  25           HB       ILE  25  37.566  22.706  13.261
 1041   HG12  ILE  25          HG12      ILE  25  37.362  25.731  13.209
 1042   HG13  ILE  25          HG11      ILE  25  36.131  24.650  12.554
 1043   HG21  ILE  25          HG21      ILE  25  38.846  23.971  14.994
 1044   HG22  ILE  25          HG22      ILE  25  39.635  24.882  13.708
 1045   HG23  ILE  25          HG23      ILE  25  39.902  23.145  13.847
 1046   HD11  ILE  25          HD11      ILE  25  36.046  23.541  14.836
 1047   HD12  ILE  25          HD12      ILE  25  35.441  25.197  14.786
 1048   HD13  ILE  25          HD13      ILE  25  37.049  24.864  15.428
 1049    H    GLY  26           HN       GLY  26  38.421  21.262  11.238
 1050    HA2  GLY  26           HA2      GLY  26  41.060  20.553  11.880
 1051    HA3  GLY  26           HA1      GLY  26  39.990  19.594  10.862
 1052    H    HIS  27           HN       HIS  27  39.604  21.210   8.700
 1053    HA   HIS  27           HA       HIS  27  42.014  20.849   7.230
 1054    HB2  HIS  27           HB2      HIS  27  39.663  20.764   6.292
 1055    HB3  HIS  27           HB1      HIS  27  39.639  22.525   6.402
 1056    HD2  HIS  27           HD2      HIS  27  40.451  23.607   4.001
 1057    HE1  HIS  27           HE1      HIS  27  43.125  20.558   2.826
 1058    HE2  HIS  27           HE2      HIS  27  42.110  22.788   2.158
 1059    H    LEU  28           HN       LEU  28  40.473  23.611   8.765
 1060    HA   LEU  28           HA       LEU  28  42.225  25.580   7.646
 1061    HB2  LEU  28           HB2      LEU  28  40.318  25.600   9.984
 1062    HB3  LEU  28           HB1      LEU  28  41.283  27.006   9.528
 1063    HG   LEU  28           HG       LEU  28  39.542  25.552   7.531
 1064   HD11  LEU  28          HD11      LEU  28  37.777  27.136   7.972
 1065   HD12  LEU  28          HD12      LEU  28  38.785  28.022   9.116
 1066   HD13  LEU  28          HD13      LEU  28  38.214  26.401   9.515
 1067   HD21  LEU  28          HD21      LEU  28  39.654  27.858   6.465
 1068   HD22  LEU  28          HD22      LEU  28  41.193  26.999   6.532
 1069   HD23  LEU  28          HD23      LEU  28  40.849  28.284   7.691
 1070    H    ASN  29           HN       ASN  29  42.643  23.206  10.029
 1071    HA   ASN  29           HA       ASN  29  44.434  22.710  11.376
 1072    HB2  ASN  29           HB2      ASN  29  45.591  24.139   9.403
 1073    HB3  ASN  29           HB1      ASN  29  45.912  25.205  10.768
 1074   HD21  ASN  29          HD21      ASN  29  48.140  24.753  11.067
 1075   HD22  ASN  29          HD22      ASN  29  48.734  23.211  11.455
 1076    H    GLN  30           HN       GLN  30  45.882  23.928  13.149
 1077    HA   GLN  30           HA       GLN  30  43.976  25.078  14.972
 1078    HB2  GLN  30           HB2      GLN  30  46.971  24.745  15.259
 1079    HB3  GLN  30           HB1      GLN  30  45.832  25.092  16.560
 1080    HG2  GLN  30           HG2      GLN  30  45.410  22.898  16.795
 1081    HG3  GLN  30           HG1      GLN  30  44.876  22.812  15.118
 1082   HE21  GLN  30          HE21      GLN  30  47.923  22.835  17.051
 1083   HE22  GLN  30          HE22      GLN  30  48.764  21.803  15.996
 1084    H    ILE  31           HN       ILE  31  44.593  27.077  16.241
 1085    HA   ILE  31           HA       ILE  31  45.433  29.172  14.337
 1086    HB   ILE  31           HB       ILE  31  43.827  29.530  16.872
 1087   HG12  ILE  31          HG12      ILE  31  42.563  28.068  15.392
 1088   HG13  ILE  31          HG11      ILE  31  41.857  29.679  15.333
 1089   HG21  ILE  31          HG21      ILE  31  43.196  31.660  15.755
 1090   HG22  ILE  31          HG22      ILE  31  44.291  31.269  14.430
 1091   HG23  ILE  31          HG23      ILE  31  44.931  31.550  16.049
 1092   HD11  ILE  31          HD11      ILE  31  42.004  28.864  13.067
 1093   HD12  ILE  31          HD12      ILE  31  43.693  28.414  13.281
 1094   HD13  ILE  31          HD13      ILE  31  43.232  30.114  13.254
 1095    H    LYS  32           HN       LYS  32  47.221  30.306  14.735
 1096    HA   LYS  32           HA       LYS  32  49.038  29.602  16.754
 1097    HB2  LYS  32           HB2      LYS  32  48.839  32.111  15.073
 1098    HB3  LYS  32           HB1      LYS  32  50.220  31.711  16.094
 1099    HG2  LYS  32           HG2      LYS  32  50.624  29.670  14.834
 1100    HG3  LYS  32           HG1      LYS  32  49.162  29.927  13.882
 1101    HD2  LYS  32           HD2      LYS  32  50.942  30.705  12.506
 1102    HD3  LYS  32           HD1      LYS  32  50.204  32.162  13.172
 1103    HE2  LYS  32           HE2      LYS  32  52.623  32.349  13.368
 1104    HE3  LYS  32           HE1      LYS  32  51.937  32.152  14.980
 1105    HZ1  LYS  32           HZ1      LYS  32  52.719  29.751  13.495
 1106    HZ2  LYS  32           HZ2      LYS  32  52.732  30.042  15.169
 1107    HZ3  LYS  32           HZ3      LYS  32  53.945  30.701  14.179
 1108    H    ARG  33           HN       ARG  33  49.432  30.361  18.766
 1109    HA   ARG  33           HA       ARG  33  49.030  31.379  20.783
 1110    HB2  ARG  33           HB2      ARG  33  49.556  33.361  19.067
 1111    HB3  ARG  33           HB1      ARG  33  47.891  33.789  19.464
 1112    HG2  ARG  33           HG2      ARG  33  48.448  33.720  21.869
 1113    HG3  ARG  33           HG1      ARG  33  50.118  33.317  21.468
 1114    HD2  ARG  33           HD2      ARG  33  50.052  35.685  21.854
 1115    HD3  ARG  33           HD1      ARG  33  50.199  35.455  20.113
 1116    HE   ARG  33           HE       ARG  33  48.097  36.392  19.866
 1117   HH11  ARG  33          HH11      ARG  33  48.583  35.415  23.178
 1118   HH12  ARG  33          HH12      ARG  33  47.124  36.156  23.734
 1119   HH21  ARG  33          HH21      ARG  33  46.200  37.355  20.625
 1120   HH22  ARG  33          HH22      ARG  33  45.783  37.248  22.303
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1   9.420  17.627   0.372
    2    H2   MET   1           HT2      MET   1   8.254  17.382  -0.840
    3    H3   MET   1           HT3      MET   1   8.599  16.146   0.272
    4    HA   MET   1           HA       MET   1   7.895  17.961   2.003
    5    HB2  MET   1           HB2      MET   1   7.310  19.168  -0.503
    6    HB3  MET   1           HB1      MET   1   5.765  18.735   0.229
    7    HG2  MET   1           HG2      MET   1   6.369  19.905   2.284
    8    HG3  MET   1           HG1      MET   1   7.969  20.267   1.639
    9    HE1  MET   1           HE1      MET   1   7.066  22.469   2.683
   10    HE2  MET   1           HE2      MET   1   5.310  22.343   2.661
   11    HE3  MET   1           HE3      MET   1   6.103  23.664   1.804
   12    H    PHE   2           HN       PHE   2   5.158  17.929   2.102
   13    HA   PHE   2           HA       PHE   2   3.334  16.589   2.489
   14    HB2  PHE   2           HB2      PHE   2   4.515  15.495   0.048
   15    HB3  PHE   2           HB1      PHE   2   3.651  14.288   0.994
   16    HD1  PHE   2           HD1      PHE   2   3.373  17.301  -1.036
   17    HD2  PHE   2           HD2      PHE   2   1.259  14.638   1.585
   18    HE1  PHE   2           HE1      PHE   2   1.217  18.219  -1.843
   19    HE2  PHE   2           HE2      PHE   2  -0.900  15.555   0.781
   20    HZ   PHE   2           HZ       PHE   2  -0.921  17.345  -0.935
   21    H    GLU   3           HN       GLU   3   5.653  14.007   1.743
   22    HA   GLU   3           HA       GLU   3   5.024  12.718   4.225
   23    HB2  GLU   3           HB2      GLU   3   6.983  11.991   2.069
   24    HB3  GLU   3           HB1      GLU   3   6.561  10.957   3.433
   25    HG2  GLU   3           HG2      GLU   3   4.616  12.017   1.359
   26    HG3  GLU   3           HG1      GLU   3   5.249  10.372   1.418
   27    HA   PRO   4           HA       PRO   4   8.278  14.952   6.469
   28    HB2  PRO   4           HB2      PRO   4   7.830  12.743   8.419
   29    HB3  PRO   4           HB1      PRO   4   7.815  14.497   8.671
   30    HG2  PRO   4           HG2      PRO   4   5.565  13.088   8.641
   31    HG3  PRO   4           HG1      PRO   4   5.645  14.722   7.955
   32    HD2  PRO   4           HD2      PRO   4   5.578  12.081   6.540
   33    HD3  PRO   4           HD1      PRO   4   4.857  13.641   6.069
   34    H    PHE   5           HN       PHE   5   8.215  11.455   5.965
   35    HA   PHE   5           HA       PHE   5  10.981  11.081   6.634
   36    HB2  PHE   5           HB2      PHE   5  10.447   8.905   6.549
   37    HB3  PHE   5           HB1      PHE   5   8.786   9.415   6.245
   38    HD1  PHE   5           HD1      PHE   5  11.830   8.021   4.804
   39    HD2  PHE   5           HD2      PHE   5   7.941   9.605   3.897
   40    HE1  PHE   5           HE1      PHE   5  11.957   7.035   2.533
   41    HE2  PHE   5           HE2      PHE   5   8.070   8.618   1.623
   42    HZ   PHE   5           HZ       PHE   5  10.079   7.327   0.945
   43    H    GLN   6           HN       GLN   6   9.164  11.825   3.747
   44    HA   GLN   6           HA       GLN   6  11.128  11.137   1.826
   45    HB2  GLN   6           HB2      GLN   6   8.815  11.522   1.180
   46    HB3  GLN   6           HB1      GLN   6   8.918  13.203   1.705
   47    HG2  GLN   6           HG2      GLN   6  10.184  13.833  -0.109
   48    HG3  GLN   6           HG1      GLN   6  10.968  12.261  -0.242
   49   HE21  GLN   6          HE21      GLN   6  10.375  11.292  -2.178
   50   HE22  GLN   6          HE22      GLN   6   8.820  11.340  -2.856
   51    H    ILE   7           HN       ILE   7  10.388  14.212   3.459
   52    HA   ILE   7           HA       ILE   7  12.444  15.659   2.102
   53    HB   ILE   7           HB       ILE   7  11.942  17.458   3.588
   54   HG12  ILE   7          HG12      ILE   7  10.712  15.364   5.381
   55   HG13  ILE   7          HG11      ILE   7  12.186  16.256   5.719
   56   HG21  ILE   7          HG21      ILE   7  10.094  16.643   2.034
   57   HG22  ILE   7          HG22      ILE   7   9.559  17.616   3.402
   58   HG23  ILE   7          HG23      ILE   7   9.374  15.864   3.443
   59   HD11  ILE   7          HD11      ILE   7  10.461  17.354   6.955
   60   HD12  ILE   7          HD12      ILE   7   9.365  17.329   5.575
   61   HD13  ILE   7          HD13      ILE   7  10.784  18.377   5.556
   62    H    LEU   8           HN       LEU   8  12.316  13.802   5.107
   63    HA   LEU   8           HA       LEU   8  14.887  14.660   6.036
   64    HB2  LEU   8           HB2      LEU   8  12.742  12.916   6.914
   65    HB3  LEU   8           HB1      LEU   8  14.314  12.163   7.172
   66    HG   LEU   8           HG       LEU   8  13.585  13.533   9.120
   67   HD11  LEU   8          HD11      LEU   8  16.042  13.237   8.321
   68   HD12  LEU   8          HD12      LEU   8  15.696  14.479   9.522
   69   HD13  LEU   8          HD13      LEU   8  15.930  14.928   7.835
   70   HD21  LEU   8          HD21      LEU   8  13.248  15.870   8.973
   71   HD22  LEU   8          HD22      LEU   8  12.409  15.237   7.559
   72   HD23  LEU   8          HD23      LEU   8  14.000  15.972   7.382
   73    H    SER   9           HN       SER   9  13.736  12.082   3.967
   74    HA   SER   9           HA       SER   9  16.203  10.600   4.008
   75    HB2  SER   9           HB2      SER   9  15.186   9.307   2.199
   76    HB3  SER   9           HB1      SER   9  14.035   9.530   3.514
   77    HG   SER   9           HG       SER   9  14.052  10.562   0.938
   78    H    ILE  10           HN       ILE  10  14.700  13.018   1.905
   79    HA   ILE  10           HA       ILE  10  16.655  12.896  -0.157
   80    HB   ILE  10           HB       ILE  10  14.700  15.064   0.643
   81   HG12  ILE  10          HG12      ILE  10  14.689  13.236  -1.771
   82   HG13  ILE  10          HG11      ILE  10  13.904  12.791  -0.257
   83   HG21  ILE  10          HG21      ILE  10  15.204  15.897  -1.719
   84   HG22  ILE  10          HG22      ILE  10  16.626  14.854  -1.684
   85   HG23  ILE  10          HG23      ILE  10  16.473  16.175  -0.526
   86   HD11  ILE  10          HD11      ILE  10  12.681  15.040  -0.402
   87   HD12  ILE  10          HD12      ILE  10  12.199  13.812  -1.571
   88   HD13  ILE  10          HD13      ILE  10  13.264  15.128  -2.065
   89    H    CYS  11           HN       CYS  11  16.319  14.885   2.780
   90    HA   CYS  11           HA       CYS  11  18.509  16.601   2.224
   91    HB2  CYS  11           HB2      CYS  11  16.682  17.014   3.906
   92    HB3  CYS  11           HB1      CYS  11  17.440  15.798   4.935
   93    HG   CYS  11           HG       CYS  11  18.723  17.798   5.727
   94    H    SER  12           HN       SER  12  18.245  13.721   4.364
   95    HA   SER  12           HA       SER  12  20.946  13.672   5.109
   96    HB2  SER  12           HB2      SER  12  18.886  11.468   4.922
   97    HB3  SER  12           HB1      SER  12  20.491  11.239   5.611
   98    HG   SER  12           HG       SER  12  20.013  12.740   7.177
   99    H    PHE  13           HN       PHE  13  19.264  12.225   2.356
  100    HA   PHE  13           HA       PHE  13  21.355  10.620   1.399
  101    HB2  PHE  13           HB2      PHE  13  18.898  11.838   0.245
  102    HB3  PHE  13           HB1      PHE  13  20.118  11.257  -0.884
  103    HD1  PHE  13           HD1      PHE  13  19.312   9.913   2.500
  104    HD2  PHE  13           HD2      PHE  13  19.136   9.279  -1.744
  105    HE1  PHE  13           HE1      PHE  13  18.557   7.579   2.880
  106    HE2  PHE  13           HE2      PHE  13  18.384   6.946  -1.365
  107    HZ   PHE  13           HZ       PHE  13  18.095   6.096   0.945
  108    H    ILE  14           HN       ILE  14  20.512  14.008   0.690
  109    HA   ILE  14           HA       ILE  14  22.534  14.469  -1.218
  110    HB   ILE  14           HB       ILE  14  21.074  16.317   0.668
  111   HG12  ILE  14          HG12      ILE  14  20.896  16.092  -2.341
  112   HG13  ILE  14          HG11      ILE  14  19.915  15.087  -1.275
  113   HG21  ILE  14          HG21      ILE  14  23.138  17.433   0.218
  114   HG22  ILE  14          HG22      ILE  14  21.971  18.112  -0.916
  115   HG23  ILE  14          HG23      ILE  14  23.135  16.909  -1.466
  116   HD11  ILE  14          HD11      ILE  14  18.748  17.183  -2.000
  117   HD12  ILE  14          HD12      ILE  14  19.992  18.116  -1.167
  118   HD13  ILE  14          HD13      ILE  14  18.923  17.054  -0.250
  119    H    LEU  15           HN       LEU  15  22.494  14.893   2.315
  120    HA   LEU  15           HA       LEU  15  25.064  16.030   2.548
  121    HB2  LEU  15           HB2      LEU  15  23.193  14.606   4.387
  122    HB3  LEU  15           HB1      LEU  15  24.867  14.822   4.903
  123    HG   LEU  15           HG       LEU  15  23.265  17.128   3.799
  124   HD11  LEU  15          HD11      LEU  15  22.808  17.731   6.190
  125   HD12  LEU  15          HD12      LEU  15  23.418  16.144   6.664
  126   HD13  LEU  15          HD13      LEU  15  21.966  16.270   5.672
  127   HD21  LEU  15          HD21      LEU  15  25.631  17.530   3.933
  128   HD22  LEU  15          HD22      LEU  15  25.728  16.801   5.536
  129   HD23  LEU  15          HD23      LEU  15  24.909  18.348   5.319
  130    H    SER  16           HN       SER  16  24.072  12.652   3.163
  131    HA   SER  16           HA       SER  16  26.538  11.531   3.578
  132    HB2  SER  16           HB2      SER  16  24.233  10.301   2.047
  133    HB3  SER  16           HB1      SER  16  25.577   9.413   2.760
  134    HG   SER  16           HG       SER  16  24.354   9.408   4.472
  135    H    ALA  17           HN       ALA  17  25.005  12.283   0.480
  136    HA   ALA  17           HA       ALA  17  26.901  11.040  -1.198
  137    HB1  ALA  17           HB1      ALA  17  25.264  13.516  -1.794
  138    HB2  ALA  17           HB2      ALA  17  24.640  11.871  -1.897
  139    HB3  ALA  17           HB3      ALA  17  25.944  12.386  -2.967
  140    H    LEU  18           HN       LEU  18  26.635  14.421  -0.074
  141    HA   LEU  18           HA       LEU  18  29.013  15.303  -1.357
  142    HB2  LEU  18           HB2      LEU  18  27.078  16.397   0.589
  143    HB3  LEU  18           HB1      LEU  18  28.706  17.071   0.676
  144    HG   LEU  18           HG       LEU  18  28.585  17.393  -1.841
  145   HD11  LEU  18          HD11      LEU  18  26.804  15.888  -2.418
  146   HD12  LEU  18          HD12      LEU  18  26.204  17.519  -2.717
  147   HD13  LEU  18          HD13      LEU  18  25.707  16.649  -1.267
  148   HD21  LEU  18          HD21      LEU  18  27.057  19.397  -1.635
  149   HD22  LEU  18          HD22      LEU  18  28.298  19.302  -0.386
  150   HD23  LEU  18          HD23      LEU  18  26.640  18.833  -0.016
  151    H    HIS  19           HN       HIS  19  28.399  13.587   1.582
  152    HA   HIS  19           HA       HIS  19  30.780  14.300   2.978
  153    HB2  HIS  19           HB2      HIS  19  28.954  13.365   4.227
  154    HB3  HIS  19           HB1      HIS  19  28.917  11.931   3.204
  155    HD2  HIS  19           HD2      HIS  19  30.569   9.884   4.072
  156    HE1  HIS  19           HE1      HIS  19  32.817  12.110   6.867
  157    HE2  HIS  19           HE2      HIS  19  32.402   9.786   5.930
  158    H    PHE  20           HN       PHE  20  29.915  11.146   1.498
  159    HA   PHE  20           HA       PHE  20  32.500  10.127   1.475
  160    HB2  PHE  20           HB2      PHE  20  29.945   9.450   0.259
  161    HB3  PHE  20           HB1      PHE  20  31.301   9.056  -0.800
  162    HD1  PHE  20           HD1      PHE  20  29.902   8.544   2.614
  163    HD2  PHE  20           HD2      PHE  20  32.809   7.279  -0.286
  164    HE1  PHE  20           HE1      PHE  20  30.418   6.552   3.998
  165    HE2  PHE  20           HE2      PHE  20  33.323   5.287   1.099
  166    HZ   PHE  20           HZ       PHE  20  32.129   4.923   3.242
  167    H    MET  21           HN       MET  21  30.954  12.385  -0.710
  168    HA   MET  21           HA       MET  21  32.717  12.161  -2.893
  169    HB2  MET  21           HB2      MET  21  30.727  14.092  -1.910
  170    HB3  MET  21           HB1      MET  21  32.013  14.805  -2.888
  171    HG2  MET  21           HG2      MET  21  30.488  12.333  -3.742
  172    HG3  MET  21           HG1      MET  21  29.991  13.965  -4.191
  173    HE1  MET  21           HE1      MET  21  30.480  11.635  -5.921
  174    HE2  MET  21           HE2      MET  21  32.050  10.953  -5.501
  175    HE3  MET  21           HE3      MET  21  31.833  11.752  -7.056
  176    H    ALA  22           HN       ALA  22  32.707  14.704  -0.377
  177    HA   ALA  22           HA       ALA  22  35.249  15.724  -1.055
  178    HB1  ALA  22           HB1      ALA  22  34.203  15.905   1.741
  179    HB2  ALA  22           HB2      ALA  22  33.321  16.702   0.439
  180    HB3  ALA  22           HB3      ALA  22  34.999  17.137   0.762
  181    H    TRP  23           HN       TRP  23  34.238  13.309   1.322
  182    HA   TRP  23           HA       TRP  23  36.683  12.990   2.653
  183    HB2  TRP  23           HB2      TRP  23  34.221  11.909   2.943
  184    HB3  TRP  23           HB1      TRP  23  35.073  10.548   2.215
  185    HD1  TRP  23           HD1      TRP  23  35.177  12.870   5.258
  186    HE1  TRP  23           HE1      TRP  23  36.569  11.739   7.109
  187    HE3  TRP  23           HE3      TRP  23  36.893   8.792   2.706
  188    HZ2  TRP  23           HZ2      TRP  23  38.197   9.413   7.461
  189    HZ3  TRP  23           HZ3      TRP  23  38.360   7.136   3.824
  190    HH2  TRP  23           HH2      TRP  23  39.014   7.442   6.196
  191    H    THR  24           HN       THR  24  35.359  11.207  -0.132
  192    HA   THR  24           HA       THR  24  37.473   9.462  -0.570
  193    HB   THR  24           HB       THR  24  35.639  10.803  -2.569
  194    HG1  THR  24           HG1      THR  24  35.592   8.198  -1.466
  195   HG21  THR  24          HG21      THR  24  36.256   8.730  -3.950
  196   HG22  THR  24          HG22      THR  24  37.632   8.553  -2.862
  197   HG23  THR  24          HG23      THR  24  37.470  10.005  -3.850
  198    H    ILE  25           HN       ILE  25  36.988  12.759  -1.825
  199    HA   ILE  25           HA       ILE  25  39.375  12.864  -3.347
  200    HB   ILE  25           HB       ILE  25  37.723  15.050  -2.065
  201   HG12  ILE  25          HG12      ILE  25  37.976  14.229  -4.967
  202   HG13  ILE  25          HG11      ILE  25  36.739  13.572  -3.893
  203   HG21  ILE  25          HG21      ILE  25  40.005  15.228  -4.058
  204   HG22  ILE  25          HG22      ILE  25  40.002  15.875  -2.418
  205   HG23  ILE  25          HG23      ILE  25  38.933  16.562  -3.638
  206   HD11  ILE  25          HD11      ILE  25  35.864  15.496  -5.163
  207   HD12  ILE  25          HD12      ILE  25  37.151  16.512  -4.515
  208   HD13  ILE  25          HD13      ILE  25  35.919  15.855  -3.437
  209    H    GLY  26           HN       GLY  26  38.636  13.698  -0.010
  210    HA2  GLY  26           HA2      GLY  26  41.081  14.901   0.697
  211    HA3  GLY  26           HA1      GLY  26  39.982  14.110   1.822
  212    H    HIS  27           HN       HIS  27  40.016  11.515   1.055
  213    HA   HIS  27           HA       HIS  27  42.406  10.528   2.155
  214    HB2  HIS  27           HB2      HIS  27  40.479   9.152   2.321
  215    HB3  HIS  27           HB1      HIS  27  40.195   9.215   0.582
  216    HD2  HIS  27           HD2      HIS  27  41.221   7.018  -0.714
  217    HE1  HIS  27           HE1      HIS  27  44.142   5.931   2.131
  218    HE2  HIS  27           HE2      HIS  27  43.072   5.291  -0.081
  219    H    LEU  28           HN       LEU  28  41.331  10.884  -1.201
  220    HA   LEU  28           HA       LEU  28  43.447   9.509  -2.437
  221    HB2  LEU  28           HB2      LEU  28  41.436  10.168  -3.659
  222    HB3  LEU  28           HB1      LEU  28  41.830  11.870  -3.432
  223    HG   LEU  28           HG       LEU  28  43.933  11.537  -4.708
  224   HD11  LEU  28          HD11      LEU  28  44.421   9.230  -4.299
  225   HD12  LEU  28          HD12      LEU  28  44.075   9.358  -6.024
  226   HD13  LEU  28          HD13      LEU  28  42.854   8.720  -4.924
  227   HD21  LEU  28          HD21      LEU  28  41.855  12.243  -5.866
  228   HD22  LEU  28          HD22      LEU  28  41.457  10.551  -6.157
  229   HD23  LEU  28          HD23      LEU  28  42.881  11.263  -6.914
  230    H    ASN  29           HN       ASN  29  43.096  12.955  -1.603
  231    HA   ASN  29           HA       ASN  29  45.651  13.709  -2.612
  232    HB2  ASN  29           HB2      ASN  29  43.771  15.029  -0.649
  233    HB3  ASN  29           HB1      ASN  29  45.263  15.773  -1.220
  234   HD21  ASN  29          HD21      ASN  29  42.439  16.650  -1.746
  235   HD22  ASN  29          HD22      ASN  29  42.277  16.654  -3.435
  236    H    GLN  30           HN       GLN  30  44.468  12.683   0.548
  237    HA   GLN  30           HA       GLN  30  46.768  13.285   2.061
  238    HB2  GLN  30           HB2      GLN  30  44.541  11.281   2.402
  239    HB3  GLN  30           HB1      GLN  30  45.861  11.407   3.565
  240    HG2  GLN  30           HG2      GLN  30  45.321  13.697   4.054
  241    HG3  GLN  30           HG1      GLN  30  44.186  13.780   2.711
  242   HE21  GLN  30          HE21      GLN  30  44.528  12.923   6.058
  243   HE22  GLN  30          HE22      GLN  30  42.954  12.330   6.280
  244    H    ILE  31           HN       ILE  31  45.821  10.370   0.274
  245    HA   ILE  31           HA       ILE  31  48.629   9.472   0.432
  246    HB   ILE  31           HB       ILE  31  46.145   7.775   0.728
  247   HG12  ILE  31          HG12      ILE  31  48.514   8.108   2.585
  248   HG13  ILE  31          HG11      ILE  31  47.042   9.067   2.732
  249   HG21  ILE  31          HG21      ILE  31  49.063   7.024   0.407
  250   HG22  ILE  31          HG22      ILE  31  47.729   6.581  -0.658
  251   HG23  ILE  31          HG23      ILE  31  47.819   5.908   0.970
  252   HD11  ILE  31          HD11      ILE  31  47.040   6.040   2.700
  253   HD12  ILE  31          HD12      ILE  31  45.708   7.112   3.133
  254   HD13  ILE  31          HD13      ILE  31  47.117   6.986   4.187
  255    H    LYS  32           HN       LYS  32  49.518   9.097  -1.494
  256    HA   LYS  32           HA       LYS  32  47.768   9.048  -3.854
  257    HB2  LYS  32           HB2      LYS  32  49.874   9.475  -5.112
  258    HB3  LYS  32           HB1      LYS  32  49.531  10.717  -3.909
  259    HG2  LYS  32           HG2      LYS  32  51.241  10.021  -2.500
  260    HG3  LYS  32           HG1      LYS  32  51.219   8.369  -3.116
  261    HD2  LYS  32           HD2      LYS  32  52.256   9.067  -5.194
  262    HD3  LYS  32           HD1      LYS  32  52.145  10.763  -4.724
  263    HE2  LYS  32           HE2      LYS  32  53.679  10.398  -2.871
  264    HE3  LYS  32           HE1      LYS  32  53.716   8.666  -3.200
  265    HZ1  LYS  32           HZ1      LYS  32  54.610   9.200  -5.421
  266    HZ2  LYS  32           HZ2      LYS  32  55.639   9.678  -4.156
  267    HZ3  LYS  32           HZ3      LYS  32  54.699  10.834  -4.971
  268    H    ARG  33           HN       ARG  33  49.173   7.766  -5.714
  269    HA   ARG  33           HA       ARG  33  49.351   5.007  -4.668
  270    HB2  ARG  33           HB2      ARG  33  49.126   5.451  -7.584
  271    HB3  ARG  33           HB1      ARG  33  48.313   4.271  -6.553
  272    HG2  ARG  33           HG2      ARG  33  46.966   6.222  -5.610
  273    HG3  ARG  33           HG1      ARG  33  47.616   7.188  -6.935
  274    HD2  ARG  33           HD2      ARG  33  45.546   6.363  -7.752
  275    HD3  ARG  33           HD1      ARG  33  46.767   5.335  -8.493
  276    HE   ARG  33           HE       ARG  33  45.938   4.157  -6.066
  277   HH11  ARG  33          HH11      ARG  33  44.751   4.886  -9.258
  278   HH12  ARG  33          HH12      ARG  33  43.647   3.558  -9.283
  279   HH21  ARG  33          HH21      ARG  33  44.485   2.425  -6.124
  280   HH22  ARG  33          HH22      ARG  33  43.496   2.171  -7.523
  281    H1   MET   1           HT1      MET   1  11.798  -1.627   1.071
  282    H2   MET   1           HT2      MET   1  10.818  -3.010   1.201
  283    H3   MET   1           HT3      MET   1  10.900  -1.901   2.484
  284    HA   MET   1           HA       MET   1  10.066  -0.236   0.662
  285    HB2  MET   1           HB2      MET   1   9.961  -2.760  -0.644
  286    HB3  MET   1           HB1      MET   1   8.296  -2.286  -0.311
  287    HG2  MET   1           HG2      MET   1   8.654  -0.125  -1.386
  288    HG3  MET   1           HG1      MET   1  10.358  -0.505  -1.639
  289    HE1  MET   1           HE1      MET   1   9.463   0.464  -3.881
  290    HE2  MET   1           HE2      MET   1   7.727   0.167  -3.884
  291    HE3  MET   1           HE3      MET   1   8.732  -0.511  -5.162
  292    H    PHE   2           HN       PHE   2   7.351  -0.556   0.489
  293    HA   PHE   2           HA       PHE   2   5.401  -0.498   1.700
  294    HB2  PHE   2           HB2      PHE   2   6.864  -2.768   2.823
  295    HB3  PHE   2           HB1      PHE   2   5.782  -2.006   3.984
  296    HD1  PHE   2           HD1      PHE   2   6.034  -3.950   0.912
  297    HD2  PHE   2           HD2      PHE   2   3.356  -1.774   3.469
  298    HE1  PHE   2           HE1      PHE   2   4.097  -5.043  -0.183
  299    HE2  PHE   2           HE2      PHE   2   1.419  -2.867   2.374
  300    HZ   PHE   2           HZ       PHE   2   1.789  -4.503   0.547
  301    H    GLU   3           HN       GLU   3   7.618  -0.972   4.430
  302    HA   GLU   3           HA       GLU   3   6.526   1.341   5.726
  303    HB2  GLU   3           HB2      GLU   3   8.738  -0.516   6.546
  304    HB3  GLU   3           HB1      GLU   3   8.039   0.732   7.576
  305    HG2  GLU   3           HG2      GLU   3   6.517  -1.576   6.326
  306    HG3  GLU   3           HG1      GLU   3   7.015  -1.479   8.015
  307    HA   PRO   4           HA       PRO   4   9.543   4.128   3.790
  308    HB2  PRO   4           HB2      PRO   4   8.648   5.912   6.004
  309    HB3  PRO   4           HB1      PRO   4   8.716   6.223   4.260
  310    HG2  PRO   4           HG2      PRO   4   6.404   5.800   5.497
  311    HG3  PRO   4           HG1      PRO   4   6.702   5.189   3.859
  312    HD2  PRO   4           HD2      PRO   4   6.670   3.689   6.455
  313    HD3  PRO   4           HD1      PRO   4   6.142   3.170   4.834
  314    H    PHE   5           HN       PHE   5   9.314   3.505   7.261
  315    HA   PHE   5           HA       PHE   5  11.911   4.573   7.857
  316    HB2  PHE   5           HB2      PHE   5  11.246   4.327   9.987
  317    HB3  PHE   5           HB1      PHE   5   9.690   3.799   9.345
  318    HD1  PHE   5           HD1      PHE   5  12.804   2.776  10.934
  319    HD2  PHE   5           HD2      PHE   5   9.227   1.358   9.022
  320    HE1  PHE   5           HE1      PHE   5  13.193   0.507  11.859
  321    HE2  PHE   5           HE2      PHE   5   9.629  -0.907   9.953
  322    HZ   PHE   5           HZ       PHE   5  11.618  -1.327  11.384
  323    H    GLN   6           HN       GLN   6  10.620   1.472   6.905
  324    HA   GLN   6           HA       GLN   6  12.800  -0.152   7.702
  325    HB2  GLN   6           HB2      GLN   6  10.648  -1.128   7.129
  326    HB3  GLN   6           HB1      GLN   6  10.790  -0.537   5.471
  327    HG2  GLN   6           HG2      GLN   6  12.359  -2.115   4.899
  328    HG3  GLN   6           HG1      GLN   6  13.042  -2.182   6.523
  329   HE21  GLN   6          HE21      GLN   6  12.687  -4.218   7.399
  330   HE22  GLN   6          HE22      GLN   6  11.260  -5.122   7.219
  331    H    ILE   7           HN       ILE   7  12.035   1.451   4.618
  332    HA   ILE   7           HA       ILE   7  14.373   0.475   3.297
  333    HB   ILE   7           HB       ILE   7  13.776   1.928   1.502
  334   HG12  ILE   7          HG12      ILE   7  12.141   3.440   3.538
  335   HG13  ILE   7          HG11      ILE   7  13.604   4.030   2.769
  336   HG21  ILE   7          HG21      ILE   7  12.136   0.084   2.142
  337   HG22  ILE   7          HG22      ILE   7  11.468   1.389   1.161
  338   HG23  ILE   7          HG23      ILE   7  11.156   1.342   2.894
  339   HD11  ILE   7          HD11      ILE   7  11.791   5.027   1.571
  340   HD12  ILE   7          HD12      ILE   7  10.922   3.495   1.483
  341   HD13  ILE   7          HD13      ILE   7  12.396   3.727   0.543
  342    H    LEU   8           HN       LEU   8  13.648   3.360   5.200
  343    HA   LEU   8           HA       LEU   8  16.104   4.699   4.569
  344    HB2  LEU   8           HB2      LEU   8  13.729   5.182   6.163
  345    HB3  LEU   8           HB1      LEU   8  15.184   5.649   7.042
  346    HG   LEU   8           HG       LEU   8  14.267   7.511   5.664
  347   HD11  LEU   8          HD11      LEU   8  16.790   7.084   6.128
  348   HD12  LEU   8          HD12      LEU   8  16.353   8.259   4.892
  349   HD13  LEU   8          HD13      LEU   8  16.874   6.642   4.422
  350   HD21  LEU   8          HD21      LEU   8  14.128   7.395   3.305
  351   HD22  LEU   8          HD22      LEU   8  13.470   5.849   3.839
  352   HD23  LEU   8          HD23      LEU   8  15.120   5.939   3.225
  353    H    SER   9           HN       SER   9  15.108   2.383   6.994
  354    HA   SER   9           HA       SER   9  17.425   2.755   8.667
  355    HB2  SER   9           HB2      SER   9  16.608   0.771   9.839
  356    HB3  SER   9           HB1      SER   9  15.286   1.900   9.553
  357    HG   SER   9           HG       SER   9  15.778  -0.607   8.474
  358    H    ILE  10           HN       ILE  10  16.444   0.537   6.091
  359    HA   ILE  10           HA       ILE  10  18.676  -1.212   6.317
  360    HB   ILE  10           HB       ILE  10  16.782  -0.644   4.028
  361   HG12  ILE  10          HG12      ILE  10  17.012  -3.092   5.793
  362   HG13  ILE  10          HG11      ILE  10  15.973  -1.731   6.211
  363   HG21  ILE  10          HG21      ILE  10  17.703  -2.872   3.181
  364   HG22  ILE  10          HG22      ILE  10  19.024  -2.658   4.328
  365   HG23  ILE  10          HG23      ILE  10  18.789  -1.490   3.027
  366   HD11  ILE  10          HD11      ILE  10  14.951  -1.984   3.873
  367   HD12  ILE  10          HD12      ILE  10  14.569  -3.256   5.034
  368   HD13  ILE  10          HD13      ILE  10  15.790  -3.535   3.790
  369    H    CYS  11           HN       CYS  11  18.033   1.703   4.374
  370    HA   CYS  11           HA       CYS  11  20.399   1.551   2.817
  371    HB2  CYS  11           HB2      CYS  11  18.367   2.947   2.307
  372    HB3  CYS  11           HB1      CYS  11  18.867   4.037   3.599
  373    HG   CYS  11           HG       CYS  11  20.156   5.084   1.725
  374    H    SER  12           HN       SER  12  19.603   3.515   5.720
  375    HA   SER  12           HA       SER  12  22.147   4.671   5.988
  376    HB2  SER  12           HB2      SER  12  19.989   4.098   8.023
  377    HB3  SER  12           HB1      SER  12  21.448   5.014   8.390
  378    HG   SER  12           HG       SER  12  20.846   6.536   6.887
  379    H    PHE  13           HN       PHE  13  20.814   1.644   7.228
  380    HA   PHE  13           HA       PHE  13  22.908   0.965   8.974
  381    HB2  PHE  13           HB2      PHE  13  20.751  -0.508   7.549
  382    HB3  PHE  13           HB1      PHE  13  22.086  -1.458   8.195
  383    HD1  PHE  13           HD1      PHE  13  20.673   1.716   9.552
  384    HD2  PHE  13           HD2      PHE  13  21.113  -2.525  10.074
  385    HE1  PHE  13           HE1      PHE  13  19.707   1.896  11.830
  386    HE2  PHE  13           HE2      PHE  13  20.148  -2.344  12.351
  387    HZ   PHE  13           HZ       PHE  13  19.446  -0.136  13.229
  388    H    ILE  14           HN       ILE  14  22.430   0.254   5.513
  389    HA   ILE  14           HA       ILE  14  24.748  -1.312   5.166
  390    HB   ILE  14           HB       ILE  14  23.148   0.393   3.258
  391   HG12  ILE  14          HG12      ILE  14  23.420  -2.615   3.399
  392   HG13  ILE  14          HG11      ILE  14  22.218  -1.744   4.352
  393   HG21  ILE  14          HG21      ILE  14  25.331   0.300   2.289
  394   HG22  ILE  14          HG22      ILE  14  24.402  -0.973   1.498
  395   HG23  ILE  14          HG23      ILE  14  25.550  -1.382   2.773
  396   HD11  ILE  14          HD11      ILE  14  21.327  -2.567   2.160
  397   HD12  ILE  14          HD12      ILE  14  22.490  -1.523   1.341
  398   HD13  ILE  14          HD13      ILE  14  21.221  -0.817   2.340
  399    H    LEU  15           HN       LEU  15  24.189   2.184   4.818
  400    HA   LEU  15           HA       LEU  15  26.764   2.850   3.886
  401    HB2  LEU  15           HB2      LEU  15  24.538   4.331   5.207
  402    HB3  LEU  15           HB1      LEU  15  26.122   5.103   5.131
  403    HG   LEU  15           HG       LEU  15  24.876   3.850   2.685
  404   HD11  LEU  15          HD11      LEU  15  24.101   6.161   2.106
  405   HD12  LEU  15          HD12      LEU  15  24.518   6.670   3.743
  406   HD13  LEU  15          HD13      LEU  15  23.248   5.474   3.489
  407   HD21  LEU  15          HD21      LEU  15  27.217   4.355   2.464
  408   HD22  LEU  15          HD22      LEU  15  27.013   5.928   3.236
  409   HD23  LEU  15          HD23      LEU  15  26.349   5.644   1.628
  410    H    SER  16           HN       SER  16  25.455   3.188   7.194
  411    HA   SER  16           HA       SER  16  27.745   3.937   8.504
  412    HB2  SER  16           HB2      SER  16  25.621   2.033   9.524
  413    HB3  SER  16           HB1      SER  16  26.773   2.914  10.525
  414    HG   SER  16           HG       SER  16  25.304   4.418  10.475
  415    H    ALA  17           HN       ALA  17  26.767   0.673   7.556
  416    HA   ALA  17           HA       ALA  17  28.804  -0.740   8.910
  417    HB1  ALA  17           HB1      ALA  17  27.459  -1.495   6.307
  418    HB2  ALA  17           HB2      ALA  17  26.741  -1.747   7.898
  419    HB3  ALA  17           HB3      ALA  17  28.229  -2.589   7.457
  420    H    LEU  18           HN       LEU  18  28.609   0.448   5.545
  421    HA   LEU  18           HA       LEU  18  31.211  -0.433   4.815
  422    HB2  LEU  18           HB2      LEU  18  29.083   1.235   3.626
  423    HB3  LEU  18           HB1      LEU  18  30.721   1.592   3.078
  424    HG   LEU  18           HG       LEU  18  31.012  -0.902   2.688
  425   HD11  LEU  18          HD11      LEU  18  29.241  -1.797   4.040
  426   HD12  LEU  18          HD12      LEU  18  28.807  -2.123   2.362
  427   HD13  LEU  18          HD13      LEU  18  28.035  -0.797   3.230
  428   HD21  LEU  18          HD21      LEU  18  29.612  -0.862   0.581
  429   HD22  LEU  18          HD22      LEU  18  30.639   0.555   0.796
  430   HD23  LEU  18          HD23      LEU  18  28.914   0.655   1.148
  431    H    HIS  19           HN       HIS  19  30.028   2.323   6.538
  432    HA   HIS  19           HA       HIS  19  32.214   4.085   6.053
  433    HB2  HIS  19           HB2      HIS  19  30.151   5.005   6.877
  434    HB3  HIS  19           HB1      HIS  19  30.175   3.940   8.281
  435    HD2  HIS  19           HD2      HIS  19  31.527   4.980  10.462
  436    HE1  HIS  19           HE1      HIS  19  33.467   8.159   8.473
  437    HE2  HIS  19           HE2      HIS  19  33.041   7.091  10.737
  438    H    PHE  20           HN       PHE  20  31.365   2.384   9.093
  439    HA   PHE  20           HA       PHE  20  33.846   2.720  10.304
  440    HB2  PHE  20           HB2      PHE  20  31.467   1.109  10.760
  441    HB3  PHE  20           HB1      PHE  20  32.938   0.256  11.229
  442    HD1  PHE  20           HD1      PHE  20  30.999   3.397  11.718
  443    HD2  PHE  20           HD2      PHE  20  34.221   0.927  13.125
  444    HE1  PHE  20           HE1      PHE  20  31.149   4.766  13.782
  445    HE2  PHE  20           HE2      PHE  20  34.371   2.297  15.187
  446    HZ   PHE  20           HZ       PHE  20  32.835   4.214  15.520
  447    H    MET  21           HN       MET  21  32.820   0.408   7.883
  448    HA   MET  21           HA       MET  21  34.875  -1.493   8.192
  449    HB2  MET  21           HB2      MET  21  32.900  -0.759   6.140
  450    HB3  MET  21           HB1      MET  21  34.368  -1.504   5.505
  451    HG2  MET  21           HG2      MET  21  32.822  -2.665   7.832
  452    HG3  MET  21           HG1      MET  21  32.517  -3.128   6.158
  453    HE1  MET  21           HE1      MET  21  33.102  -4.842   8.476
  454    HE2  MET  21           HE2      MET  21  34.535  -4.213   9.286
  455    HE3  MET  21           HE3      MET  21  34.617  -5.753   8.435
  456    H    ALA  22           HN       ALA  22  34.658   1.079   5.707
  457    HA   ALA  22           HA       ALA  22  37.339   0.828   4.870
  458    HB1  ALA  22           HB1      ALA  22  35.890   3.439   4.677
  459    HB2  ALA  22           HB2      ALA  22  35.278   2.046   3.785
  460    HB3  ALA  22           HB3      ALA  22  36.913   2.635   3.486
  461    H    TRP  23           HN       TRP  23  35.807   2.940   7.257
  462    HA   TRP  23           HA       TRP  23  37.988   4.616   7.791
  463    HB2  TRP  23           HB2      TRP  23  35.440   4.491   8.687
  464    HB3  TRP  23           HB1      TRP  23  36.294   3.855  10.091
  465    HD1  TRP  23           HD1      TRP  23  36.090   6.957   7.857
  466    HE1  TRP  23           HE1      TRP  23  37.099   8.958   9.131
  467    HE3  TRP  23           HE3      TRP  23  37.892   4.557  11.991
  468    HZ2  TRP  23           HZ2      TRP  23  38.485   9.474  11.578
  469    HZ3  TRP  23           HZ3      TRP  23  39.050   5.827  13.775
  470    HH2  TRP  23           HH2      TRP  23  39.347   8.280  13.576
  471    H    THR  24           HN       THR  24  36.990   1.595   9.391
  472    HA   THR  24           HA       THR  24  39.015   1.433  11.290
  473    HB   THR  24           HB       THR  24  37.610  -0.775   9.772
  474    HG1  THR  24           HG1      THR  24  37.210   0.217  12.390
  475   HG21  THR  24          HG21      THR  24  38.286  -2.117  11.853
  476   HG22  THR  24          HG22      THR  24  39.460  -0.837  12.158
  477   HG23  THR  24          HG23      THR  24  39.557  -1.788  10.675
  478    H    ILE  25           HN       ILE  25  38.967   0.238   7.929
  479    HA   ILE  25           HA       ILE  25  41.559  -0.905   7.979
  480    HB   ILE  25           HB       ILE  25  39.889   0.187   5.704
  481   HG12  ILE  25          HG12      ILE  25  40.523  -2.669   6.476
  482   HG13  ILE  25          HG11      ILE  25  39.094  -1.817   7.061
  483   HG21  ILE  25          HG21      ILE  25  42.453  -1.435   5.653
  484   HG22  ILE  25          HG22      ILE  25  42.248   0.209   5.046
  485   HG23  ILE  25          HG23      ILE  25  41.428  -1.131   4.251
  486   HD11  ILE  25          HD11      ILE  25  38.564  -3.141   5.048
  487   HD12  ILE  25          HD12      ILE  25  39.805  -2.270   4.148
  488   HD13  ILE  25          HD13      ILE  25  38.378  -1.416   4.733
  489    H    GLY  26           HN       GLY  26  40.374   2.306   7.166
  490    HA2  GLY  26           HA2      GLY  26  42.758   3.420   6.170
  491    HA3  GLY  26           HA1      GLY  26  41.446   4.337   6.901
  492    H    HIS  27           HN       HIS  27  41.416   3.492   9.473
  493    HA   HIS  27           HA       HIS  27  43.530   4.910  10.661
  494    HB2  HIS  27           HB2      HIS  27  41.509   4.735  11.892
  495    HB3  HIS  27           HB1      HIS  27  41.500   2.976  11.769
  496    HD2  HIS  27           HD2      HIS  27  42.559   1.777  14.006
  497    HE1  HIS  27           HE1      HIS  27  44.921   4.997  15.375
  498    HE2  HIS  27           HE2      HIS  27  44.163   2.627  15.881
  499    H    LEU  28           HN       LEU  28  43.018   1.445  10.136
  500    HA   LEU  28           HA       LEU  28  45.193   0.498  11.649
  501    HB2  LEU  28           HB2      LEU  28  43.445  -0.991  10.810
  502    HB3  LEU  28           HB1      LEU  28  43.922  -0.647   9.149
  503    HG   LEU  28           HG       LEU  28  46.167  -1.601   9.611
  504   HD11  LEU  28          HD11      LEU  28  46.423  -1.202  11.956
  505   HD12  LEU  28          HD12      LEU  28  46.353  -2.954  11.764
  506   HD13  LEU  28          HD13      LEU  28  44.935  -2.072  12.333
  507   HD21  LEU  28          HD21      LEU  28  44.349  -3.038   8.723
  508   HD22  LEU  28          HD22      LEU  28  43.878  -3.442  10.375
  509   HD23  LEU  28          HD23      LEU  28  45.449  -3.951   9.756
  510    H    ASN  29           HN       ASN  29  44.962   1.384   8.207
  511    HA   ASN  29           HA       ASN  29  47.689   0.806   7.624
  512    HB2  ASN  29           HB2      ASN  29  45.626   2.504   6.212
  513    HB3  ASN  29           HB1      ASN  29  47.237   2.192   5.568
  514   HD21  ASN  29          HD21      ASN  29  44.597   1.274   4.470
  515   HD22  ASN  29          HD22      ASN  29  44.697  -0.420   4.415
  516    H    GLN  30           HN       GLN  30  45.962   3.713   8.629
  517    HA   GLN  30           HA       GLN  30  48.037   5.577   8.237
  518    HB2  GLN  30           HB2      GLN  30  45.650   5.506  10.074
  519    HB3  GLN  30           HB1      GLN  30  46.780   6.860  10.075
  520    HG2  GLN  30           HG2      GLN  30  46.334   7.339   7.764
  521    HG3  GLN  30           HG1      GLN  30  45.428   5.843   7.565
  522   HE21  GLN  30          HE21      GLN  30  45.192   9.171   8.528
  523   HE22  GLN  30          HE22      GLN  30  43.564   9.132   9.003
  524    H    ILE  31           HN       ILE  31  47.175   3.567  11.031
  525    HA   ILE  31           HA       ILE  31  49.854   4.119  12.139
  526    HB   ILE  31           HB       ILE  31  47.241   3.976  13.653
  527   HG12  ILE  31          HG12      ILE  31  49.315   6.181  13.541
  528   HG13  ILE  31          HG11      ILE  31  47.908   6.135  12.478
  529   HG21  ILE  31          HG21      ILE  31  50.115   4.079  14.613
  530   HG22  ILE  31          HG22      ILE  31  48.934   2.808  14.929
  531   HG23  ILE  31          HG23      ILE  31  48.723   4.403  15.645
  532   HD11  ILE  31          HD11      ILE  31  47.697   6.001  15.494
  533   HD12  ILE  31          HD12      ILE  31  46.394   6.264  14.335
  534   HD13  ILE  31          HD13      ILE  31  47.611   7.513  14.591
  535    H    LYS  32           HN       LYS  32  51.003   2.340  12.536
  536    HA   LYS  32           HA       LYS  32  49.640  -0.259  12.399
  537    HB2  LYS  32           HB2      LYS  32  51.939  -1.166  12.102
  538    HB3  LYS  32           HB1      LYS  32  51.504   0.012  10.866
  539    HG2  LYS  32           HG2      LYS  32  52.921   1.641  11.721
  540    HG3  LYS  32           HG1      LYS  32  52.878   0.974  13.352
  541    HD2  LYS  32           HD2      LYS  32  54.270  -0.897  12.690
  542    HD3  LYS  32           HD1      LYS  32  54.208  -0.395  10.999
  543    HE2  LYS  32           HE2      LYS  32  55.407   1.660  11.519
  544    HE3  LYS  32           HE1      LYS  32  55.373   1.281  13.242
  545    HZ1  LYS  32           HZ1      LYS  32  56.635  -0.760  12.722
  546    HZ2  LYS  32           HZ2      LYS  32  57.488   0.664  12.354
  547    HZ3  LYS  32           HZ3      LYS  32  56.768  -0.243  11.111
  548    H    ARG  33           HN       ARG  33  51.219  -1.926  13.740
  549    HA   ARG  33           HA       ARG  33  51.039  -0.961  16.527
  550    HB2  ARG  33           HB2      ARG  33  51.297  -3.860  16.002
  551    HB3  ARG  33           HB1      ARG  33  50.254  -3.005  17.139
  552    HG2  ARG  33           HG2      ARG  33  48.918  -2.213  15.116
  553    HG3  ARG  33           HG1      ARG  33  49.832  -3.390  14.171
  554    HD2  ARG  33           HD2      ARG  33  47.859  -4.538  14.820
  555    HD3  ARG  33           HD1      ARG  33  49.106  -5.120  15.918
  556    HE   ARG  33           HE       ARG  33  47.832  -2.889  17.089
  557   HH11  ARG  33          HH11      ARG  33  47.203  -6.199  16.198
  558   HH12  ARG  33          HH12      ARG  33  46.027  -6.438  17.439
  559   HH21  ARG  33          HH21      ARG  33  46.287  -3.229  18.704
  560   HH22  ARG  33          HH22      ARG  33  45.510  -4.770  18.852
  561    H1   MET   1           HT1      MET   1  12.333  -1.484  20.684
  562    H2   MET   1           HT2      MET   1  11.210  -1.472  21.959
  563    H3   MET   1           HT3      MET   1  11.190  -0.236  20.794
  564    HA   MET   1           HA       MET   1  10.847  -2.235  19.161
  565    HB2  MET   1           HB2      MET   1  10.700  -3.441  21.730
  566    HB3  MET   1           HB1      MET   1   9.061  -3.416  21.083
  567    HG2  MET   1           HG2      MET   1   9.812  -4.497  19.028
  568    HG3  MET   1           HG1      MET   1  11.486  -4.441  19.582
  569    HE1  MET   1           HE1      MET   1  11.077  -6.838  18.657
  570    HE2  MET   1           HE2      MET   1   9.344  -7.124  18.788
  571    HE3  MET   1           HE3      MET   1  10.470  -8.187  19.627
  572    H    PHE   2           HN       PHE   2   8.176  -2.856  19.234
  573    HA   PHE   2           HA       PHE   2   6.069  -1.997  18.924
  574    HB2  PHE   2           HB2      PHE   2   7.088  -0.554  21.256
  575    HB3  PHE   2           HB1      PHE   2   5.911   0.374  20.333
  576    HD1  PHE   2           HD1      PHE   2   6.470  -2.535  22.458
  577    HD2  PHE   2           HD2      PHE   2   3.642  -0.555  19.904
  578    HE1  PHE   2           HE1      PHE   2   4.641  -3.900  23.423
  579    HE2  PHE   2           HE2      PHE   2   1.812  -1.921  20.869
  580    HZ   PHE   2           HZ       PHE   2   2.310  -3.593  22.631
  581    H    GLU   3           HN       GLU   3   7.742   1.087  19.455
  582    HA   GLU   3           HA       GLU   3   6.692   2.087  16.982
  583    HB2  GLU   3           HB2      GLU   3   8.537   3.346  18.989
  584    HB3  GLU   3           HB1      GLU   3   7.806   4.191  17.625
  585    HG2  GLU   3           HG2      GLU   3   6.286   2.790  19.847
  586    HG3  GLU   3           HG1      GLU   3   6.505   4.534  19.703
  587    HA   PRO   4           HA       PRO   4  10.255   0.591  14.604
  588    HB2  PRO   4           HB2      PRO   4   9.191   2.547  12.622
  589    HB3  PRO   4           HB1      PRO   4   9.577   0.831  12.429
  590    HG2  PRO   4           HG2      PRO   4   7.063   1.670  12.554
  591    HG3  PRO   4           HG1      PRO   4   7.565   0.133  13.279
  592    HD2  PRO   4           HD2      PRO   4   6.948   2.740  14.622
  593    HD3  PRO   4           HD1      PRO   4   6.649   1.074  15.178
  594    H    PHE   5           HN       PHE   5   9.391   3.994  15.008
  595    HA   PHE   5           HA       PHE   5  11.948   4.978  14.154
  596    HB2  PHE   5           HB2      PHE   5  10.918   6.972  14.213
  597    HB3  PHE   5           HB1      PHE   5   9.444   6.099  14.632
  598    HD1  PHE   5           HD1      PHE   5  12.141   8.228  15.848
  599    HD2  PHE   5           HD2      PHE   5   8.797   5.806  17.030
  600    HE1  PHE   5           HE1      PHE   5  12.157   9.298  18.085
  601    HE2  PHE   5           HE2      PHE   5   8.813   6.876  19.268
  602    HZ   PHE   5           HZ       PHE   5  10.493   8.623  19.794
  603    H    GLN   6           HN       GLN   6  10.523   3.951  17.171
  604    HA   GLN   6           HA       GLN   6  12.367   5.161  18.943
  605    HB2  GLN   6           HB2      GLN   6  10.253   4.266  19.744
  606    HB3  GLN   6           HB1      GLN   6  10.727   2.637  19.261
  607    HG2  GLN   6           HG2      GLN   6  12.204   2.402  21.009
  608    HG3  GLN   6           HG1      GLN   6  12.594   4.120  21.049
  609   HE21  GLN   6          HE21      GLN   6  11.894   5.000  22.991
  610   HE22  GLN   6          HE22      GLN   6  10.434   4.613  23.767
  611    H    ILE   7           HN       ILE   7  12.288   1.929  17.458
  612    HA   ILE   7           HA       ILE   7  14.705   1.069  18.711
  613    HB   ILE   7           HB       ILE   7  14.566  -0.858  17.310
  614   HG12  ILE   7          HG12      ILE   7  12.780   0.809  15.541
  615   HG13  ILE   7          HG11      ILE   7  14.403   0.277  15.136
  616   HG21  ILE   7          HG21      ILE   7  12.664  -0.438  18.953
  617   HG22  ILE   7          HG22      ILE   7  12.302  -1.566  17.649
  618   HG23  ILE   7          HG23      ILE   7  11.704   0.088  17.572
  619   HD11  ILE   7          HD11      ILE   7  12.921  -1.250  14.041
  620   HD12  ILE   7          HD12      ILE   7  11.928  -1.424  15.487
  621   HD13  ILE   7          HD13      ILE   7  13.553  -2.108  15.447
  622    H    LEU   8           HN       LEU   8  13.974   2.706  15.671
  623    HA   LEU   8           HA       LEU   8  16.624   2.456  14.606
  624    HB2  LEU   8           HB2      LEU   8  14.079   3.599  13.814
  625    HB3  LEU   8           HB1      LEU   8  15.409   4.695  13.437
  626    HG   LEU   8           HG       LEU   8  14.925   3.102  11.580
  627   HD11  LEU   8          HD11      LEU   8  17.278   4.018  12.210
  628   HD12  LEU   8          HD12      LEU   8  17.177   2.678  11.071
  629   HD13  LEU   8          HD13      LEU   8  17.607   2.373  12.753
  630   HD21  LEU   8          HD21      LEU   8  15.176   0.766  11.822
  631   HD22  LEU   8          HD22      LEU   8  14.295   1.239  13.271
  632   HD23  LEU   8          HD23      LEU   8  16.025   0.918  13.360
  633    H    SER   9           HN       SER   9  15.010   4.753  16.682
  634    HA   SER   9           HA       SER   9  17.040   6.785  16.434
  635    HB2  SER   9           HB2      SER   9  15.839   7.872  18.259
  636    HB3  SER   9           HB1      SER   9  14.707   7.303  17.034
  637    HG   SER   9           HG       SER   9  15.118   6.447  19.637
  638    H    ILE  10           HN       ILE  10  16.277   4.171  18.695
  639    HA   ILE  10           HA       ILE  10  18.256   4.840  20.624
  640    HB   ILE  10           HB       ILE  10  16.836   2.240  20.007
  641   HG12  ILE  10          HG12      ILE  10  16.518   4.113  22.365
  642   HG13  ILE  10          HG11      ILE  10  15.568   4.293  20.891
  643   HG21  ILE  10          HG21      ILE  10  17.651   1.649  22.355
  644   HG22  ILE  10          HG22      ILE  10  18.778   2.996  22.202
  645   HG23  ILE  10          HG23      ILE  10  18.883   1.630  21.094
  646   HD11  ILE  10          HD11      ILE  10  14.927   1.829  21.179
  647   HD12  ILE  10          HD12      ILE  10  14.233   2.956  22.343
  648   HD13  ILE  10          HD13      ILE  10  15.607   1.951  22.802
  649    H    CYS  11           HN       CYS  11  18.239   2.701  17.780
  650    HA   CYS  11           HA       CYS  11  20.805   1.580  18.229
  651    HB2  CYS  11           HB2      CYS  11  19.034   0.678  16.681
  652    HB3  CYS  11           HB1      CYS  11  19.425   1.991  15.571
  653    HG   CYS  11           HG       CYS  11  21.102   0.323  14.756
  654    H    SER  12           HN       SER  12  19.739   4.228  16.048
  655    HA   SER  12           HA       SER  12  22.307   4.880  15.117
  656    HB2  SER  12           HB2      SER  12  19.795   6.538  15.372
  657    HB3  SER  12           HB1      SER  12  21.258   7.113  14.577
  658    HG   SER  12           HG       SER  12  21.068   5.474  13.089
  659    H    PHE  13           HN       PHE  13  20.488   5.994  17.934
  660    HA   PHE  13           HA       PHE  13  22.184   8.093  18.708
  661    HB2  PHE  13           HB2      PHE  13  20.155   6.378  20.050
  662    HB3  PHE  13           HB1      PHE  13  21.262   7.278  21.083
  663    HD1  PHE  13           HD1      PHE  13  19.974   8.252  17.721
  664    HD2  PHE  13           HD2      PHE  13  19.886   9.003  21.949
  665    HE1  PHE  13           HE1      PHE  13  18.666  10.323  17.326
  666    HE2  PHE  13           HE2      PHE  13  18.581  11.073  21.556
  667    HZ   PHE  13           HZ       PHE  13  17.970  11.734  19.244
  668    H    ILE  14           HN       ILE  14  22.215   4.637  19.565
  669    HA   ILE  14           HA       ILE  14  24.392   4.745  21.352
  670    HB   ILE  14           HB       ILE  14  23.311   2.528  19.613
  671   HG12  ILE  14          HG12      ILE  14  23.248   2.830  22.621
  672   HG13  ILE  14          HG11      ILE  14  22.000   3.531  21.590
  673   HG21  ILE  14          HG21      ILE  14  25.603   1.951  19.965
  674   HG22  ILE  14          HG22      ILE  14  24.693   1.061  21.187
  675   HG23  ILE  14          HG23      ILE  14  25.566   2.528  21.631
  676   HD11  ILE  14          HD11      ILE  14  21.408   1.250  22.446
  677   HD12  ILE  14          HD12      ILE  14  22.788   0.603  21.561
  678   HD13  ILE  14          HD13      ILE  14  21.449   1.343  20.685
  679    H    LEU  15           HN       LEU  15  24.251   4.178  17.851
  680    HA   LEU  15           HA       LEU  15  27.004   3.670  17.474
  681    HB2  LEU  15           HB2      LEU  15  24.749   4.531  15.720
  682    HB3  LEU  15           HB1      LEU  15  26.394   4.696  15.104
  683    HG   LEU  15           HG       LEU  15  25.451   2.125  16.371
  684   HD11  LEU  15          HD11      LEU  15  25.024   1.333  14.031
  685   HD12  LEU  15          HD12      LEU  15  25.210   2.996  13.477
  686   HD13  LEU  15          HD13      LEU  15  23.886   2.572  14.561
  687   HD21  LEU  15          HD21      LEU  15  27.835   2.287  16.102
  688   HD22  LEU  15          HD22      LEU  15  27.668   2.951  14.478
  689   HD23  LEU  15          HD23      LEU  15  27.255   1.265  14.787
  690    H    SER  16           HN       SER  16  25.200   6.691  16.843
  691    HA   SER  16           HA       SER  16  27.306   8.340  16.231
  692    HB2  SER  16           HB2      SER  16  24.861   9.054  17.869
  693    HB3  SER  16           HB1      SER  16  25.916  10.205  17.051
  694    HG   SER  16           HG       SER  16  24.635   9.851  15.419
  695    H    ALA  17           HN       ALA  17  26.172   7.373  19.439
  696    HA   ALA  17           HA       ALA  17  27.805   9.104  20.958
  697    HB1  ALA  17           HB1      ALA  17  26.843   6.340  21.727
  698    HB2  ALA  17           HB2      ALA  17  25.848   7.793  21.823
  699    HB3  ALA  17           HB3      ALA  17  27.295   7.647  22.822
  700    H    LEU  18           HN       LEU  18  28.288   5.713  19.951
  701    HA   LEU  18           HA       LEU  18  30.876   5.469  21.104
  702    HB2  LEU  18           HB2      LEU  18  29.153   3.871  19.312
  703    HB3  LEU  18           HB1      LEU  18  30.889   3.598  19.140
  704    HG   LEU  18           HG       LEU  18  30.987   3.360  21.668
  705   HD11  LEU  18          HD11      LEU  18  28.935   4.423  22.319
  706   HD12  LEU  18          HD12      LEU  18  28.757   2.710  22.696
  707   HD13  LEU  18          HD13      LEU  18  27.987   3.380  21.258
  708   HD21  LEU  18          HD21      LEU  18  29.968   1.044  21.614
  709   HD22  LEU  18          HD22      LEU  18  31.083   1.378  20.288
  710   HD23  LEU  18          HD23      LEU  18  29.343   1.425  20.008
  711    H    HIS  19           HN       HIS  19  29.709   6.862  18.157
  712    HA   HIS  19           HA       HIS  19  32.111   6.685  16.640
  713    HB2  HIS  19           HB2      HIS  19  30.050   7.106  15.484
  714    HB3  HIS  19           HB1      HIS  19  29.727   8.533  16.466
  715    HD2  HIS  19           HD2      HIS  19  30.795  10.872  15.438
  716    HE1  HIS  19           HE1      HIS  19  33.355   9.125  12.571
  717    HE2  HIS  19           HE2      HIS  19  32.448  11.322  13.468
  718    H    PHE  20           HN       PHE  20  30.604   9.596  18.092
  719    HA   PHE  20           HA       PHE  20  32.867  11.198  17.913
  720    HB2  PHE  20           HB2      PHE  20  30.299  11.308  19.272
  721    HB3  PHE  20           HB1      PHE  20  31.578  12.054  20.229
  722    HD1  PHE  20           HD1      PHE  20  29.913  12.077  16.898
  723    HD2  PHE  20           HD2      PHE  20  32.588  14.113  19.574
  724    HE1  PHE  20           HE1      PHE  20  29.865  14.076  15.428
  725    HE2  PHE  20           HE2      PHE  20  32.539  16.110  18.104
  726    HZ   PHE  20           HZ       PHE  20  31.178  16.096  16.030
  727    H    MET  21           HN       MET  21  32.029   8.735  20.254
  728    HA   MET  21           HA       MET  21  33.805   9.455  22.315
  729    HB2  MET  21           HB2      MET  21  32.282   7.072  21.506
  730    HB3  MET  21           HB1      MET  21  33.751   6.722  22.420
  731    HG2  MET  21           HG2      MET  21  31.731   8.797  23.301
  732    HG3  MET  21           HG1      MET  21  31.664   7.114  23.825
  733    HE1  MET  21           HE1      MET  21  31.676   9.563  25.462
  734    HE2  MET  21           HE2      MET  21  33.009  10.583  24.923
  735    HE3  MET  21           HE3      MET  21  33.077   9.819  26.509
  736    H    ALA  22           HN       ALA  22  34.261   6.882  19.875
  737    HA   ALA  22           HA       ALA  22  37.008   6.518  20.416
  738    HB1  ALA  22           HB1      ALA  22  35.881   5.979  17.699
  739    HB2  ALA  22           HB2      ALA  22  35.287   5.053  19.075
  740    HB3  ALA  22           HB3      ALA  22  37.001   5.013  18.658
  741    H    TRP  23           HN       TRP  23  35.323   8.530  18.045
  742    HA   TRP  23           HA       TRP  23  37.544   9.359  16.553
  743    HB2  TRP  23           HB2      TRP  23  34.883   9.815  16.388
  744    HB3  TRP  23           HB1      TRP  23  35.424  11.368  17.024
  745    HD1  TRP  23           HD1      TRP  23  35.908   9.015  14.044
  746    HE1  TRP  23           HE1      TRP  23  36.889  10.362  12.080
  747    HE3  TRP  23           HE3      TRP  23  36.749  13.481  16.372
  748    HZ2  TRP  23           HZ2      TRP  23  37.896  12.989  11.560
  749    HZ3  TRP  23           HZ3      TRP  23  37.719  15.388  15.118
  750    HH2  TRP  23           HH2      TRP  23  38.293  15.146  12.719
  751    H    THR  24           HN       THR  24  35.992  10.882  19.375
  752    HA   THR  24           HA       THR  24  37.646  13.103  19.621
  753    HB   THR  24           HB       THR  24  36.296  11.453  21.768
  754    HG1  THR  24           HG1      THR  24  35.569  13.925  20.603
  755   HG21  THR  24          HG21      THR  24  36.477  13.667  23.051
  756   HG22  THR  24          HG22      THR  24  37.707  14.120  21.872
  757   HG23  THR  24          HG23      THR  24  37.954  12.714  22.907
  758    H    ILE  25           HN       ILE  25  38.033   9.836  20.993
  759    HA   ILE  25           HA       ILE  25  40.454  10.367  22.366
  760    HB   ILE  25           HB       ILE  25  39.302   7.800  21.250
  761   HG12  ILE  25          HG12      ILE  25  39.509   8.778  24.106
  762   HG13  ILE  25          HG11      ILE  25  38.097   9.079  23.094
  763   HG21  ILE  25          HG21      ILE  25  41.665   8.248  23.102
  764   HG22  ILE  25          HG22      ILE  25  41.728   7.552  21.483
  765   HG23  ILE  25          HG23      ILE  25  40.921   6.683  22.784
  766   HD11  ILE  25          HD11      ILE  25  37.774   7.059  24.470
  767   HD12  ILE  25          HD12      ILE  25  39.228   6.348  23.772
  768   HD13  ILE  25          HD13      ILE  25  37.818   6.650  22.755
  769    H    GLY  26           HN       GLY  26  39.751   9.243  19.111
  770    HA2  GLY  26           HA2      GLY  26  42.368   8.622  18.276
  771    HA3  GLY  26           HA1      GLY  26  41.052   9.084  17.205
  772    H    HIS  27           HN       HIS  27  40.512  11.644  17.901
  773    HA   HIS  27           HA       HIS  27  42.534  13.119  16.621
  774    HB2  HIS  27           HB2      HIS  27  40.329  13.993  16.537
  775    HB3  HIS  27           HB1      HIS  27  40.161  13.938  18.292
  776    HD2  HIS  27           HD2      HIS  27  40.707  16.366  19.460
  777    HE1  HIS  27           HE1      HIS  27  43.125  17.992  16.406
  778    HE2  HIS  27           HE2      HIS  27  42.057  18.454  18.663
  779    H    LEU  28           HN       LEU  28  41.766  12.650  20.046
  780    HA   LEU  28           HA       LEU  28  43.554  14.546  21.106
  781    HB2  LEU  28           HB2      LEU  28  41.827  13.482  22.471
  782    HB3  LEU  28           HB1      LEU  28  42.603  11.914  22.267
  783    HG   LEU  28           HG       LEU  28  44.633  12.787  23.399
  784   HD11  LEU  28          HD11      LEU  28  44.537  15.124  22.895
  785   HD12  LEU  28          HD12      LEU  28  44.323  14.991  24.642
  786   HD13  LEU  28          HD13      LEU  28  42.927  15.275  23.602
  787   HD21  LEU  28          HD21      LEU  28  42.850  11.660  24.705
  788   HD22  LEU  28          HD22      LEU  28  42.075  13.220  24.972
  789   HD23  LEU  28          HD23      LEU  28  43.666  12.899  25.659
  790    H    ASN  29           HN       ASN  29  43.988  11.083  20.395
  791    HA   ASN  29           HA       ASN  29  46.701  10.996  21.258
  792    HB2  ASN  29           HB2      ASN  29  45.084   9.189  19.453
  793    HB3  ASN  29           HB1      ASN  29  46.739   8.842  19.950
  794   HD21  ASN  29          HD21      ASN  29  44.238   7.344  20.676
  795   HD22  ASN  29          HD22      ASN  29  44.173   7.372  22.371
  796    H    GLN  30           HN       GLN  30  45.135  11.579  18.151
  797    HA   GLN  30           HA       GLN  30  47.427  11.475  16.514
  798    HB2  GLN  30           HB2      GLN  30  44.771  12.881  16.259
  799    HB3  GLN  30           HB1      GLN  30  46.018  13.022  15.019
  800    HG2  GLN  30           HG2      GLN  30  46.012  10.652  14.629
  801    HG3  GLN  30           HG1      GLN  30  45.005  10.358  16.043
  802   HE21  GLN  30          HE21      GLN  30  44.949  11.131  12.657
  803   HE22  GLN  30          HE22      GLN  30  43.269  11.327  12.520
  804    H    ILE  31           HN       ILE  31  45.911  14.157  18.277
  805    HA   ILE  31           HA       ILE  31  48.412  15.685  17.917
  806    HB   ILE  31           HB       ILE  31  45.583  16.734  17.732
  807   HG12  ILE  31          HG12      ILE  31  47.858  16.891  15.738
  808   HG13  ILE  31          HG11      ILE  31  46.650  15.606  15.713
  809   HG21  ILE  31          HG21      ILE  31  48.251  18.165  17.845
  810   HG22  ILE  31          HG22      ILE  31  46.913  18.324  18.981
  811   HG23  ILE  31          HG23      ILE  31  46.747  18.932  17.333
  812   HD11  ILE  31          HD11      ILE  31  45.929  18.546  15.660
  813   HD12  ILE  31          HD12      ILE  31  44.870  17.173  15.340
  814   HD13  ILE  31          HD13      ILE  31  46.148  17.584  14.198
  815    H    LYS  32           HN       LYS  32  49.292  16.339  19.770
  816    HA   LYS  32           HA       LYS  32  47.713  16.070  22.234
  817    HB2  LYS  32           HB2      LYS  32  49.926  16.206  23.369
  818    HB3  LYS  32           HB1      LYS  32  49.823  14.869  22.225
  819    HG2  LYS  32           HG2      LYS  32  51.238  15.891  20.690
  820    HG3  LYS  32           HG1      LYS  32  50.857  17.514  21.261
  821    HD2  LYS  32           HD2      LYS  32  52.143  17.170  23.288
  822    HD3  LYS  32           HD1      LYS  32  52.413  15.476  22.874
  823    HE2  LYS  32           HE2      LYS  32  53.711  16.115  20.916
  824    HE3  LYS  32           HE1      LYS  32  53.353  17.820  21.195
  825    HZ1  LYS  32           HZ1      LYS  32  54.470  17.601  23.370
  826    HZ2  LYS  32           HZ2      LYS  32  55.512  17.331  22.055
  827    HZ3  LYS  32           HZ3      LYS  32  54.921  16.018  22.958
  828    H    ARG  33           HN       ARG  33  48.873  17.726  23.966
  829    HA   ARG  33           HA       ARG  33  48.329  20.401  22.835
  830    HB2  ARG  33           HB2      ARG  33  48.376  20.040  25.770
  831    HB3  ARG  33           HB1      ARG  33  47.250  20.950  24.761
  832    HG2  ARG  33           HG2      ARG  33  46.357  18.698  23.959
  833    HG3  ARG  33           HG1      ARG  33  47.290  17.970  25.267
  834    HD2  ARG  33           HD2      ARG  33  45.129  18.316  26.188
  835    HD3  ARG  33           HD1      ARG  33  46.112  19.633  26.823
  836    HE   ARG  33           HE       ARG  33  44.895  20.482  24.422
  837   HH11  ARG  33          HH11      ARG  33  44.092  19.625  27.702
  838   HH12  ARG  33          HH12      ARG  33  42.707  20.655  27.761
  839   HH21  ARG  33          HH21      ARG  33  43.077  21.823  24.526
  840   HH22  ARG  33          HH22      ARG  33  42.133  21.893  25.976
  841    H1   MET   1           HT1      MET   1  10.104  17.417  19.943
  842    H2   MET   1           HT2      MET   1   8.805  18.514  19.935
  843    H3   MET   1           HT3      MET   1   9.054  17.478  18.612
  844    HA   MET   1           HA       MET   1   8.811  15.633  20.436
  845    HB2  MET   1           HB2      MET   1   8.187  18.035  21.826
  846    HB3  MET   1           HB1      MET   1   6.671  17.162  21.606
  847    HG2  MET   1           HG2      MET   1   7.644  15.147  22.579
  848    HG3  MET   1           HG1      MET   1   9.213  15.940  22.717
  849    HE1  MET   1           HE1      MET   1   8.768  14.746  24.987
  850    HE2  MET   1           HE2      MET   1   7.019  14.599  25.128
  851    HE3  MET   1           HE3      MET   1   7.922  15.490  26.349
  852    H    PHE   2           HN       PHE   2   6.122  15.265  20.823
  853    HA   PHE   2           HA       PHE   2   4.156  14.736  19.759
  854    HB2  PHE   2           HB2      PHE   2   4.917  17.311  18.604
  855    HB3  PHE   2           HB1      PHE   2   3.968  16.318  17.504
  856    HD1  PHE   2           HD1      PHE   2   3.976  18.226  20.610
  857    HD2  PHE   2           HD2      PHE   2   1.724  15.483  18.192
  858    HE1  PHE   2           HE1      PHE   2   1.923  18.788  21.882
  859    HE2  PHE   2           HE2      PHE   2  -0.330  16.043  19.463
  860    HZ   PHE   2           HZ       PHE   2  -0.230  17.698  21.309
  861    H    GLU   3           HN       GLU   3   5.959  15.783  16.888
  862    HA   GLU   3           HA       GLU   3   5.373  13.286  15.604
  863    HB2  GLU   3           HB2      GLU   3   6.984  15.646  14.678
  864    HB3  GLU   3           HB1      GLU   3   6.533  14.275  13.665
  865    HG2  GLU   3           HG2      GLU   3   4.593  16.116  15.099
  866    HG3  GLU   3           HG1      GLU   3   4.963  16.166  13.375
  867    HA   PRO   4           HA       PRO   4   9.132  11.315  17.216
  868    HB2  PRO   4           HB2      PRO   4   8.529   9.391  15.020
  869    HB3  PRO   4           HB1      PRO   4   8.813   9.086  16.744
  870    HG2  PRO   4           HG2      PRO   4   6.376   8.936  15.698
  871    HG3  PRO   4           HG1      PRO   4   6.645   9.581  17.327
  872    HD2  PRO   4           HD2      PRO   4   6.033  11.058  14.793
  873    HD3  PRO   4           HD1      PRO   4   5.526  11.409  16.464
  874    H    PHE   5           HN       PHE   5   8.477  11.906  13.794
  875    HA   PHE   5           HA       PHE   5  11.200  11.525  12.974
  876    HB2  PHE   5           HB2      PHE   5  10.326  11.619  10.909
  877    HB3  PHE   5           HB1      PHE   5   8.744  11.744  11.680
  878    HD1  PHE   5           HD1      PHE   5  11.384  13.515   9.900
  879    HD2  PHE   5           HD2      PHE   5   7.723  13.990  12.098
  880    HE1  PHE   5           HE1      PHE   5  11.145  15.815   9.006
  881    HE2  PHE   5           HE2      PHE   5   7.485  16.292  11.201
  882    HZ   PHE   5           HZ       PHE   5   9.196  17.201   9.646
  883    H    GLN   6           HN       GLN   6   9.260  14.197  14.110
  884    HA   GLN   6           HA       GLN   6  10.901  16.322  13.211
  885    HB2  GLN   6           HB2      GLN   6   8.629  16.722  13.976
  886    HB3  GLN   6           HB1      GLN   6   9.047  16.165  15.597
  887    HG2  GLN   6           HG2      GLN   6  10.219  18.077  16.100
  888    HG3  GLN   6           HG1      GLN   6  10.729  18.332  14.433
  889   HE21  GLN   6          HE21      GLN   6   9.812  20.228  13.655
  890   HE22  GLN   6          HE22      GLN   6   8.226  20.745  13.971
  891    H    ILE   7           HN       ILE   7  10.807  14.545  16.293
  892    HA   ILE   7           HA       ILE   7  12.932  16.054  17.461
  893    HB   ILE   7           HB       ILE   7  12.860  14.478  19.252
  894   HG12  ILE   7          HG12      ILE   7  11.490  12.631  17.296
  895   HG13  ILE   7          HG11      ILE   7  13.110  12.414  17.936
  896   HG21  ILE   7          HG21      ILE   7  10.772  15.869  18.795
  897   HG22  ILE   7          HG22      ILE   7  10.522  14.428  19.780
  898   HG23  ILE   7          HG23      ILE   7  10.073  14.417  18.078
  899   HD11  ILE   7          HD11      ILE   7  11.699  10.983  19.231
  900   HD12  ILE   7          HD12      ILE   7  10.490  12.250  19.433
  901   HD13  ILE   7          HD13      ILE   7  12.044  12.380  20.253
  902    H    LEU   8           HN       LEU   8  12.792  13.104  15.525
  903    HA   LEU   8           HA       LEU   8  15.545  12.410  15.928
  904    HB2  LEU   8           HB2      LEU   8  13.243  11.370  14.500
  905    HB3  LEU   8           HB1      LEU   8  14.696  11.288  13.504
  906    HG   LEU   8           HG       LEU   8  14.373   9.244  14.893
  907   HD11  LEU   8          HD11      LEU   8  16.668  10.287  14.251
  908   HD12  LEU   8          HD12      LEU   8  16.636   9.027  15.479
  909   HD13  LEU   8          HD13      LEU   8  16.780  10.717  15.958
  910   HD21  LEU   8          HD21      LEU   8  14.389   9.316  17.258
  911   HD22  LEU   8          HD22      LEU   8  13.341  10.648  16.815
  912   HD23  LEU   8          HD23      LEU   8  15.006  10.960  17.303
  913    H    SER   9           HN       SER   9  13.816  14.432  13.661
  914    HA   SER   9           HA       SER   9  16.012  14.669  11.810
  915    HB2  SER   9           HB2      SER   9  14.642  16.404  10.768
  916    HB3  SER   9           HB1      SER   9  13.666  14.977  11.112
  917    HG   SER   9           HG       SER   9  13.607  17.513  12.235
  918    H    ILE  10           HN       ILE  10  14.719  16.545  14.519
  919    HA   ILE  10           HA       ILE  10  16.428  18.794  14.187
  920    HB   ILE  10           HB       ILE  10  14.922  17.741  16.591
  921   HG12  ILE  10          HG12      ILE  10  14.397  20.193  14.895
  922   HG13  ILE  10          HG11      ILE  10  13.696  18.621  14.512
  923   HG21  ILE  10          HG21      ILE  10  15.327  20.117  17.440
  924   HG22  ILE  10          HG22      ILE  10  16.566  20.252  16.191
  925   HG23  ILE  10          HG23      ILE  10  16.728  19.047  17.469
  926   HD11  ILE  10          HD11      ILE  10  12.834  18.582  16.925
  927   HD12  ILE  10          HD12      ILE  10  12.058  19.735  15.839
  928   HD13  ILE  10          HD13      ILE  10  13.267  20.291  16.996
  929    H    CYS  11           HN       CYS  11  16.681  15.788  16.078
  930    HA   CYS  11           HA       CYS  11  19.054  16.502  17.458
  931    HB2  CYS  11           HB2      CYS  11  17.476  14.639  18.072
  932    HB3  CYS  11           HB1      CYS  11  18.126  13.723  16.713
  933    HG   CYS  11           HG       CYS  11  19.776  13.006  18.456
  934    H    SER  12           HN       SER  12  18.538  14.439  14.561
  935    HA   SER  12           HA       SER  12  21.257  13.955  14.067
  936    HB2  SER  12           HB2      SER  12  18.870  13.999  12.219
  937    HB3  SER  12           HB1      SER  12  20.475  13.479  11.715
  938    HG   SER  12           HG       SER  12  20.387  11.833  13.202
  939    H    PHE  13           HN       PHE  13  19.121  16.570  13.024
  940    HA   PHE  13           HA       PHE  13  20.836  17.771  11.152
  941    HB2  PHE  13           HB2      PHE  13  18.505  18.644  12.782
  942    HB3  PHE  13           HB1      PHE  13  19.509  19.904  12.068
  943    HD1  PHE  13           HD1      PHE  13  18.822  16.496  10.718
  944    HD2  PHE  13           HD2      PHE  13  18.151  20.718  10.305
  945    HE1  PHE  13           HE1      PHE  13  17.751  16.110   8.515
  946    HE2  PHE  13           HE2      PHE  13  17.082  20.333   8.101
  947    HZ   PHE  13           HZ       PHE  13  16.881  18.029   7.206
  948    H    ILE  14           HN       ILE  14  20.475  18.296  14.656
  949    HA   ILE  14           HA       ILE  14  22.357  20.382  14.884
  950    HB   ILE  14           HB       ILE  14  21.385  18.311  16.852
  951   HG12  ILE  14          HG12      ILE  14  20.895  21.294  16.786
  952   HG13  ILE  14          HG11      ILE  14  19.872  20.164  15.898
  953   HG21  ILE  14          HG21      ILE  14  23.549  18.932  17.655
  954   HG22  ILE  14          HG22      ILE  14  22.402  19.925  18.554
  955   HG23  ILE  14          HG23      ILE  14  23.306  20.622  17.210
  956   HD11  ILE  14          HD11      ILE  14  18.986  20.709  18.178
  957   HD12  ILE  14          HD12      ILE  14  20.433  19.976  18.871
  958   HD13  ILE  14          HD13      ILE  14  19.301  18.991  17.947
  959    H    LEU  15           HN       LEU  15  22.709  16.855  15.153
  960    HA   LEU  15           HA       LEU  15  25.441  16.845  15.876
  961    HB2  LEU  15           HB2      LEU  15  23.550  14.868  14.678
  962    HB3  LEU  15           HB1      LEU  15  25.277  14.516  14.615
  963    HG   LEU  15           HG       LEU  15  23.957  15.389  17.183
  964   HD11  LEU  15          HD11      LEU  15  23.829  12.948  17.742
  965   HD12  LEU  15          HD12      LEU  15  24.223  12.584  16.061
  966   HD13  LEU  15          HD13      LEU  15  22.723  13.422  16.453
  967   HD21  LEU  15          HD21      LEU  15  26.361  15.481  17.213
  968   HD22  LEU  15          HD22      LEU  15  26.491  13.916  16.410
  969   HD23  LEU  15          HD23      LEU  15  25.909  14.009  18.072
  970    H    SER  16           HN       SER  16  23.982  16.246  12.669
  971    HA   SER  16           HA       SER  16  26.275  16.094  11.170
  972    HB2  SER  16           HB2      SER  16  23.674  17.421  10.368
  973    HB3  SER  16           HB1      SER  16  24.926  16.872   9.256
  974    HG   SER  16           HG       SER  16  23.882  15.048   9.362
  975    H    ALA  17           HN       ALA  17  24.602  19.004  12.279
  976    HA   ALA  17           HA       ALA  17  26.115  20.894  10.826
  977    HB1  ALA  17           HB1      ALA  17  24.839  21.257  13.548
  978    HB2  ALA  17           HB2      ALA  17  23.956  21.342  12.025
  979    HB3  ALA  17           HB3      ALA  17  25.218  22.521  12.378
  980    H    LEU  18           HN       LEU  18  26.484  19.654  14.156
  981    HA   LEU  18           HA       LEU  18  28.840  21.141  14.717
  982    HB2  LEU  18           HB2      LEU  18  27.293  18.979  16.012
  983    HB3  LEU  18           HB1      LEU  18  29.008  19.035  16.422
  984    HG   LEU  18           HG       LEU  18  28.705  21.519  16.869
  985   HD11  LEU  18          HD11      LEU  18  26.663  21.962  15.684
  986   HD12  LEU  18          HD12      LEU  18  26.301  22.150  17.400
  987   HD13  LEU  18          HD13      LEU  18  25.811  20.684  16.553
  988   HD21  LEU  18          HD21      LEU  18  27.535  21.104  19.074
  989   HD22  LEU  18          HD22      LEU  18  28.860  19.989  18.733
  990   HD23  LEU  18          HD23      LEU  18  27.188  19.469  18.511
  991    H    HIS  19           HN       HIS  19  28.238  18.200  12.987
  992    HA   HIS  19           HA       HIS  19  30.830  17.037  13.277
  993    HB2  HIS  19           HB2      HIS  19  29.010  15.632  12.584
  994    HB3  HIS  19           HB1      HIS  19  28.645  16.682  11.217
  995    HD2  HIS  19           HD2      HIS  19  30.030  16.047   8.905
  996    HE1  HIS  19           HE1      HIS  19  32.854  13.423  10.625
  997    HE2  HIS  19           HE2      HIS  19  31.988  14.384   8.440
  998    H    PHE  20           HN       PHE  20  29.333  18.558  10.376
  999    HA   PHE  20           HA       PHE  20  31.722  18.815   8.966
 1000    HB2  PHE  20           HB2      PHE  20  28.996  19.797   8.730
 1001    HB3  PHE  20           HB1      PHE  20  30.169  20.990   8.178
 1002    HD1  PHE  20           HD1      PHE  20  29.032  17.469   7.746
 1003    HD2  PHE  20           HD2      PHE  20  31.419  20.675   6.168
 1004    HE1  PHE  20           HE1      PHE  20  29.352  16.196   5.641
 1005    HE2  PHE  20           HE2      PHE  20  31.739  19.400   4.064
 1006    HZ   PHE  20           HZ       PHE  20  30.705  17.159   3.799
 1007    H    MET  21           HN       MET  21  30.357  20.773  11.517
 1008    HA   MET  21           HA       MET  21  31.852  23.128  11.120
 1009    HB2  MET  21           HB2      MET  21  30.290  21.893  13.287
 1010    HB3  MET  21           HB1      MET  21  31.573  22.976  13.836
 1011    HG2  MET  21           HG2      MET  21  29.605  23.740  11.668
 1012    HG3  MET  21           HG1      MET  21  29.329  24.090  13.375
 1013    HE1  MET  21           HE1      MET  21  29.284  25.926  11.071
 1014    HE2  MET  21           HE2      MET  21  30.759  25.680  10.141
 1015    HE3  MET  21           HE3      MET  21  30.527  27.185  11.026
 1016    H    ALA  22           HN       ALA  22  32.472  20.538  13.515
 1017    HA   ALA  22           HA       ALA  22  35.067  21.438  14.170
 1018    HB1  ALA  22           HB1      ALA  22  34.326  18.547  14.385
 1019    HB2  ALA  22           HB2      ALA  22  33.462  19.733  15.365
 1020    HB3  ALA  22           HB3      ALA  22  35.210  19.565  15.522
 1021    H    TRP  23           HN       TRP  23  33.917  19.045  11.832
 1022    HA   TRP  23           HA       TRP  23  36.397  17.973  11.087
 1023    HB2  TRP  23           HB2      TRP  23  33.837  17.469  10.383
 1024    HB3  TRP  23           HB1      TRP  23  34.393  18.317   8.942
 1025    HD1  TRP  23           HD1      TRP  23  35.140  15.236  11.086
 1026    HE1  TRP  23           HE1      TRP  23  36.506  13.565   9.677
 1027    HE3  TRP  23           HE3      TRP  23  35.952  18.060   6.910
 1028    HZ2  TRP  23           HZ2      TRP  23  37.773  13.441   7.117
 1029    HZ3  TRP  23           HZ3      TRP  23  37.239  17.139   5.002
 1030    HH2  TRP  23           HH2      TRP  23  38.151  14.837   5.100
 1031    H    THR  24           HN       THR  24  34.557  20.668   9.660
 1032    HA   THR  24           HA       THR  24  36.321  21.358   7.625
 1033    HB   THR  24           HB       THR  24  34.539  23.125   9.316
 1034    HG1  THR  24           HG1      THR  24  34.188  22.099   6.703
 1035   HG21  THR  24          HG21      THR  24  34.694  24.620   7.236
 1036   HG22  THR  24          HG22      THR  24  36.120  23.679   6.802
 1037   HG23  THR  24          HG23      THR  24  36.097  24.604   8.304
 1038    H    ILE  25           HN       ILE  25  36.246  22.465  11.013
 1039    HA   ILE  25           HA       ILE  25  38.464  24.214  10.811
 1040    HB   ILE  25           HB       ILE  25  37.302  22.713  13.168
 1041   HG12  ILE  25          HG12      ILE  25  37.150  25.647  12.444
 1042   HG13  ILE  25          HG11      ILE  25  35.932  24.475  11.938
 1043   HG21  ILE  25          HG21      ILE  25  39.387  24.918  13.080
 1044   HG22  ILE  25          HG22      ILE  25  39.638  23.268  13.649
 1045   HG23  ILE  25          HG23      ILE  25  38.581  24.356  14.542
 1046   HD11  ILE  25          HD11      ILE  25  35.254  25.599  14.025
 1047   HD12  ILE  25          HD12      ILE  25  36.738  25.053  14.804
 1048   HD13  ILE  25          HD13      ILE  25  35.525  23.878  14.297
 1049    H    GLY  26           HN       GLY  26  38.177  20.800  11.604
 1050    HA2  GLY  26           HA2      GLY  26  40.834  20.301  12.387
 1051    HA3  GLY  26           HA1      GLY  26  39.736  19.096  11.725
 1052    H    HIS  27           HN       HIS  27  39.292  19.939   9.191
 1053    HA   HIS  27           HA       HIS  27  41.591  19.106   7.803
 1054    HB2  HIS  27           HB2      HIS  27  39.497  18.787   6.733
 1055    HB3  HIS  27           HB1      HIS  27  39.062  20.488   6.914
 1056    HD2  HIS  27           HD2      HIS  27  39.608  21.941   4.644
 1057    HE1  HIS  27           HE1      HIS  27  42.578  19.431   3.000
 1058    HE2  HIS  27           HE2      HIS  27  41.218  21.544   2.629
 1059    H    LEU  28           HN       LEU  28  40.278  22.328   8.471
 1060    HA   LEU  28           HA       LEU  28  42.025  23.805   6.837
 1061    HB2  LEU  28           HB2      LEU  28  40.038  24.803   7.848
 1062    HB3  LEU  28           HB1      LEU  28  40.716  24.566   9.459
 1063    HG   LEU  28           HG       LEU  28  42.611  26.055   8.865
 1064   HD11  LEU  28          HD11      LEU  28  42.770  25.761   6.494
 1065   HD12  LEU  28          HD12      LEU  28  42.287  27.439   6.748
 1066   HD13  LEU  28          HD13      LEU  28  41.090  26.241   6.256
 1067   HD21  LEU  28          HD21      LEU  28  40.569  26.983   9.927
 1068   HD22  LEU  28          HD22      LEU  28  39.886  27.278   8.330
 1069   HD23  LEU  28          HD23      LEU  28  41.326  28.154   8.848
 1070    H    ASN  29           HN       ASN  29  42.298  22.848  10.256
 1071    HA   ASN  29           HA       ASN  29  44.836  24.080  10.651
 1072    HB2  ASN  29           HB2      ASN  29  43.379  21.902  12.156
 1073    HB3  ASN  29           HB1      ASN  29  44.909  22.599  12.687
 1074   HD21  ASN  29          HD21      ASN  29  42.222  22.816  14.011
 1075   HD22  ASN  29          HD22      ASN  29  41.902  24.480  14.113
 1076    H    GLN  30           HN       GLN  30  43.807  20.847   9.685
 1077    HA   GLN  30           HA       GLN  30  46.304  19.554   9.860
 1078    HB2  GLN  30           HB2      GLN  30  43.832  19.050   8.208
 1079    HB3  GLN  30           HB1      GLN  30  45.260  18.020   8.082
 1080    HG2  GLN  30           HG2      GLN  30  45.132  17.418  10.402
 1081    HG3  GLN  30           HG1      GLN  30  43.903  18.637  10.715
 1082   HE21  GLN  30          HE21      GLN  30  44.419  15.366   9.676
 1083   HE22  GLN  30          HE22      GLN  30  42.800  15.006   9.321
 1084    H    ILE  31           HN       ILE  31  44.748  21.321   7.204
 1085    HA   ILE  31           HA       ILE  31  47.383  21.466   5.881
 1086    HB   ILE  31           HB       ILE  31  44.702  20.973   4.574
 1087   HG12  ILE  31          HG12      ILE  31  47.259  19.352   4.460
 1088   HG13  ILE  31          HG11      ILE  31  45.974  19.034   5.626
 1089   HG21  ILE  31          HG21      ILE  31  47.424  21.603   3.399
 1090   HG22  ILE  31          HG22      ILE  31  45.943  22.542   3.211
 1091   HG23  ILE  31          HG23      ILE  31  46.079  20.951   2.463
 1092   HD11  ILE  31          HD11      ILE  31  45.496  19.149   2.638
 1093   HD12  ILE  31          HD12      ILE  31  44.394  18.556   3.882
 1094   HD13  ILE  31          HD13      ILE  31  45.859  17.652   3.498
 1095    H    LYS  32           HN       LYS  32  48.020  23.480   5.457
 1096    HA   LYS  32           HA       LYS  32  46.072  25.655   5.780
 1097    HB2  LYS  32           HB2      LYS  32  48.090  27.104   5.933
 1098    HB3  LYS  32           HB1      LYS  32  48.061  25.839   7.160
 1099    HG2  LYS  32           HG2      LYS  32  49.765  24.624   6.148
 1100    HG3  LYS  32           HG1      LYS  32  49.427  25.282   4.548
 1101    HD2  LYS  32           HD2      LYS  32  50.362  27.433   5.168
 1102    HD3  LYS  32           HD1      LYS  32  50.562  26.907   6.840
 1103    HE2  LYS  32           HE2      LYS  32  52.186  25.224   6.163
 1104    HE3  LYS  32           HE1      LYS  32  51.920  25.605   4.462
 1105    HZ1  LYS  32           HZ1      LYS  32  52.676  27.888   4.952
 1106    HZ2  LYS  32           HZ2      LYS  32  53.882  26.718   5.207
 1107    HZ3  LYS  32           HZ3      LYS  32  53.062  27.402   6.529
 1108    H    ARG  33           HN       ARG  33  47.076  27.681   4.380
 1109    HA   ARG  33           HA       ARG  33  46.917  26.737   1.584
 1110    HB2  ARG  33           HB2      ARG  33  46.492  29.602   2.181
 1111    HB3  ARG  33           HB1      ARG  33  45.604  28.529   1.097
 1112    HG2  ARG  33           HG2      ARG  33  44.674  27.404   3.190
 1113    HG3  ARG  33           HG1      ARG  33  45.341  28.759   4.099
 1114    HD2  ARG  33           HD2      ARG  33  43.099  29.388   3.638
 1115    HD3  ARG  33           HD1      ARG  33  44.070  30.276   2.468
 1116    HE   ARG  33           HE       ARG  33  43.297  27.813   1.327
 1117   HH11  ARG  33          HH11      ARG  33  41.946  30.852   2.367
 1118   HH12  ARG  33          HH12      ARG  33  40.652  30.804   1.226
 1119   HH21  ARG  33          HH21      ARG  33  41.593  27.778  -0.156
 1120   HH22  ARG  33          HH22      ARG  33  40.448  29.076  -0.195
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1   6.708  16.038  -0.816
    2    H2   MET   1           HT2      MET   1   5.020  16.105  -0.640
    3    H3   MET   1           HT3      MET   1   5.964  15.300   0.518
    4    HA   MET   1           HA       MET   1   7.095  17.515   0.919
    5    HB2  MET   1           HB2      MET   1   5.872  19.484   0.276
    6    HB3  MET   1           HB1      MET   1   6.088  18.514  -1.179
    7    HG2  MET   1           HG2      MET   1   3.800  17.574  -0.852
    8    HG3  MET   1           HG1      MET   1   3.590  18.635   0.540
    9    HE1  MET   1           HE1      MET   1   3.263  22.066  -0.625
   10    HE2  MET   1           HE2      MET   1   4.920  21.513  -0.396
   11    HE3  MET   1           HE3      MET   1   3.639  20.897   0.648
   12    H    PHE   2           HN       PHE   2   3.878  16.134   0.959
   13    HA   PHE   2           HA       PHE   2   3.014  17.366   3.381
   14    HB2  PHE   2           HB2      PHE   2   2.095  14.892   1.906
   15    HB3  PHE   2           HB1      PHE   2   1.310  15.498   3.364
   16    HD1  PHE   2           HD1      PHE   2   2.079  16.212  -0.176
   17    HD2  PHE   2           HD2      PHE   2   0.005  17.542   3.342
   18    HE1  PHE   2           HE1      PHE   2   0.813  17.849  -1.542
   19    HE2  PHE   2           HE2      PHE   2  -1.262  19.179   1.976
   20    HZ   PHE   2           HZ       PHE   2  -0.857  19.333  -0.466
   21    H    GLU   3           HN       GLU   3   4.843  14.465   2.608
   22    HA   GLU   3           HA       GLU   3   4.676  13.492   5.334
   23    HB2  GLU   3           HB2      GLU   3   6.182  12.425   2.943
   24    HB3  GLU   3           HB1      GLU   3   6.039  11.616   4.507
   25    HG2  GLU   3           HG2      GLU   3   3.575  11.609   4.271
   26    HG3  GLU   3           HG1      GLU   3   3.734  12.381   2.694
   27    HA   PRO   4           HA       PRO   4   8.361  15.858   6.411
   28    HB2  PRO   4           HB2      PRO   4   8.780  14.775   8.894
   29    HB3  PRO   4           HB1      PRO   4   7.565  16.024   8.561
   30    HG2  PRO   4           HG2      PRO   4   7.222  13.078   8.846
   31    HG3  PRO   4           HG1      PRO   4   6.202  14.398   9.447
   32    HD2  PRO   4           HD2      PRO   4   5.568  12.978   7.219
   33    HD3  PRO   4           HD1      PRO   4   5.143  14.695   7.406
   34    H    PHE   5           HN       PHE   5   8.130  12.387   6.389
   35    HA   PHE   5           HA       PHE   5  10.840  11.757   6.909
   36    HB2  PHE   5           HB2      PHE   5   9.696   9.809   6.998
   37    HB3  PHE   5           HB1      PHE   5   8.472  10.365   5.856
   38    HD1  PHE   5           HD1      PHE   5  11.877   8.926   6.168
   39    HD2  PHE   5           HD2      PHE   5   8.675   9.963   3.498
   40    HE1  PHE   5           HE1      PHE   5  12.981   7.653   4.348
   41    HE2  PHE   5           HE2      PHE   5   9.778   8.691   1.680
   42    HZ   PHE   5           HZ       PHE   5  11.931   7.534   2.104
   43    H    GLN   6           HN       GLN   6   9.113  12.686   3.976
   44    HA   GLN   6           HA       GLN   6  11.109  11.949   2.108
   45    HB2  GLN   6           HB2      GLN   6   8.759  12.532   1.532
   46    HB3  GLN   6           HB1      GLN   6   9.125  14.218   1.899
   47    HG2  GLN   6           HG2      GLN   6  10.778  14.320   0.150
   48    HG3  GLN   6           HG1      GLN   6  10.664  12.582  -0.127
   49   HE21  GLN   6          HE21      GLN   6  10.199  13.911  -2.394
   50   HE22  GLN   6          HE22      GLN   6   8.546  14.054  -2.742
   51    H    ILE   7           HN       ILE   7  10.532  14.922   3.892
   52    HA   ILE   7           HA       ILE   7  12.618  16.408   2.608
   53    HB   ILE   7           HB       ILE   7  12.022  18.183   3.918
   54   HG12  ILE   7          HG12      ILE   7  11.761  16.198   6.181
   55   HG13  ILE   7          HG11      ILE   7  12.947  17.480   6.001
   56   HG21  ILE   7          HG21      ILE   7   9.692  18.195   4.309
   57   HG22  ILE   7          HG22      ILE   7   9.664  16.481   4.729
   58   HG23  ILE   7          HG23      ILE   7   9.911  16.977   3.055
   59   HD11  ILE   7          HD11      ILE   7  10.009  17.721   6.645
   60   HD12  ILE   7          HD12      ILE   7  10.944  19.097   6.054
   61   HD13  ILE   7          HD13      ILE   7  11.385  18.312   7.571
   62    H    LEU   8           HN       LEU   8  12.500  14.309   5.424
   63    HA   LEU   8           HA       LEU   8  15.120  15.031   6.357
   64    HB2  LEU   8           HB2      LEU   8  13.397  14.210   7.900
   65    HB3  LEU   8           HB1      LEU   8  13.339  12.678   7.032
   66    HG   LEU   8           HG       LEU   8  15.730  12.297   7.575
   67   HD11  LEU   8          HD11      LEU   8  15.377  14.951   8.985
   68   HD12  LEU   8          HD12      LEU   8  16.607  14.499   7.806
   69   HD13  LEU   8          HD13      LEU   8  16.656  13.821   9.432
   70   HD21  LEU   8          HD21      LEU   8  13.969  12.919   9.967
   71   HD22  LEU   8          HD22      LEU   8  15.387  11.870   9.985
   72   HD23  LEU   8          HD23      LEU   8  13.963  11.412   9.049
   73    H    SER   9           HN       SER   9  13.716  12.558   4.312
   74    HA   SER   9           HA       SER   9  16.036  10.888   4.195
   75    HB2  SER   9           HB2      SER   9  13.788  10.038   3.653
   76    HB3  SER   9           HB1      SER   9  13.717  11.116   2.263
   77    HG   SER   9           HG       SER   9  14.769   8.701   2.401
   78    H    ILE  10           HN       ILE  10  14.692  13.424   2.083
   79    HA   ILE  10           HA       ILE  10  16.742  13.216   0.118
   80    HB   ILE  10           HB       ILE  10  14.406  14.306  -0.082
   81   HG12  ILE  10          HG12      ILE  10  15.387  16.056  -1.700
   82   HG13  ILE  10          HG11      ILE  10  16.968  15.461  -1.187
   83   HG21  ILE  10          HG21      ILE  10  14.225  16.625   0.449
   84   HG22  ILE  10          HG22      ILE  10  15.947  16.746   0.819
   85   HG23  ILE  10          HG23      ILE  10  14.875  15.846   1.888
   86   HD11  ILE  10          HD11      ILE  10  15.992  14.352  -3.267
   87   HD12  ILE  10          HD12      ILE  10  14.791  13.622  -2.202
   88   HD13  ILE  10          HD13      ILE  10  16.502  13.257  -1.984
   89    H    CYS  11           HN       CYS  11  16.396  15.074   3.115
   90    HA   CYS  11           HA       CYS  11  18.619  16.796   2.641
   91    HB2  CYS  11           HB2      CYS  11  16.894  16.085   4.963
   92    HB3  CYS  11           HB1      CYS  11  18.446  16.852   5.294
   93    HG   CYS  11           HG       CYS  11  17.674  18.968   4.158
   94    H    SER  12           HN       SER  12  18.242  13.983   4.833
   95    HA   SER  12           HA       SER  12  20.944  13.814   5.549
   96    HB2  SER  12           HB2      SER  12  19.177  12.641   6.777
   97    HB3  SER  12           HB1      SER  12  18.883  11.604   5.386
   98    HG   SER  12           HG       SER  12  20.820  11.474   7.295
   99    H    PHE  13           HN       PHE  13  19.158  12.274   2.887
  100    HA   PHE  13           HA       PHE  13  21.178  10.584   1.963
  101    HB2  PHE  13           HB2      PHE  13  18.954  10.386   1.082
  102    HB3  PHE  13           HB1      PHE  13  18.983  12.044   0.484
  103    HD1  PHE  13           HD1      PHE  13  20.581   8.698   0.094
  104    HD2  PHE  13           HD2      PHE  13  19.906  12.575  -1.628
  105    HE1  PHE  13           HE1      PHE  13  21.564   7.919  -2.046
  106    HE2  PHE  13           HE2      PHE  13  20.888  11.796  -3.767
  107    HZ   PHE  13           HZ       PHE  13  21.718   9.469  -3.978
  108    H    ILE  14           HN       ILE  14  20.451  13.950   1.018
  109    HA   ILE  14           HA       ILE  14  22.511  14.226  -0.875
  110    HB   ILE  14           HB       ILE  14  21.125  16.236   0.900
  111   HG12  ILE  14          HG12      ILE  14  19.952  14.909  -1.002
  112   HG13  ILE  14          HG11      ILE  14  19.765  16.662  -0.982
  113   HG21  ILE  14          HG21      ILE  14  23.252  16.611  -1.216
  114   HG22  ILE  14          HG22      ILE  14  23.180  17.299   0.407
  115   HG23  ILE  14          HG23      ILE  14  22.087  17.885  -0.846
  116   HD11  ILE  14          HD11      ILE  14  22.002  15.371  -2.545
  117   HD12  ILE  14          HD12      ILE  14  21.282  16.966  -2.760
  118   HD13  ILE  14          HD13      ILE  14  20.387  15.525  -3.235
  119    H    LEU  15           HN       LEU  15  22.476  14.939   2.601
  120    HA   LEU  15           HA       LEU  15  25.145  15.909   2.738
  121    HB2  LEU  15           HB2      LEU  15  23.290  14.770   4.836
  122    HB3  LEU  15           HB1      LEU  15  24.881  15.432   5.209
  123    HG   LEU  15           HG       LEU  15  22.774  16.989   3.689
  124   HD11  LEU  15          HD11      LEU  15  23.407  17.012   6.657
  125   HD12  LEU  15          HD12      LEU  15  21.905  16.451   5.924
  126   HD13  LEU  15          HD13      LEU  15  22.345  18.156   5.838
  127   HD21  LEU  15          HD21      LEU  15  25.395  17.666   5.048
  128   HD22  LEU  15          HD22      LEU  15  24.222  18.899   4.588
  129   HD23  LEU  15          HD23      LEU  15  24.970  17.891   3.352
  130    H    SER  16           HN       SER  16  23.755  12.731   2.804
  131    HA   SER  16           HA       SER  16  26.011  11.341   3.885
  132    HB2  SER  16           HB2      SER  16  23.787  10.337   3.934
  133    HB3  SER  16           HB1      SER  16  23.709  10.363   2.175
  134    HG   SER  16           HG       SER  16  24.749   8.548   2.214
  135    H    ALA  17           HN       ALA  17  24.791  11.866   0.582
  136    HA   ALA  17           HA       ALA  17  26.831  10.445  -0.747
  137    HB1  ALA  17           HB1      ALA  17  24.552  11.505  -1.602
  138    HB2  ALA  17           HB2      ALA  17  25.909  11.259  -2.701
  139    HB3  ALA  17           HB3      ALA  17  25.606  12.857  -2.019
  140    H    LEU  18           HN       LEU  18  26.553  13.845   0.256
  141    HA   LEU  18           HA       LEU  18  28.938  14.732  -0.983
  142    HB2  LEU  18           HB2      LEU  18  27.334  15.759   1.356
  143    HB3  LEU  18           HB1      LEU  18  28.770  16.584   0.751
  144    HG   LEU  18           HG       LEU  18  26.485  15.824  -1.073
  145   HD11  LEU  18          HD11      LEU  18  26.903  18.498   0.292
  146   HD12  LEU  18          HD12      LEU  18  25.716  17.306   0.820
  147   HD13  LEU  18          HD13      LEU  18  25.574  18.044  -0.775
  148   HD21  LEU  18          HD21      LEU  18  28.533  16.359  -2.229
  149   HD22  LEU  18          HD22      LEU  18  28.815  17.761  -1.196
  150   HD23  LEU  18          HD23      LEU  18  27.489  17.774  -2.359
  151    H    HIS  19           HN       HIS  19  28.270  13.598   2.351
  152    HA   HIS  19           HA       HIS  19  30.777  14.003   3.440
  153    HB2  HIS  19           HB2      HIS  19  28.709  13.239   4.648
  154    HB3  HIS  19           HB1      HIS  19  28.981  11.629   3.985
  155    HD2  HIS  19           HD2      HIS  19  30.501  10.095   5.695
  156    HE1  HIS  19           HE1      HIS  19  32.542  13.221   7.667
  157    HE2  HIS  19           HE2      HIS  19  32.222  10.704   7.562
  158    H    PHE  20           HN       PHE  20  29.560  11.163   1.684
  159    HA   PHE  20           HA       PHE  20  31.996   9.704   1.851
  160    HB2  PHE  20           HB2      PHE  20  29.396   9.351   0.657
  161    HB3  PHE  20           HB1      PHE  20  30.659   8.900  -0.488
  162    HD1  PHE  20           HD1      PHE  20  29.120   8.149   2.774
  163    HD2  PHE  20           HD2      PHE  20  32.244   7.107   0.019
  164    HE1  PHE  20           HE1      PHE  20  29.502   6.030   4.009
  165    HE2  PHE  20           HE2      PHE  20  32.630   4.988   1.250
  166    HZ   PHE  20           HZ       PHE  20  31.258   4.440   3.246
  167    H    MET  21           HN       MET  21  30.700  12.040  -0.455
  168    HA   MET  21           HA       MET  21  32.567  11.671  -2.524
  169    HB2  MET  21           HB2      MET  21  30.500  13.017  -2.740
  170    HB3  MET  21           HB1      MET  21  31.199  14.238  -1.676
  171    HG2  MET  21           HG2      MET  21  31.531  14.918  -3.996
  172    HG3  MET  21           HG1      MET  21  33.091  14.501  -3.288
  173    HE1  MET  21           HE1      MET  21  33.166  14.818  -6.046
  174    HE2  MET  21           HE2      MET  21  33.654  13.339  -6.871
  175    HE3  MET  21           HE3      MET  21  34.506  13.852  -5.417
  176    H    ALA  22           HN       ALA  22  32.620  13.894   0.248
  177    HA   ALA  22           HA       ALA  22  35.095  15.112  -0.356
  178    HB1  ALA  22           HB1      ALA  22  33.712  16.226   1.200
  179    HB2  ALA  22           HB2      ALA  22  35.084  15.642   2.142
  180    HB3  ALA  22           HB3      ALA  22  33.542  14.787   2.205
  181    H    TRP  23           HN       TRP  23  34.255  12.258   1.551
  182    HA   TRP  23           HA       TRP  23  36.879  11.759   2.547
  183    HB2  TRP  23           HB2      TRP  23  34.372  10.153   2.239
  184    HB3  TRP  23           HB1      TRP  23  35.867   9.393   2.783
  185    HD1  TRP  23           HD1      TRP  23  34.039   9.152   4.953
  186    HE1  TRP  23           HE1      TRP  23  34.014  10.580   7.083
  187    HE3  TRP  23           HE3      TRP  23  36.468  13.391   3.296
  188    HZ2  TRP  23           HZ2      TRP  23  34.888  13.111   7.980
  189    HZ3  TRP  23           HZ3      TRP  23  36.843  15.271   4.842
  190    HH2  TRP  23           HH2      TRP  23  36.057  15.146   7.179
  191    H    THR  24           HN       THR  24  35.147  10.386  -0.250
  192    HA   THR  24           HA       THR  24  37.105   8.650  -1.128
  193    HB   THR  24           HB       THR  24  36.122   9.481  -3.480
  194    HG1  THR  24           HG1      THR  24  34.387  10.688  -3.264
  195   HG21  THR  24          HG21      THR  24  34.362   7.857  -3.185
  196   HG22  THR  24          HG22      THR  24  34.400   8.063  -1.434
  197   HG23  THR  24          HG23      THR  24  35.755   7.297  -2.261
  198    H    ILE  25           HN       ILE  25  36.654  12.052  -2.163
  199    HA   ILE  25           HA       ILE  25  39.051  12.157  -3.669
  200    HB   ILE  25           HB       ILE  25  36.922  13.812  -3.426
  201   HG12  ILE  25          HG12      ILE  25  38.459  15.502  -4.636
  202   HG13  ILE  25          HG11      ILE  25  39.730  14.298  -4.412
  203   HG21  ILE  25          HG21      ILE  25  37.825  14.595  -1.186
  204   HG22  ILE  25          HG22      ILE  25  37.547  15.870  -2.365
  205   HG23  ILE  25          HG23      ILE  25  39.185  15.294  -2.063
  206   HD11  ILE  25          HD11      ILE  25  37.060  13.726  -5.727
  207   HD12  ILE  25          HD12      ILE  25  38.435  12.630  -5.616
  208   HD13  ILE  25          HD13      ILE  25  38.543  14.083  -6.611
  209    H    GLY  26           HN       GLY  26  38.353  12.665  -0.291
  210    HA2  GLY  26           HA2      GLY  26  40.693  13.998   0.522
  211    HA3  GLY  26           HA1      GLY  26  39.731  12.943   1.552
  212    H    HIS  27           HN       HIS  27  39.984  10.509   0.439
  213    HA   HIS  27           HA       HIS  27  42.575   9.672   1.244
  214    HB2  HIS  27           HB2      HIS  27  40.636   8.195   1.424
  215    HB3  HIS  27           HB1      HIS  27  40.461   8.185  -0.331
  216    HD2  HIS  27           HD2      HIS  27  42.822   6.640   2.410
  217    HE1  HIS  27           HE1      HIS  27  43.904   5.015  -1.334
  218    HE2  HIS  27           HE2      HIS  27  44.293   4.872   1.171
  219    H    LEU  28           HN       LEU  28  41.127  10.407  -1.863
  220    HA   LEU  28           HA       LEU  28  43.256   9.321  -3.449
  221    HB2  LEU  28           HB2      LEU  28  41.022  11.263  -4.056
  222    HB3  LEU  28           HB1      LEU  28  42.179  10.707  -5.267
  223    HG   LEU  28           HG       LEU  28  40.623   8.750  -3.576
  224   HD11  LEU  28          HD11      LEU  28  39.037   8.592  -5.498
  225   HD12  LEU  28          HD12      LEU  28  39.817   9.998  -6.220
  226   HD13  LEU  28          HD13      LEU  28  38.963  10.156  -4.685
  227   HD21  LEU  28          HD21      LEU  28  42.619   7.974  -4.872
  228   HD22  LEU  28          HD22      LEU  28  41.855   8.566  -6.345
  229   HD23  LEU  28          HD23      LEU  28  41.120   7.242  -5.441
  230    H    ASN  29           HN       ASN  29  42.670  12.350  -1.833
  231    HA   ASN  29           HA       ASN  29  44.365  14.045  -3.283
  232    HB2  ASN  29           HB2      ASN  29  42.807  14.815  -1.521
  233    HB3  ASN  29           HB1      ASN  29  43.832  14.059  -0.303
  234   HD21  ASN  29          HD21      ASN  29  43.284  16.976  -1.954
  235   HD22  ASN  29          HD22      ASN  29  44.765  17.729  -1.610
  236    H    GLN  30           HN       GLN  30  46.441  13.728  -3.737
  237    HA   GLN  30           HA       GLN  30  48.178  12.569  -1.639
  238    HB2  GLN  30           HB2      GLN  30  47.853  11.010  -3.528
  239    HB3  GLN  30           HB1      GLN  30  48.443  12.246  -4.639
  240    HG2  GLN  30           HG2      GLN  30  50.250  10.685  -4.051
  241    HG3  GLN  30           HG1      GLN  30  50.598  12.298  -3.430
  242   HE21  GLN  30          HE21      GLN  30  51.861  11.622  -1.601
  243   HE22  GLN  30          HE22      GLN  30  51.199  10.737  -0.313
  244    H    ILE  31           HN       ILE  31  49.677  13.933  -0.934
  245    HA   ILE  31           HA       ILE  31  50.056  16.530  -1.823
  246    HB   ILE  31           HB       ILE  31  52.270  16.390  -0.611
  247   HG12  ILE  31          HG12      ILE  31  51.352  13.571   0.015
  248   HG13  ILE  31          HG11      ILE  31  52.571  13.932  -1.209
  249   HG21  ILE  31          HG21      ILE  31  50.190  16.989   0.554
  250   HG22  ILE  31          HG22      ILE  31  51.206  15.991   1.594
  251   HG23  ILE  31          HG23      ILE  31  49.811  15.280   0.781
  252   HD11  ILE  31          HD11      ILE  31  52.775  14.842   1.673
  253   HD12  ILE  31          HD12      ILE  31  54.027  14.934   0.434
  254   HD13  ILE  31          HD13      ILE  31  53.521  13.365   1.061
  255    H    LYS  32           HN       LYS  32  51.411  17.536  -3.246
  256    HA   LYS  32           HA       LYS  32  53.470  16.066  -4.660
  257    HB2  LYS  32           HB2      LYS  32  52.519  16.439  -6.890
  258    HB3  LYS  32           HB1      LYS  32  51.452  15.424  -5.920
  259    HG2  LYS  32           HG2      LYS  32  50.058  17.370  -5.378
  260    HG3  LYS  32           HG1      LYS  32  51.140  18.417  -6.299
  261    HD2  LYS  32           HD2      LYS  32  50.636  17.143  -8.349
  262    HD3  LYS  32           HD1      LYS  32  49.556  16.091  -7.433
  263    HE2  LYS  32           HE2      LYS  32  48.131  18.006  -6.869
  264    HE3  LYS  32           HE1      LYS  32  49.226  19.093  -7.722
  265    HZ1  LYS  32           HZ1      LYS  32  47.697  18.679  -9.341
  266    HZ2  LYS  32           HZ2      LYS  32  47.360  17.105  -8.798
  267    HZ3  LYS  32           HZ3      LYS  32  48.788  17.421  -9.664
  268    H    ARG  33           HN       ARG  33  54.736  17.452  -6.074
  269    HA   ARG  33           HA       ARG  33  54.277  20.334  -5.804
  270    HB2  ARG  33           HB2      ARG  33  56.080  18.966  -4.129
  271    HB3  ARG  33           HB1      ARG  33  57.071  19.781  -5.341
  272    HG2  ARG  33           HG2      ARG  33  55.800  21.892  -4.882
  273    HG3  ARG  33           HG1      ARG  33  54.966  21.057  -3.572
  274    HD2  ARG  33           HD2      ARG  33  56.677  21.788  -2.277
  275    HD3  ARG  33           HD1      ARG  33  57.590  20.478  -3.019
  276    HE   ARG  33           HE       ARG  33  57.774  22.684  -4.727
  277   HH11  ARG  33          HH11      ARG  33  58.697  21.790  -1.484
  278   HH12  ARG  33          HH12      ARG  33  60.081  22.824  -1.466
  279   HH21  ARG  33          HH21      ARG  33  59.593  24.027  -4.677
  280   HH22  ARG  33          HH22      ARG  33  60.589  24.083  -3.260
  281    H1   MET   1           HT1      MET   1   9.494  -4.024   1.783
  282    H2   MET   1           HT2      MET   1   7.816  -4.134   1.550
  283    H3   MET   1           HT3      MET   1   8.468  -2.851   2.451
  284    HA   MET   1           HA       MET   1   9.723  -2.217   0.359
  285    HB2  MET   1           HB2      MET   1   8.818  -3.012  -1.724
  286    HB3  MET   1           HB1      MET   1   9.184  -4.432  -0.745
  287    HG2  MET   1           HG2      MET   1   6.795  -4.513  -0.030
  288    HG3  MET   1           HG1      MET   1   6.455  -3.153  -1.100
  289    HE1  MET   1           HE1      MET   1   6.657  -4.282  -4.553
  290    HE2  MET   1           HE2      MET   1   8.190  -3.788  -3.839
  291    HE3  MET   1           HE3      MET   1   6.698  -2.990  -3.346
  292    H    PHE   2           HN       PHE   2   6.427  -2.747   1.418
  293    HA   PHE   2           HA       PHE   2   5.289  -0.476   0.122
  294    HB2  PHE   2           HB2      PHE   2   4.400  -2.139   2.486
  295    HB3  PHE   2           HB1      PHE   2   3.440  -0.820   1.814
  296    HD1  PHE   2           HD1      PHE   2   4.861  -4.166   1.159
  297    HD2  PHE   2           HD2      PHE   2   2.360  -1.017  -0.348
  298    HE1  PHE   2           HE1      PHE   2   4.006  -5.688  -0.602
  299    HE2  PHE   2           HE2      PHE   2   1.505  -2.539  -2.110
  300    HZ   PHE   2           HZ       PHE   2   2.328  -4.875  -2.236
  301    H    GLU   3           HN       GLU   3   6.937  -0.996   3.183
  302    HA   GLU   3           HA       GLU   3   6.219   1.642   4.150
  303    HB2  GLU   3           HB2      GLU   3   7.998  -0.486   5.346
  304    HB3  GLU   3           HB1      GLU   3   7.517   1.014   6.144
  305    HG2  GLU   3           HG2      GLU   3   5.139   0.368   5.909
  306    HG3  GLU   3           HG1      GLU   3   5.636  -1.142   5.148
  307    HA   PRO   4           HA       PRO   4   9.877   3.372   2.160
  308    HB2  PRO   4           HB2      PRO   4   9.766   5.868   3.295
  309    HB3  PRO   4           HB1      PRO   4   8.750   5.363   1.930
  310    HG2  PRO   4           HG2      PRO   4   8.083   5.522   4.828
  311    HG3  PRO   4           HG1      PRO   4   7.107   5.969   3.418
  312    HD2  PRO   4           HD2      PRO   4   6.728   3.637   4.758
  313    HD3  PRO   4           HD1      PRO   4   6.443   3.789   3.011
  314    H    PHE   5           HN       PHE   5   9.324   3.238   5.592
  315    HA   PHE   5           HA       PHE   5  11.835   4.190   6.488
  316    HB2  PHE   5           HB2      PHE   5  10.512   4.042   8.313
  317    HB3  PHE   5           HB1      PHE   5   9.557   2.723   7.635
  318    HD1  PHE   5           HD1      PHE   5  12.708   3.570   9.402
  319    HD2  PHE   5           HD2      PHE   5  10.118   0.424   8.043
  320    HE1  PHE   5           HE1      PHE   5  13.974   1.935  10.771
  321    HE2  PHE   5           HE2      PHE   5  11.383  -1.209   9.411
  322    HZ   PHE   5           HZ       PHE   5  13.310  -0.455  10.777
  323    H    GLN   6           HN       GLN   6  10.724   1.029   5.380
  324    HA   GLN   6           HA       GLN   6  12.927  -0.494   6.298
  325    HB2  GLN   6           HB2      GLN   6  10.775  -1.444   5.483
  326    HB3  GLN   6           HB1      GLN   6  11.231  -0.982   3.844
  327    HG2  GLN   6           HG2      GLN   6  13.159  -2.426   3.893
  328    HG3  GLN   6           HG1      GLN   6  12.930  -2.757   5.610
  329   HE21  GLN   6          HE21      GLN   6  12.984  -5.039   4.230
  330   HE22  GLN   6          HE22      GLN   6  11.433  -5.658   3.926
  331    H    ILE   7           HN       ILE   7  12.347   1.245   3.292
  332    HA   ILE   7           HA       ILE   7  14.749   0.349   2.011
  333    HB   ILE   7           HB       ILE   7  14.113   1.576   0.192
  334   HG12  ILE   7          HG12      ILE   7  13.286   3.721   2.152
  335   HG13  ILE   7          HG11      ILE   7  14.601   3.769   0.989
  336   HG21  ILE   7          HG21      ILE   7  11.764   1.570  -0.049
  337   HG22  ILE   7          HG22      ILE   7  11.499   1.941   1.656
  338   HG23  ILE   7          HG23      ILE   7  12.074   0.343   1.180
  339   HD11  ILE   7          HD11      ILE   7  11.631   3.914   0.469
  340   HD12  ILE   7          HD12      ILE   7  12.779   3.523  -0.813
  341   HD13  ILE   7          HD13      ILE   7  12.879   5.074   0.021
  342    H    LEU   8           HN       LEU   8  13.959   3.058   4.113
  343    HA   LEU   8           HA       LEU   8  16.437   4.433   3.642
  344    HB2  LEU   8           HB2      LEU   8  14.410   5.648   4.300
  345    HB3  LEU   8           HB1      LEU   8  14.353   4.748   5.813
  346    HG   LEU   8           HG       LEU   8  16.570   5.676   6.431
  347   HD11  LEU   8          HD11      LEU   8  16.239   7.067   3.765
  348   HD12  LEU   8          HD12      LEU   8  17.601   6.100   4.327
  349   HD13  LEU   8          HD13      LEU   8  17.312   7.695   5.017
  350   HD21  LEU   8          HD21      LEU   8  14.497   7.750   5.652
  351   HD22  LEU   8          HD22      LEU   8  15.783   7.985   6.835
  352   HD23  LEU   8          HD23      LEU   8  14.503   6.814   7.147
  353    H    SER   9           HN       SER   9  15.167   2.137   5.966
  354    HA   SER   9           HA       SER   9  17.307   2.367   7.845
  355    HB2  SER   9           HB2      SER   9  15.112   1.438   8.468
  356    HB3  SER   9           HB1      SER   9  15.379   0.079   7.379
  357    HG   SER   9           HG       SER   9  16.158   0.336   9.888
  358    H    ILE  10           HN       ILE  10  16.586   0.116   5.179
  359    HA   ILE  10           HA       ILE  10  18.910  -1.482   5.575
  360    HB   ILE  10           HB       ILE  10  16.755  -2.048   4.261
  361   HG12  ILE  10          HG12      ILE  10  18.161  -3.439   2.607
  362   HG13  ILE  10          HG11      ILE  10  19.566  -2.681   3.355
  363   HG21  ILE  10          HG21      ILE  10  16.711  -1.503   1.938
  364   HG22  ILE  10          HG22      ILE  10  18.348  -0.850   1.987
  365   HG23  ILE  10          HG23      ILE  10  17.032   0.008   2.783
  366   HD11  ILE  10          HD11      ILE  10  18.857  -4.919   4.352
  367   HD12  ILE  10          HD12      ILE  10  17.428  -4.090   4.966
  368   HD13  ILE  10          HD13      ILE  10  19.034  -3.593   5.501
  369    H    CYS  11           HN       CYS  11  18.245   1.467   3.714
  370    HA   CYS  11           HA       CYS  11  20.666   1.395   2.209
  371    HB2  CYS  11           HB2      CYS  11  18.513   3.380   2.761
  372    HB3  CYS  11           HB1      CYS  11  20.054   3.985   2.151
  373    HG   CYS  11           HG       CYS  11  19.690   2.782  -0.038
  374    H    SER  12           HN       SER  12  19.661   3.445   4.980
  375    HA   SER  12           HA       SER  12  22.171   4.586   5.417
  376    HB2  SER  12           HB2      SER  12  20.121   5.476   6.420
  377    HB3  SER  12           HB1      SER  12  19.967   4.032   7.416
  378    HG   SER  12           HG       SER  12  21.534   6.234   7.746
  379    H    PHE  13           HN       PHE  13  20.719   1.631   6.768
  380    HA   PHE  13           HA       PHE  13  22.697   1.022   8.637
  381    HB2  PHE  13           HB2      PHE  13  20.648  -0.224   8.614
  382    HB3  PHE  13           HB1      PHE  13  20.936  -0.772   6.963
  383    HD1  PHE  13           HD1      PHE  13  22.250  -0.962  10.447
  384    HD2  PHE  13           HD2      PHE  13  22.249  -2.687   6.513
  385    HE1  PHE  13           HE1      PHE  13  23.502  -2.923  11.305
  386    HE2  PHE  13           HE2      PHE  13  23.500  -4.647   7.370
  387    HZ   PHE  13           HZ       PHE  13  24.127  -4.767   9.767
  388    H    ILE  14           HN       ILE  14  22.467   0.041   5.211
  389    HA   ILE  14           HA       ILE  14  24.833  -1.472   5.127
  390    HB   ILE  14           HB       ILE  14  23.364   0.087   3.000
  391   HG12  ILE  14          HG12      ILE  14  22.412  -2.013   4.198
  392   HG13  ILE  14          HG11      ILE  14  22.390  -1.987   2.436
  393   HG21  ILE  14          HG21      ILE  14  25.845  -1.632   2.825
  394   HG22  ILE  14          HG22      ILE  14  25.569  -0.030   2.142
  395   HG23  ILE  14          HG23      ILE  14  24.762  -1.434   1.446
  396   HD11  ILE  14          HD11      ILE  14  24.727  -3.179   3.927
  397   HD12  ILE  14          HD12      ILE  14  24.209  -3.474   2.268
  398   HD13  ILE  14          HD13      ILE  14  23.275  -4.126   3.614
  399    H    LEU  15           HN       LEU  15  24.281   1.971   4.430
  400    HA   LEU  15           HA       LEU  15  26.968   2.565   3.728
  401    HB2  LEU  15           HB2      LEU  15  24.685   4.299   4.692
  402    HB3  LEU  15           HB1      LEU  15  26.245   4.949   4.192
  403    HG   LEU  15           HG       LEU  15  24.586   3.131   2.428
  404   HD11  LEU  15          HD11      LEU  15  24.705   6.164   2.484
  405   HD12  LEU  15          HD12      LEU  15  23.302   5.175   2.888
  406   HD13  LEU  15          HD13      LEU  15  23.912   5.202   1.235
  407   HD21  LEU  15          HD21      LEU  15  26.992   4.925   2.019
  408   HD22  LEU  15          HD22      LEU  15  26.036   4.302   0.673
  409   HD23  LEU  15          HD23      LEU  15  26.881   3.186   1.744
  410    H    SER  16           HN       SER  16  25.285   2.344   6.762
  411    HA   SER  16           HA       SER  16  27.188   3.744   8.367
  412    HB2  SER  16           HB2      SER  16  24.904   3.396   9.150
  413    HB3  SER  16           HB1      SER  16  25.128   1.650   9.106
  414    HG   SER  16           HG       SER  16  25.967   1.824  11.013
  415    H    ALA  17           HN       ALA  17  26.596   0.295   7.716
  416    HA   ALA  17           HA       ALA  17  28.691  -0.705   9.312
  417    HB1  ALA  17           HB1      ALA  17  26.701  -1.905   8.030
  418    HB2  ALA  17           HB2      ALA  17  28.194  -2.766   8.402
  419    HB3  ALA  17           HB3      ALA  17  27.932  -2.111   6.786
  420    H    LEU  18           HN       LEU  18  28.573   0.316   5.905
  421    HA   LEU  18           HA       LEU  18  31.205  -0.490   5.249
  422    HB2  LEU  18           HB2      LEU  18  29.335   1.572   4.085
  423    HB3  LEU  18           HB1      LEU  18  30.926   1.234   3.400
  424    HG   LEU  18           HG       LEU  18  28.919  -0.963   3.924
  425   HD11  LEU  18          HD11      LEU  18  29.354   0.508   1.310
  426   HD12  LEU  18          HD12      LEU  18  27.986   0.806   2.382
  427   HD13  LEU  18          HD13      LEU  18  28.186  -0.775   1.626
  428   HD21  LEU  18          HD21      LEU  18  31.175  -1.748   3.585
  429   HD22  LEU  18          HD22      LEU  18  31.409  -0.654   2.222
  430   HD23  LEU  18          HD23      LEU  18  30.307  -2.022   2.074
  431    H    HIS  19           HN       HIS  19  29.878   2.664   6.321
  432    HA   HIS  19           HA       HIS  19  32.192   4.164   6.178
  433    HB2  HIS  19           HB2      HIS  19  29.886   4.990   6.747
  434    HB3  HIS  19           HB1      HIS  19  30.113   4.346   8.371
  435    HD2  HIS  19           HD2      HIS  19  31.167   6.254  10.054
  436    HE1  HIS  19           HE1      HIS  19  33.135   8.608   7.153
  437    HE2  HIS  19           HE2      HIS  19  32.598   8.396   9.626
  438    H    PHE  20           HN       PHE  20  31.022   2.174   8.886
  439    HA   PHE  20           HA       PHE  20  33.249   2.708  10.568
  440    HB2  PHE  20           HB2      PHE  20  30.866   1.087  10.664
  441    HB3  PHE  20           HB1      PHE  20  32.257   0.163  11.232
  442    HD1  PHE  20           HD1      PHE  20  30.123   3.103  11.842
  443    HD2  PHE  20           HD2      PHE  20  33.552   0.892  13.178
  444    HE1  PHE  20           HE1      PHE  20  30.079   4.341  13.993
  445    HE2  PHE  20           HE2      PHE  20  33.514   2.126  15.331
  446    HZ   PHE  20           HZ       PHE  20  31.772   3.860  15.754
  447    H    MET  21           HN       MET  21  32.586   0.268   8.106
  448    HA   MET  21           HA       MET  21  34.731  -1.467   8.642
  449    HB2  MET  21           HB2      MET  21  32.869  -1.995   7.096
  450    HB3  MET  21           HB1      MET  21  33.493  -0.803   5.958
  451    HG2  MET  21           HG2      MET  21  34.276  -3.022   5.303
  452    HG3  MET  21           HG1      MET  21  35.647  -2.071   5.871
  453    HE1  MET  21           HE1      MET  21  36.216  -4.771   5.552
  454    HE2  MET  21           HE2      MET  21  36.697  -5.532   7.068
  455    HE3  MET  21           HE3      MET  21  37.333  -3.945   6.646
  456    H    ALA  22           HN       ALA  22  34.532   1.329   6.447
  457    HA   ALA  22           HA       ALA  22  37.176   1.168   5.477
  458    HB1  ALA  22           HB1      ALA  22  35.665   2.495   4.242
  459    HB2  ALA  22           HB2      ALA  22  36.795   3.639   4.965
  460    HB3  ALA  22           HB3      ALA  22  35.190   3.425   5.665
  461    H    TRP  23           HN       TRP  23  35.758   2.848   8.243
  462    HA   TRP  23           HA       TRP  23  38.115   4.256   9.003
  463    HB2  TRP  23           HB2      TRP  23  35.556   3.494  10.354
  464    HB3  TRP  23           HB1      TRP  23  36.856   4.266  11.261
  465    HD1  TRP  23           HD1      TRP  23  34.672   6.090  11.332
  466    HE1  TRP  23           HE1      TRP  23  34.424   8.218   9.919
  467    HE3  TRP  23           HE3      TRP  23  37.742   4.959   7.342
  468    HZ2  TRP  23           HZ2      TRP  23  35.373   9.301   7.497
  469    HZ3  TRP  23           HZ3      TRP  23  38.027   6.589   5.517
  470    HH2  TRP  23           HH2      TRP  23  36.850   8.756   5.578
  471    H    THR  24           HN       THR  24  36.757   1.182  10.195
  472    HA   THR  24           HA       THR  24  38.663   0.604  12.101
  473    HB   THR  24           HB       THR  24  38.176  -1.862  11.166
  474    HG1  THR  24           HG1      THR  24  36.552  -1.912   9.796
  475   HG21  THR  24          HG21      THR  24  36.243  -1.901  12.609
  476   HG22  THR  24          HG22      THR  24  36.004  -0.165  12.417
  477   HG23  THR  24          HG23      THR  24  37.400  -0.768  13.309
  478    H    ILE  25           HN       ILE  25  38.716  -0.421   8.669
  479    HA   ILE  25           HA       ILE  25  41.332  -1.499   8.787
  480    HB   ILE  25           HB       ILE  25  39.363  -1.580   6.932
  481   HG12  ILE  25          HG12      ILE  25  41.238  -2.475   5.394
  482   HG13  ILE  25          HG11      ILE  25  42.330  -2.069   6.720
  483   HG21  ILE  25          HG21      ILE  25  39.944   0.796   6.254
  484   HG22  ILE  25          HG22      ILE  25  39.992  -0.382   4.950
  485   HG23  ILE  25          HG23      ILE  25  41.492   0.176   5.687
  486   HD11  ILE  25          HD11      ILE  25  39.879  -3.826   7.016
  487   HD12  ILE  25          HD12      ILE  25  41.105  -3.512   8.243
  488   HD13  ILE  25          HD13      ILE  25  41.518  -4.440   6.802
  489    H    GLY  26           HN       GLY  26  40.128   1.732   8.235
  490    HA2  GLY  26           HA2      GLY  26  42.416   2.947   7.138
  491    HA3  GLY  26           HA1      GLY  26  41.198   3.780   8.099
  492    H    HIS  27           HN       HIS  27  41.399   2.674  10.538
  493    HA   HIS  27           HA       HIS  27  43.724   3.881  11.630
  494    HB2  HIS  27           HB2      HIS  27  41.652   3.702  12.911
  495    HB3  HIS  27           HB1      HIS  27  41.775   1.942  12.893
  496    HD2  HIS  27           HD2      HIS  27  43.482   5.003  14.678
  497    HE1  HIS  27           HE1      HIS  27  45.020   1.459  16.381
  498    HE2  HIS  27           HE2      HIS  27  44.964   3.991  16.575
  499    H    LEU  28           HN       LEU  28  42.898   0.590  10.747
  500    HA   LEU  28           HA       LEU  28  45.155  -0.637  12.019
  501    HB2  LEU  28           HB2      LEU  28  43.248  -1.568   9.867
  502    HB3  LEU  28           HB1      LEU  28  44.534  -2.581  10.526
  503    HG   LEU  28           HG       LEU  28  42.536  -1.215  12.331
  504   HD11  LEU  28          HD11      LEU  28  41.288  -3.380  12.323
  505   HD12  LEU  28          HD12      LEU  28  42.311  -3.932  10.997
  506   HD13  LEU  28          HD13      LEU  28  41.229  -2.559  10.763
  507   HD21  LEU  28          HD21      LEU  28  44.639  -2.176  13.291
  508   HD22  LEU  28          HD22      LEU  28  44.194  -3.743  12.621
  509   HD23  LEU  28          HD23      LEU  28  43.195  -3.003  13.871
  510    H    ASN  29           HN       ASN  29  44.593   0.925   8.957
  511    HA   ASN  29           HA       ASN  29  46.664  -0.186   7.430
  512    HB2  ASN  29           HB2      ASN  29  44.911   1.306   6.519
  513    HB3  ASN  29           HB1      ASN  29  45.637   2.663   7.378
  514   HD21  ASN  29          HD21      ASN  29  45.657   1.007   4.414
  515   HD22  ASN  29          HD22      ASN  29  47.124   1.611   3.810
  516    H    GLN  30           HN       GLN  30  48.747  -0.291   7.944
  517    HA   GLN  30           HA       GLN  30  49.985   2.043   9.277
  518    HB2  GLN  30           HB2      GLN  30  49.836   0.094  10.789
  519    HB3  GLN  30           HB1      GLN  30  50.719  -0.877   9.611
  520    HG2  GLN  30           HG2      GLN  30  52.244  -0.029  11.344
  521    HG3  GLN  30           HG1      GLN  30  52.636   0.676   9.776
  522   HE21  GLN  30          HE21      GLN  30  53.501   2.676  10.581
  523   HE22  GLN  30          HE22      GLN  30  52.549   3.814  11.404
  524    H    ILE  31           HN       ILE  31  51.465   3.018   8.070
  525    HA   ILE  31           HA       ILE  31  52.236   2.263   5.519
  526    HB   ILE  31           HB       ILE  31  54.189   3.826   5.881
  527   HG12  ILE  31          HG12      ILE  31  52.916   4.227   8.600
  528   HG13  ILE  31          HG11      ILE  31  54.351   3.233   8.354
  529   HG21  ILE  31          HG21      ILE  31  52.008   4.636   5.089
  530   HG22  ILE  31          HG22      ILE  31  52.734   5.811   6.185
  531   HG23  ILE  31          HG23      ILE  31  51.436   4.760   6.753
  532   HD11  ILE  31          HD11      ILE  31  54.151   6.126   7.482
  533   HD12  ILE  31          HD12      ILE  31  55.597   5.117   7.506
  534   HD13  ILE  31          HD13      ILE  31  54.847   5.616   9.021
  535    H    LYS  32           HN       LYS  32  53.902   1.108   4.643
  536    HA   LYS  32           HA       LYS  32  56.019   0.029   6.299
  537    HB2  LYS  32           HB2      LYS  32  55.499  -2.322   5.823
  538    HB3  LYS  32           HB1      LYS  32  54.192  -1.567   6.735
  539    HG2  LYS  32           HG2      LYS  32  52.918  -1.222   4.664
  540    HG3  LYS  32           HG1      LYS  32  54.234  -1.924   3.722
  541    HD2  LYS  32           HD2      LYS  32  53.966  -4.058   4.929
  542    HD3  LYS  32           HD1      LYS  32  52.651  -3.361   5.875
  543    HE2  LYS  32           HE2      LYS  32  51.342  -3.001   3.834
  544    HE3  LYS  32           HE1      LYS  32  52.663  -3.636   2.855
  545    HZ1  LYS  32           HZ1      LYS  32  51.398  -5.497   3.108
  546    HZ2  LYS  32           HZ2      LYS  32  50.825  -5.053   4.645
  547    HZ3  LYS  32           HZ3      LYS  32  52.402  -5.659   4.465
  548    H    ARG  33           HN       ARG  33  57.633  -1.122   5.034
  549    HA   ARG  33           HA       ARG  33  57.412  -0.870   2.124
  550    HB2  ARG  33           HB2      ARG  33  58.768   1.053   3.670
  551    HB3  ARG  33           HB1      ARG  33  60.021   0.041   2.948
  552    HG2  ARG  33           HG2      ARG  33  58.898   0.328   0.727
  553    HG3  ARG  33           HG1      ARG  33  57.778   1.461   1.483
  554    HD2  ARG  33           HD2      ARG  33  59.308   3.039   0.930
  555    HD3  ARG  33           HD1      ARG  33  60.205   2.435   2.319
  556    HE   ARG  33           HE       ARG  33  60.884   0.827   0.133
  557   HH11  ARG  33          HH11      ARG  33  61.156   4.158   1.130
  558   HH12  ARG  33          HH12      ARG  33  62.611   4.431   0.236
  559   HH21  ARG  33          HH21      ARG  33  62.788   1.212  -1.026
  560   HH22  ARG  33          HH22      ARG  33  63.531   2.777  -0.978
  561    H1   MET   1           HT1      MET   1   9.617  -0.907  22.149
  562    H2   MET   1           HT2      MET   1   7.993  -1.400  22.100
  563    H3   MET   1           HT3      MET   1   8.616  -0.398  20.879
  564    HA   MET   1           HA       MET   1  10.235  -2.264  20.381
  565    HB2  MET   1           HB2      MET   1   9.596  -4.469  21.101
  566    HB3  MET   1           HB1      MET   1   9.668  -3.458  22.542
  567    HG2  MET   1           HG2      MET   1   7.199  -3.125  22.392
  568    HG3  MET   1           HG1      MET   1   7.162  -4.223  21.014
  569    HE1  MET   1           HE1      MET   1   7.793  -7.611  22.181
  570    HE2  MET   1           HE2      MET   1   9.237  -6.662  21.832
  571    HE3  MET   1           HE3      MET   1   7.770  -6.402  20.889
  572    H    PHE   2           HN       PHE   2   6.779  -1.737  20.590
  573    HA   PHE   2           HA       PHE   2   6.079  -3.177  18.230
  574    HB2  PHE   2           HB2      PHE   2   4.678  -0.994  19.785
  575    HB3  PHE   2           HB1      PHE   2   3.963  -1.796  18.385
  576    HD1  PHE   2           HD1      PHE   2   5.148  -2.248  21.855
  577    HD2  PHE   2           HD2      PHE   2   3.220  -4.102  18.494
  578    HE1  PHE   2           HE1      PHE   2   4.438  -4.133  23.301
  579    HE2  PHE   2           HE2      PHE   2   2.510  -5.987  19.940
  580    HZ   PHE   2           HZ       PHE   2   3.119  -6.003  22.345
  581    H    GLU   3           HN       GLU   3   7.171   0.099  18.883
  582    HA   GLU   3           HA       GLU   3   6.563   0.965  16.183
  583    HB2  GLU   3           HB2      GLU   3   7.924   2.407  18.461
  584    HB3  GLU   3           HB1      GLU   3   7.470   3.133  16.918
  585    HG2  GLU   3           HG2      GLU   3   5.106   2.523  17.334
  586    HG3  GLU   3           HG1      GLU   3   5.569   1.838  18.891
  587    HA   PRO   4           HA       PRO   4  10.636  -0.415  14.819
  588    HB2  PRO   4           HB2      PRO   4  10.585   0.708  12.317
  589    HB3  PRO   4           HB1      PRO   4   9.751  -0.802  12.734
  590    HG2  PRO   4           HG2      PRO   4   8.659   1.958  12.492
  591    HG3  PRO   4           HG1      PRO   4   7.962   0.416  11.964
  592    HD2  PRO   4           HD2      PRO   4   7.159   1.661  14.240
  593    HD3  PRO   4           HD1      PRO   4   7.166  -0.109  14.075
  594    H    PHE   5           HN       PHE   5   9.544   2.888  14.880
  595    HA   PHE   5           HA       PHE   5  11.963   4.172  14.166
  596    HB2  PHE   5           HB2      PHE   5  10.362   5.768  14.174
  597    HB3  PHE   5           HB1      PHE   5   9.406   4.937  15.402
  598    HD1  PHE   5           HD1      PHE   5  12.307   7.182  14.844
  599    HD2  PHE   5           HD2      PHE   5   9.677   5.412  17.739
  600    HE1  PHE   5           HE1      PHE   5  13.177   8.729  16.576
  601    HE2  PHE   5           HE2      PHE   5  10.543   6.957  19.474
  602    HZ   PHE   5           HZ       PHE   5  12.287   8.630  18.893
  603    H    GLN   6           HN       GLN   6  10.743   2.881  17.212
  604    HA   GLN   6           HA       GLN   6  12.622   4.116  18.930
  605    HB2  GLN   6           HB2      GLN   6  10.542   2.969  19.677
  606    HB3  GLN   6           HB1      GLN   6  11.291   1.425  19.274
  607    HG2  GLN   6           HG2      GLN   6  13.040   1.764  20.894
  608    HG3  GLN   6           HG1      GLN   6  12.516   3.421  21.189
  609   HE21  GLN   6          HE21      GLN   6  12.568   2.047  23.476
  610   HE22  GLN   6          HE22      GLN   6  11.031   1.500  23.945
  611    H    ILE   7           HN       ILE   7  12.683   1.072  17.170
  612    HA   ILE   7           HA       ILE   7  15.162   0.174  18.292
  613    HB   ILE   7           HB       ILE   7  14.937  -1.711  17.023
  614   HG12  ILE   7          HG12      ILE   7  14.023   0.115  14.794
  615   HG13  ILE   7          HG11      ILE   7  15.501  -0.828  14.880
  616   HG21  ILE   7          HG21      ILE   7  12.663  -2.314  16.805
  617   HG22  ILE   7          HG22      ILE   7  12.174  -0.668  16.397
  618   HG23  ILE   7          HG23      ILE   7  12.659  -1.062  18.045
  619   HD11  ILE   7          HD11      ILE   7  12.678  -1.806  14.456
  620   HD12  ILE   7          HD12      ILE   7  13.971  -2.895  14.964
  621   HD13  ILE   7          HD13      ILE   7  14.085  -2.044  13.424
  622    H    LEU   8           HN       LEU   8  14.315   2.148  15.506
  623    HA   LEU   8           HA       LEU   8  16.955   2.083  14.377
  624    HB2  LEU   8           HB2      LEU   8  14.973   2.427  12.971
  625    HB3  LEU   8           HB1      LEU   8  14.596   3.907  13.851
  626    HG   LEU   8           HG       LEU   8  16.767   4.869  13.133
  627   HD11  LEU   8          HD11      LEU   8  16.991   2.193  11.737
  628   HD12  LEU   8          HD12      LEU   8  18.151   2.954  12.824
  629   HD13  LEU   8          HD13      LEU   8  17.908   3.604  11.204
  630   HD21  LEU   8          HD21      LEU   8  15.048   3.794  10.876
  631   HD22  LEU   8          HD22      LEU   8  16.151   5.165  10.758
  632   HD23  LEU   8          HD23      LEU   8  14.731   5.261  11.800
  633    H    SER   9           HN       SER   9  15.126   4.160  16.525
  634    HA   SER   9           HA       SER   9  16.956   6.355  16.487
  635    HB2  SER   9           HB2      SER   9  14.612   6.620  17.200
  636    HB3  SER   9           HB1      SER   9  14.916   5.576  18.583
  637    HG   SER   9           HG       SER   9  15.317   8.176  18.386
  638    H    ILE  10           HN       ILE  10  16.450   3.592  18.680
  639    HA   ILE  10           HA       ILE  10  18.523   4.332  20.486
  640    HB   ILE  10           HB       ILE  10  16.555   2.693  20.854
  641   HG12  ILE  10          HG12      ILE  10  18.065   1.268  22.384
  642   HG13  ILE  10          HG11      ILE  10  19.401   2.233  21.758
  643   HG21  ILE  10          HG21      ILE  10  16.926   0.397  20.323
  644   HG22  ILE  10          HG22      ILE  10  18.590   0.705  19.829
  645   HG23  ILE  10          HG23      ILE  10  17.254   1.294  18.844
  646   HD11  ILE  10          HD11      ILE  10  18.332   3.086  23.912
  647   HD12  ILE  10          HD12      ILE  10  16.912   3.478  22.944
  648   HD13  ILE  10          HD13      ILE  10  18.455   4.260  22.603
  649    H    CYS  11           HN       CYS  11  18.437   2.411  17.504
  650    HA   CYS  11           HA       CYS  11  21.048   1.305  17.813
  651    HB2  CYS  11           HB2      CYS  11  19.034   1.529  15.627
  652    HB3  CYS  11           HB1      CYS  11  20.703   1.172  15.177
  653    HG   CYS  11           HG       CYS  11  20.573  -1.056  16.357
  654    H    SER  12           HN       SER  12  19.820   3.900  15.661
  655    HA   SER  12           HA       SER  12  22.330   4.735  14.757
  656    HB2  SER  12           HB2      SER  12  20.239   5.411  13.669
  657    HB3  SER  12           HB1      SER  12  19.797   6.360  15.085
  658    HG   SER  12           HG       SER  12  21.494   6.947  13.037
  659    H    PHE  13           HN       PHE  13  20.409   5.818  17.551
  660    HA   PHE  13           HA       PHE  13  22.004   7.969  18.333
  661    HB2  PHE  13           HB2      PHE  13  19.876   7.614  19.378
  662    HB3  PHE  13           HB1      PHE  13  20.362   6.024  19.962
  663    HD1  PHE  13           HD1      PHE  13  21.092   9.669  20.253
  664    HD2  PHE  13           HD2      PHE  13  21.541   5.770  21.997
  665    HE1  PHE  13           HE1      PHE  13  22.004  10.697  22.318
  666    HE2  PHE  13           HE2      PHE  13  22.451   6.796  24.062
  667    HZ   PHE  13           HZ       PHE  13  22.681   9.260  24.224
  668    H    ILE  14           HN       ILE  14  22.219   4.543  19.312
  669    HA   ILE  14           HA       ILE  14  24.416   4.815  21.042
  670    HB   ILE  14           HB       ILE  14  23.454   2.497  19.366
  671   HG12  ILE  14          HG12      ILE  14  22.130   3.515  21.359
  672   HG13  ILE  14          HG11      ILE  14  22.385   1.771  21.340
  673   HG21  ILE  14          HG21      ILE  14  25.755   2.699  21.315
  674   HG22  ILE  14          HG22      ILE  14  25.744   1.997  19.699
  675   HG23  ILE  14          HG23      ILE  14  24.927   1.168  21.023
  676   HD11  ILE  14          HD11      ILE  14  24.339   3.598  22.741
  677   HD12  ILE  14          HD12      ILE  14  24.060   1.876  22.997
  678   HD13  ILE  14          HD13      ILE  14  22.869   3.053  23.548
  679    H    LEU  15           HN       LEU  15  24.308   4.069  17.570
  680    HA   LEU  15           HA       LEU  15  27.117   3.799  17.235
  681    HB2  LEU  15           HB2      LEU  15  24.886   4.409  15.286
  682    HB3  LEU  15           HB1      LEU  15  26.562   4.164  14.792
  683    HG   LEU  15           HG       LEU  15  25.031   2.148  16.456
  684   HD11  LEU  15          HD11      LEU  15  25.429   2.246  13.447
  685   HD12  LEU  15          HD12      LEU  15  23.891   2.421  14.295
  686   HD13  LEU  15          HD13      LEU  15  24.752   0.882  14.339
  687   HD21  LEU  15          HD21      LEU  15  27.631   2.134  14.901
  688   HD22  LEU  15          HD22      LEU  15  26.843   0.650  15.438
  689   HD23  LEU  15          HD23      LEU  15  27.401   1.830  16.623
  690    H    SER  16           HN       SER  16  24.968   6.529  17.277
  691    HA   SER  16           HA       SER  16  26.719   8.426  16.052
  692    HB2  SER  16           HB2      SER  16  24.318   8.838  16.176
  693    HB3  SER  16           HB1      SER  16  24.380   8.815  17.937
  694    HG   SER  16           HG       SER  16  24.921  10.832  17.829
  695    H    ALA  17           HN       ALA  17  25.912   7.661  19.433
  696    HA   ALA  17           HA       ALA  17  27.627   9.557  20.615
  697    HB1  ALA  17           HB1      ALA  17  25.757   7.971  21.631
  698    HB2  ALA  17           HB2      ALA  17  27.085   8.565  22.627
  699    HB3  ALA  17           HB3      ALA  17  27.144   6.933  21.963
  700    H    LEU  18           HN       LEU  18  28.139   6.183  19.617
  701    HA   LEU  18           HA       LEU  18  30.755   5.938  20.668
  702    HB2  LEU  18           HB2      LEU  18  29.294   4.513  18.446
  703    HB3  LEU  18           HB1      LEU  18  30.934   4.083  18.939
  704    HG   LEU  18           HG       LEU  18  28.670   4.270  20.931
  705   HD11  LEU  18          HD11      LEU  18  29.645   1.767  19.526
  706   HD12  LEU  18          HD12      LEU  18  28.161   2.616  19.094
  707   HD13  LEU  18          HD13      LEU  18  28.327   1.887  20.692
  708   HD21  LEU  18          HD21      LEU  18  30.864   4.281  21.929
  709   HD22  LEU  18          HD22      LEU  18  31.414   2.982  20.873
  710   HD23  LEU  18          HD23      LEU  18  30.223   2.652  22.130
  711    H    HIS  19           HN       HIS  19  29.582   6.814  17.399
  712    HA   HIS  19           HA       HIS  19  32.021   7.042  16.122
  713    HB2  HIS  19           HB2      HIS  19  29.743   7.254  15.077
  714    HB3  HIS  19           HB1      HIS  19  29.653   8.888  15.731
  715    HD2  HIS  19           HD2      HIS  19  30.606  10.732  13.921
  716    HE1  HIS  19           HE1      HIS  19  33.217   8.196  11.783
  717    HE2  HIS  19           HE2      HIS  19  32.283  10.552  11.927
  718    H    PHE  20           HN       PHE  20  30.259   9.522  17.974
  719    HA   PHE  20           HA       PHE  20  32.235  11.538  17.640
  720    HB2  PHE  20           HB2      PHE  20  29.723  11.246  19.029
  721    HB3  PHE  20           HB1      PHE  20  30.916  12.015  20.076
  722    HD1  PHE  20           HD1      PHE  20  28.998  12.314  16.944
  723    HD2  PHE  20           HD2      PHE  20  31.952  14.146  19.463
  724    HE1  PHE  20           HE1      PHE  20  28.738  14.445  15.696
  725    HE2  PHE  20           HE2      PHE  20  31.698  16.278  18.220
  726    HZ   PHE  20           HZ       PHE  20  30.083  16.444  16.330
  727    H    MET  21           HN       MET  21  31.736   8.984  20.025
  728    HA   MET  21           HA       MET  21  33.595   9.830  21.951
  729    HB2  MET  21           HB2      MET  21  31.958   8.007  22.307
  730    HB3  MET  21           HB1      MET  21  32.867   6.992  21.187
  731    HG2  MET  21           HG2      MET  21  33.524   6.450  23.478
  732    HG3  MET  21           HG1      MET  21  34.874   7.233  22.659
  733    HE1  MET  21           HE1      MET  21  35.226   6.988  25.403
  734    HE2  MET  21           HE2      MET  21  35.387   8.554  26.195
  735    HE3  MET  21           HE3      MET  21  36.233   8.250  24.679
  736    H    ALA  22           HN       ALA  22  34.008   7.658  19.169
  737    HA   ALA  22           HA       ALA  22  36.746   7.111  19.584
  738    HB1  ALA  22           HB1      ALA  22  35.579   5.666  18.126
  739    HB2  ALA  22           HB2      ALA  22  36.687   6.566  17.091
  740    HB3  ALA  22           HB3      ALA  22  34.980   7.005  17.147
  741    H    TRP  23           HN       TRP  23  35.080   9.635  17.759
  742    HA   TRP  23           HA       TRP  23  37.411  10.767  16.576
  743    HB2  TRP  23           HB2      TRP  23  34.610  11.694  17.084
  744    HB3  TRP  23           HB1      TRP  23  35.820  12.799  16.431
  745    HD1  TRP  23           HD1      TRP  23  33.831  12.537  14.410
  746    HE1  TRP  23           HE1      TRP  23  34.011  11.121  12.280
  747    HE3  TRP  23           HE3      TRP  23  37.377   9.076  15.850
  748    HZ2  TRP  23           HZ2      TRP  23  35.433   8.895  11.304
  749    HZ3  TRP  23           HZ3      TRP  23  38.101   7.336  14.265
  750    HH2  TRP  23           HH2      TRP  23  37.139   7.231  11.995
  751    H    THR  24           HN       THR  24  35.597  11.708  19.500
  752    HA   THR  24           HA       THR  24  37.118  13.883  20.241
  753    HB   THR  24           HB       THR  24  36.552  12.862  22.657
  754    HG1  THR  24           HG1      THR  24  35.165  11.255  22.561
  755   HG21  THR  24          HG21      THR  24  34.423  13.987  22.502
  756   HG22  THR  24          HG22      THR  24  34.383  13.774  20.751
  757   HG23  THR  24          HG23      THR  24  35.559  14.869  21.480
  758    H    ILE  25           HN       ILE  25  37.608  10.494  21.291
  759    HA   ILE  25           HA       ILE  25  40.062  11.008  22.611
  760    HB   ILE  25           HB       ILE  25  38.407   8.868  22.516
  761   HG12  ILE  25          HG12      ILE  25  40.404   7.636  23.599
  762   HG13  ILE  25          HG11      ILE  25  41.311   9.117  23.288
  763   HG21  ILE  25          HG21      ILE  25  39.311   8.310  20.211
  764   HG22  ILE  25          HG22      ILE  25  39.450   7.020  21.399
  765   HG23  ILE  25          HG23      ILE  25  40.862   7.985  20.982
  766   HD11  ILE  25          HD11      ILE  25  38.688   9.016  24.802
  767   HD12  ILE  25          HD12      ILE  25  39.732  10.423  24.595
  768   HD13  ILE  25          HD13      ILE  25  40.275   9.057  25.570
  769    H    GLY  26           HN       GLY  26  39.269  10.303  19.285
  770    HA2  GLY  26           HA2      GLY  26  41.806   9.585  18.299
  771    HA3  GLY  26           HA1      GLY  26  40.537  10.352  17.349
  772    H    HIS  27           HN       HIS  27  40.248  12.785  18.453
  773    HA   HIS  27           HA       HIS  27  42.479  14.235  17.463
  774    HB2  HIS  27           HB2      HIS  27  40.223  15.176  17.437
  775    HB3  HIS  27           HB1      HIS  27  40.181  15.162  19.201
  776    HD2  HIS  27           HD2      HIS  27  41.870  17.216  16.301
  777    HE1  HIS  27           HE1      HIS  27  42.780  19.111  19.962
  778    HE2  HIS  27           HE2      HIS  27  42.935  19.313  17.436
  779    H    LEU  28           HN       LEU  28  41.492  13.208  20.667
  780    HA   LEU  28           HA       LEU  28  43.395  14.807  22.094
  781    HB2  LEU  28           HB2      LEU  28  41.770  12.375  22.855
  782    HB3  LEU  28           HB1      LEU  28  42.835  13.218  23.980
  783    HG   LEU  28           HG       LEU  28  40.718  14.700  22.420
  784   HD11  LEU  28          HD11      LEU  28  39.289  14.481  24.455
  785   HD12  LEU  28          HD12      LEU  28  40.449  13.325  25.110
  786   HD13  LEU  28          HD13      LEU  28  39.551  12.937  23.644
  787   HD21  LEU  28          HD21      LEU  28  42.545  15.969  23.568
  788   HD22  LEU  28          HD22      LEU  28  42.065  15.225  25.091
  789   HD23  LEU  28          HD23      LEU  28  40.956  16.310  24.250
  790    H    ASN  29           HN       ASN  29  43.470  11.707  20.508
  791    HA   ASN  29           HA       ASN  29  45.640  10.512  21.819
  792    HB2  ASN  29           HB2      ASN  29  44.200   9.352  20.174
  793    HB3  ASN  29           HB1      ASN  29  44.909  10.326  18.886
  794   HD21  ASN  29          HD21      ASN  29  45.236   7.387  20.557
  795   HD22  ASN  29          HD22      ASN  29  46.830   7.024  20.099
  796    H    GLN  30           HN       GLN  30  47.598  11.346  22.119
  797    HA   GLN  30           HA       GLN  30  48.826  12.876  19.904
  798    HB2  GLN  30           HB2      GLN  30  48.260  14.329  21.821
  799    HB3  GLN  30           HB1      GLN  30  49.221  13.296  22.878
  800    HG2  GLN  30           HG2      GLN  30  50.530  15.252  22.167
  801    HG3  GLN  30           HG1      GLN  30  51.225  13.772  21.512
  802   HE21  GLN  30          HE21      GLN  30  52.140  14.718  19.599
  803   HE22  GLN  30          HE22      GLN  30  51.183  15.392  18.368
  804    H    ILE  31           HN       ILE  31  50.564  11.923  19.082
  805    HA   ILE  31           HA       ILE  31  51.649   9.518  19.926
  806    HB   ILE  31           HB       ILE  31  53.660  10.194  18.552
  807   HG12  ILE  31          HG12      ILE  31  52.021  12.683  18.012
  808   HG13  ILE  31          HG11      ILE  31  53.377  12.655  19.141
  809   HG21  ILE  31          HG21      ILE  31  51.718   9.076  17.543
  810   HG22  ILE  31          HG22      ILE  31  52.371  10.283  16.435
  811   HG23  ILE  31          HG23      ILE  31  50.907  10.630  17.354
  812   HD11  ILE  31          HD11      ILE  31  53.592  11.788  16.247
  813   HD12  ILE  31          HD12      ILE  31  54.913  12.030  17.389
  814   HD13  ILE  31          HD13      ILE  31  53.984  13.412  16.810
  815    H    LYS  32           HN       LYS  32  53.314   8.903  21.237
  816    HA   LYS  32           HA       LYS  32  55.035  10.861  22.502
  817    HB2  LYS  32           HB2      LYS  32  54.375  10.291  24.796
  818    HB3  LYS  32           HB1      LYS  32  53.018  10.993  23.914
  819    HG2  LYS  32           HG2      LYS  32  52.124   8.751  23.465
  820    HG3  LYS  32           HG1      LYS  32  53.498   8.022  24.295
  821    HD2  LYS  32           HD2      LYS  32  52.844   9.154  26.385
  822    HD3  LYS  32           HD1      LYS  32  51.469   9.889  25.559
  823    HE2  LYS  32           HE2      LYS  32  50.533   7.671  25.091
  824    HE3  LYS  32           HE1      LYS  32  51.927   6.905  25.855
  825    HZ1  LYS  32           HZ1      LYS  32  50.465   6.943  27.586
  826    HZ2  LYS  32           HZ2      LYS  32  49.705   8.376  27.078
  827    HZ3  LYS  32           HZ3      LYS  32  51.226   8.439  27.832
  828    H    ARG  33           HN       ARG  33  56.710   9.855  23.810
  829    HA   ARG  33           HA       ARG  33  56.972   6.948  23.559
  830    HB2  ARG  33           HB2      ARG  33  58.246   8.702  21.762
  831    HB3  ARG  33           HB1      ARG  33  59.495   8.178  22.893
  832    HG2  ARG  33           HG2      ARG  33  58.765   5.810  22.517
  833    HG3  ARG  33           HG1      ARG  33  57.654   6.391  21.277
  834    HD2  ARG  33           HD2      ARG  33  59.394   6.096  19.855
  835    HD3  ARG  33           HD1      ARG  33  60.001   7.604  20.534
  836    HE   ARG  33           HE       ARG  33  60.858   5.538  22.212
  837   HH11  ARG  33          HH11      ARG  33  61.286   6.593  18.915
  838   HH12  ARG  33          HH12      ARG  33  62.881   5.940  18.787
  839   HH21  ARG  33          HH21      ARG  33  62.948   4.695  22.017
  840   HH22  ARG  33          HH22      ARG  33  63.818   4.871  20.530
  841    H1   MET   1           HT1      MET   1   6.990  19.690  18.977
  842    H2   MET   1           HT2      MET   1   5.350  19.407  19.315
  843    H3   MET   1           HT3      MET   1   6.236  18.283  18.401
  844    HA   MET   1           HA       MET   1   7.726  18.039  20.419
  845    HB2  MET   1           HB2      MET   1   6.782  18.670  22.540
  846    HB3  MET   1           HB1      MET   1   6.740  20.101  21.511
  847    HG2  MET   1           HG2      MET   1   4.362  19.588  20.952
  848    HG3  MET   1           HG1      MET   1   4.419  18.225  22.069
  849    HE1  MET   1           HE1      MET   1   4.548  19.491  25.477
  850    HE2  MET   1           HE2      MET   1   6.110  19.350  24.676
  851    HE3  MET   1           HE3      MET   1   4.827  18.203  24.297
  852    H    PHE   2           HN       PHE   2   4.344  17.736  19.565
  853    HA   PHE   2           HA       PHE   2   3.858  15.307  20.979
  854    HB2  PHE   2           HB2      PHE   2   2.461  16.627  18.645
  855    HB3  PHE   2           HB1      PHE   2   1.885  15.142  19.404
  856    HD1  PHE   2           HD1      PHE   2   2.502  18.751  19.898
  857    HD2  PHE   2           HD2      PHE   2   0.918  15.153  21.627
  858    HE1  PHE   2           HE1      PHE   2   1.412  20.088  21.679
  859    HE2  PHE   2           HE2      PHE   2  -0.171  16.490  23.410
  860    HZ   PHE   2           HZ       PHE   2   0.076  18.958  23.436
  861    H    GLU   3           HN       GLU   3   5.152  16.096  17.807
  862    HA   GLU   3           HA       GLU   3   5.030  13.330  16.941
  863    HB2  GLU   3           HB2      GLU   3   6.177  15.774  15.590
  864    HB3  GLU   3           HB1      GLU   3   6.022  14.176  14.855
  865    HG2  GLU   3           HG2      GLU   3   3.576  14.248  15.232
  866    HG3  GLU   3           HG1      GLU   3   3.742  15.859  15.927
  867    HA   PRO   4           HA       PRO   4   9.107  12.587  18.724
  868    HB2  PRO   4           HB2      PRO   4   9.528  10.097  17.650
  869    HB3  PRO   4           HB1      PRO   4   8.501  10.395  19.067
  870    HG2  PRO   4           HG2      PRO   4   7.725   9.982  16.221
  871    HG3  PRO   4           HG1      PRO   4   6.969   9.363  17.700
  872    HD2  PRO   4           HD2      PRO   4   5.964  11.492  16.342
  873    HD3  PRO   4           HD1      PRO   4   5.827  11.339  18.109
  874    H    PHE   5           HN       PHE   5   8.337  12.466  15.334
  875    HA   PHE   5           HA       PHE   5  10.946  12.106  14.296
  876    HB2  PHE   5           HB2      PHE   5   9.521  11.870  12.557
  877    HB3  PHE   5           HB1      PHE   5   8.321  12.948  13.270
  878    HD1  PHE   5           HD1      PHE   5  11.474  12.811  11.320
  879    HD2  PHE   5           HD2      PHE   5   8.291  15.298  12.780
  880    HE1  PHE   5           HE1      PHE   5  12.233  14.651   9.839
  881    HE2  PHE   5           HE2      PHE   5   9.050  17.138  11.302
  882    HZ   PHE   5           HZ       PHE   5  11.021  16.815   9.830
  883    H    GLN   6           HN       GLN   6   9.181  14.946  15.415
  884    HA   GLN   6           HA       GLN   6  10.898  16.917  14.322
  885    HB2  GLN   6           HB2      GLN   6   8.632  17.358  15.252
  886    HB3  GLN   6           HB1      GLN   6   9.280  17.076  16.869
  887    HG2  GLN   6           HG2      GLN   6  10.801  18.934  16.663
  888    HG3  GLN   6           HG1      GLN   6  10.399  19.141  14.959
  889   HE21  GLN   6          HE21      GLN   6   9.989  21.417  16.288
  890   HE22  GLN   6          HE22      GLN   6   8.355  21.660  16.681
  891    H    ILE   7           HN       ILE   7  10.929  15.192  17.389
  892    HA   ILE   7           HA       ILE   7  13.114  16.680  18.499
  893    HB   ILE   7           HB       ILE   7  12.895  15.396  20.376
  894   HG12  ILE   7          HG12      ILE   7  12.497  13.049  18.515
  895   HG13  ILE   7          HG11      ILE   7  13.851  13.359  19.590
  896   HG21  ILE   7          HG21      ILE   7  10.633  14.844  20.764
  897   HG22  ILE   7          HG22      ILE   7  10.369  14.360  19.088
  898   HG23  ILE   7          HG23      ILE   7  10.565  16.065  19.497
  899   HD11  ILE   7          HD11      ILE   7  11.040  12.523  20.307
  900   HD12  ILE   7          HD12      ILE   7  12.129  13.229  21.502
  901   HD13  ILE   7          HD13      ILE   7  12.557  11.718  20.701
  902    H    LEU   8           HN       LEU   8  12.875  13.791  16.507
  903    HA   LEU   8           HA       LEU   8  15.631  13.060  16.841
  904    HB2  LEU   8           HB2      LEU   8  13.916  11.378  16.340
  905    HB3  LEU   8           HB1      LEU   8  13.559  12.185  14.815
  906    HG   LEU   8           HG       LEU   8  15.893  11.786  14.074
  907   HD11  LEU   8          HD11      LEU   8  16.061  10.452  16.786
  908   HD12  LEU   8          HD12      LEU   8  17.117  11.695  16.115
  909   HD13  LEU   8          HD13      LEU   8  17.177  10.053  15.479
  910   HD21  LEU   8          HD21      LEU   8  14.425   9.309  15.028
  911   HD22  LEU   8          HD22      LEU   8  15.660   9.344  13.771
  912   HD23  LEU   8          HD23      LEU   8  14.120  10.167  13.518
  913    H    SER   9           HN       SER   9  13.716  14.907  14.560
  914    HA   SER   9           HA       SER   9  15.735  15.124  12.550
  915    HB2  SER   9           HB2      SER   9  13.350  15.482  12.052
  916    HB3  SER   9           HB1      SER   9  13.347  16.902  13.092
  917    HG   SER   9           HG       SER   9  14.018  16.752  10.545
  918    H    ILE  10           HN       ILE  10  14.659  17.229  15.216
  919    HA   ILE  10           HA       ILE  10  16.504  19.321  14.632
  920    HB   ILE  10           HB       ILE  10  14.356  19.406  16.071
  921   HG12  ILE  10          HG12      ILE  10  15.483  21.148  17.602
  922   HG13  ILE  10          HG11      ILE  10  16.982  20.718  16.778
  923   HG21  ILE  10          HG21      ILE  10  14.578  18.948  18.403
  924   HG22  ILE  10          HG22      ILE  10  16.319  18.698  18.260
  925   HG23  ILE  10          HG23      ILE  10  15.199  17.528  17.569
  926   HD11  ILE  10          HD11      ILE  10  15.700  22.689  15.788
  927   HD12  ILE  10          HD12      ILE  10  14.479  21.521  15.284
  928   HD13  ILE  10          HD13      ILE  10  16.123  21.404  14.656
  929    H    CYS  11           HN       CYS  11  16.673  16.362  16.587
  930    HA   CYS  11           HA       CYS  11  19.089  17.064  17.934
  931    HB2  CYS  11           HB2      CYS  11  17.445  14.605  17.562
  932    HB3  CYS  11           HB1      CYS  11  19.119  14.406  18.084
  933    HG   CYS  11           HG       CYS  11  18.604  15.563  20.267
  934    H    SER  12           HN       SER  12  18.444  14.733  15.279
  935    HA   SER  12           HA       SER  12  21.123  14.209  14.700
  936    HB2  SER  12           HB2      SER  12  19.289  12.823  13.852
  937    HB3  SER  12           HB1      SER  12  18.738  14.154  12.840
  938    HG   SER  12           HG       SER  12  20.762  12.375  12.452
  939    H    PHE  13           HN       PHE  13  18.931  16.685  13.391
  940    HA   PHE  13           HA       PHE  13  20.593  17.681  11.381
  941    HB2  PHE  13           HB2      PHE  13  18.310  18.405  11.512
  942    HB3  PHE  13           HB1      PHE  13  18.553  19.063  13.130
  943    HD1  PHE  13           HD1      PHE  13  19.579  19.437   9.564
  944    HD2  PHE  13           HD2      PHE  13  19.396  21.250  13.455
  945    HE1  PHE  13           HE1      PHE  13  20.276  21.608   8.586
  946    HE2  PHE  13           HE2      PHE  13  20.093  23.418  12.478
  947    HZ   PHE  13           HZ       PHE  13  20.531  23.599  10.044
  948    H    ILE  14           HN       ILE  14  20.338  18.693  14.798
  949    HA   ILE  14           HA       ILE  14  22.273  20.729  14.693
  950    HB   ILE  14           HB       ILE  14  21.347  18.944  16.943
  951   HG12  ILE  14          HG12      ILE  14  19.850  20.714  15.768
  952   HG13  ILE  14          HG11      ILE  14  19.939  20.745  17.527
  953   HG21  ILE  14          HG21      ILE  14  23.350  21.208  16.920
  954   HG22  ILE  14          HG22      ILE  14  23.504  19.610  17.651
  955   HG23  ILE  14          HG23      ILE  14  22.429  20.806  18.372
  956   HD11  ILE  14          HD11      ILE  14  21.834  22.405  15.862
  957   HD12  ILE  14          HD12      ILE  14  21.356  22.628  17.545
  958   HD13  ILE  14          HD13      ILE  14  20.216  22.990  16.250
  959    H    LEU  15           HN       LEU  15  22.603  17.276  15.499
  960    HA   LEU  15           HA       LEU  15  25.388  17.365  16.033
  961    HB2  LEU  15           HB2      LEU  15  23.533  15.108  15.253
  962    HB3  LEU  15           HB1      LEU  15  25.231  14.866  15.666
  963    HG   LEU  15           HG       LEU  15  23.290  16.299  17.495
  964   HD11  LEU  15          HD11      LEU  15  24.124  13.380  17.494
  965   HD12  LEU  15          HD12      LEU  15  22.505  13.993  17.161
  966   HD13  LEU  15          HD13      LEU  15  23.200  14.172  18.772
  967   HD21  LEU  15          HD21      LEU  15  26.074  15.142  17.784
  968   HD22  LEU  15          HD22      LEU  15  25.077  15.567  19.174
  969   HD23  LEU  15          HD23      LEU  15  25.568  16.814  18.031
  970    H    SER  16           HN       SER  16  23.527  17.074  13.110
  971    HA   SER  16           HA       SER  16  25.613  16.112  11.413
  972    HB2  SER  16           HB2      SER  16  23.269  15.879  10.775
  973    HB3  SER  16           HB1      SER  16  23.073  17.630  10.768
  974    HG   SER  16           HG       SER  16  23.815  17.593   8.813
  975    H    ALA  17           HN       ALA  17  24.253  19.341  12.036
  976    HA   ALA  17           HA       ALA  17  25.950  20.752  10.283
  977    HB1  ALA  17           HB1      ALA  17  23.808  21.491  11.665
  978    HB2  ALA  17           HB2      ALA  17  25.030  22.668  11.181
  979    HB3  ALA  17           HB3      ALA  17  25.026  22.027  12.824
  980    H    LEU  18           HN       LEU  18  26.283  19.850  13.714
  981    HA   LEU  18           HA       LEU  18  28.678  21.284  14.177
  982    HB2  LEU  18           HB2      LEU  18  27.426  18.878  15.503
  983    HB3  LEU  18           HB1      LEU  18  28.927  19.609  16.074
  984    HG   LEU  18           HG       LEU  18  26.426  21.247  15.639
  985   HD11  LEU  18          HD11      LEU  18  27.352  20.012  18.249
  986   HD12  LEU  18          HD12      LEU  18  26.035  19.363  17.272
  987   HD13  LEU  18          HD13      LEU  18  25.896  20.971  17.983
  988   HD21  LEU  18          HD21      LEU  18  28.444  22.557  15.815
  989   HD22  LEU  18          HD22      LEU  18  29.012  21.597  17.180
  990   HD23  LEU  18          HD23      LEU  18  27.626  22.669  17.372
  991    H    HIS  19           HN       HIS  19  28.083  17.868  13.264
  992    HA   HIS  19           HA       HIS  19  30.689  16.966  13.284
  993    HB2  HIS  19           HB2      HIS  19  28.619  15.598  12.881
  994    HB3  HIS  19           HB1      HIS  19  28.592  16.222  11.233
  995    HD2  HIS  19           HD2      HIS  19  29.969  14.559   9.523
  996    HE1  HIS  19           HE1      HIS  19  32.609  12.842  12.335
  997    HE2  HIS  19           HE2      HIS  19  31.893  12.832   9.899
  998    H    PHE  20           HN       PHE  20  28.923  18.525  10.617
  999    HA   PHE  20           HA       PHE  20  31.109  18.476   8.803
 1000    HB2  PHE  20           HB2      PHE  20  28.406  19.483   8.836
 1001    HB3  PHE  20           HB1      PHE  20  29.501  20.691   8.162
 1002    HD1  PHE  20           HD1      PHE  20  28.099  17.310   7.747
 1003    HD2  PHE  20           HD2      PHE  20  30.819  20.229   6.154
 1004    HE1  PHE  20           HE1      PHE  20  28.234  16.030   5.623
 1005    HE2  PHE  20           HE2      PHE  20  30.954  18.951   4.035
 1006    HZ   PHE  20           HZ       PHE  20  29.659  16.853   3.763
 1007    H    MET  21           HN       MET  21  30.034  20.769  11.258
 1008    HA   MET  21           HA       MET  21  31.660  22.947  10.547
 1009    HB2  MET  21           HB2      MET  21  29.821  23.068  12.202
 1010    HB3  MET  21           HB1      MET  21  30.781  22.098  13.319
 1011    HG2  MET  21           HG2      MET  21  31.046  24.464  13.876
 1012    HG3  MET  21           HG1      MET  21  32.569  23.846  13.238
 1013    HE1  MET  21           HE1      MET  21  32.495  26.615  13.463
 1014    HE2  MET  21           HE2      MET  21  32.687  27.413  11.905
 1015    HE3  MET  21           HE3      MET  21  33.710  26.039  12.314
 1016    H    ALA  22           HN       ALA  22  32.269  20.258  12.806
 1017    HA   ALA  22           HA       ALA  22  34.848  21.082  13.594
 1018    HB1  ALA  22           HB1      ALA  22  33.772  19.478  14.952
 1019    HB2  ALA  22           HB2      ALA  22  35.099  18.609  14.180
 1020    HB3  ALA  22           HB3      ALA  22  33.451  18.413  13.582
 1021    H    TRP  23           HN       TRP  23  33.713  19.015  10.962
 1022    HA   TRP  23           HA       TRP  23  36.288  18.182  10.075
 1023    HB2  TRP  23           HB2      TRP  23  33.546  18.268   8.881
 1024    HB3  TRP  23           HB1      TRP  23  34.938  17.797   7.906
 1025    HD1  TRP  23           HD1      TRP  23  33.254  15.503   8.011
 1026    HE1  TRP  23           HE1      TRP  23  33.611  13.426   9.476
 1027    HE3  TRP  23           HE3      TRP  23  36.192  17.469  11.771
 1028    HZ2  TRP  23           HZ2      TRP  23  34.935  12.690  11.846
 1029    HZ3  TRP  23           HZ3      TRP  23  36.969  16.016  13.603
 1030    HH2  TRP  23           HH2      TRP  23  36.346  13.631  13.658
 1031    H    THR  24           HN       THR  24  34.168  20.803   8.918
 1032    HA   THR  24           HA       THR  24  35.766  21.748   6.878
 1033    HB   THR  24           HB       THR  24  34.761  24.058   7.793
 1034    HG1  THR  24           HG1      THR  24  33.253  23.772   9.264
 1035   HG21  THR  24          HG21      THR  24  32.794  23.589   6.477
 1036   HG22  THR  24          HG22      THR  24  32.988  21.853   6.719
 1037   HG23  THR  24          HG23      THR  24  34.146  22.739   5.726
 1038    H    ILE  25           HN       ILE  25  35.776  22.876  10.281
 1039    HA   ILE  25           HA       ILE  25  38.046  24.539   9.969
 1040    HB   ILE  25           HB       ILE  25  36.225  24.216  11.946
 1041   HG12  ILE  25          HG12      ILE  25  37.919  25.585  13.339
 1042   HG13  ILE  25          HG11      ILE  25  38.998  25.403  11.955
 1043   HG21  ILE  25          HG21      ILE  25  37.396  22.071  12.633
 1044   HG22  ILE  25          HG22      ILE  25  37.237  23.272  13.906
 1045   HG23  ILE  25          HG23      ILE  25  38.782  23.060  13.085
 1046   HD11  ILE  25          HD11      ILE  25  36.185  26.516  11.782
 1047   HD12  ILE  25          HD12      ILE  25  37.377  26.457  10.483
 1048   HD13  ILE  25          HD13      ILE  25  37.639  27.508  11.874
 1049    H    GLY  26           HN       GLY  26  37.682  21.133  10.662
 1050    HA2  GLY  26           HA2      GLY  26  40.255  20.539  11.633
 1051    HA3  GLY  26           HA1      GLY  26  39.217  19.406  10.770
 1052    H    HIS  27           HN       HIS  27  39.004  20.438   8.302
 1053    HA   HIS  27           HA       HIS  27  41.482  19.783   7.084
 1054    HB2  HIS  27           HB2      HIS  27  39.355  19.421   5.936
 1055    HB3  HIS  27           HB1      HIS  27  39.055  21.158   5.911
 1056    HD2  HIS  27           HD2      HIS  27  41.338  18.527   4.083
 1057    HE1  HIS  27           HE1      HIS  27  41.882  22.273   2.212
 1058    HE2  HIS  27           HE2      HIS  27  42.422  19.796   2.073
 1059    H    LEU  28           HN       LEU  28  39.949  22.813   7.958
 1060    HA   LEU  28           HA       LEU  28  41.767  24.495   6.510
 1061    HB2  LEU  28           HB2      LEU  28  39.823  25.024   8.764
 1062    HB3  LEU  28           HB1      LEU  28  40.790  26.287   8.002
 1063    HG   LEU  28           HG       LEU  28  39.074  24.425   6.359
 1064   HD11  LEU  28          HD11      LEU  28  37.349  26.230   6.405
 1065   HD12  LEU  28          HD12      LEU  28  38.286  27.055   7.651
 1066   HD13  LEU  28          HD13      LEU  28  37.577  25.474   7.981
 1067   HD21  LEU  28          HD21      LEU  28  40.826  25.822   5.246
 1068   HD22  LEU  28          HD22      LEU  28  40.059  27.262   5.911
 1069   HD23  LEU  28          HD23      LEU  28  39.196  26.263   4.744
 1070    H    ASN  29           HN       ASN  29  41.775  22.955   9.635
 1071    HA   ASN  29           HA       ASN  29  43.607  24.575  11.002
 1072    HB2  ASN  29           HB2      ASN  29  42.316  22.742  12.054
 1073    HB3  ASN  29           HB1      ASN  29  43.294  21.568  11.177
 1074   HD21  ASN  29          HD21      ASN  29  43.092  23.285  14.100
 1075   HD22  ASN  29          HD22      ASN  29  44.694  23.067  14.619
 1076    H    GLN  30           HN       GLN  30  45.569  25.153  10.351
 1077    HA   GLN  30           HA       GLN  30  47.249  23.134   8.987
 1078    HB2  GLN  30           HB2      GLN  30  46.552  24.938   7.449
 1079    HB3  GLN  30           HB1      GLN  30  47.246  26.131   8.548
 1080    HG2  GLN  30           HG2      GLN  30  48.826  25.609   6.737
 1081    HG3  GLN  30           HG1      GLN  30  49.464  25.070   8.289
 1082   HE21  GLN  30          HE21      GLN  30  50.732  23.306   7.470
 1083   HE22  GLN  30          HE22      GLN  30  50.034  21.947   6.733
 1084    H    ILE  31           HN       ILE  31  48.988  22.581  10.115
 1085    HA   ILE  31           HA       ILE  31  49.703  23.587  12.594
 1086    HB   ILE  31           HB       ILE  31  51.948  22.519  12.137
 1087   HG12  ILE  31          HG12      ILE  31  50.651  21.731   9.516
 1088   HG13  ILE  31          HG11      ILE  31  51.820  23.047   9.649
 1089   HG21  ILE  31          HG21      ILE  31  50.075  21.243  13.087
 1090   HG22  ILE  31          HG22      ILE  31  50.994  20.237  11.969
 1091   HG23  ILE  31          HG23      ILE  31  49.452  20.929  11.466
 1092   HD11  ILE  31          HD11      ILE  31  52.369  20.222  10.590
 1093   HD12  ILE  31          HD12      ILE  31  53.527  21.544  10.451
 1094   HD13  ILE  31          HD13      ILE  31  52.830  20.827   8.998
 1095    H    LYS  32           HN       LYS  32  51.094  25.132  13.338
 1096    HA   LYS  32           HA       LYS  32  52.792  26.624  11.525
 1097    HB2  LYS  32           HB2      LYS  32  51.755  28.800  11.986
 1098    HB3  LYS  32           HB1      LYS  32  50.615  27.725  11.177
 1099    HG2  LYS  32           HG2      LYS  32  49.583  27.161  13.334
 1100    HG3  LYS  32           HG1      LYS  32  50.746  28.191  14.173
 1101    HD2  LYS  32           HD2      LYS  32  49.906  30.155  12.942
 1102    HD3  LYS  32           HD1      LYS  32  48.742  29.131  12.099
 1103    HE2  LYS  32           HE2      LYS  32  47.677  28.545  14.227
 1104    HE3  LYS  32           HE1      LYS  32  48.865  29.507  15.105
 1105    HZ1  LYS  32           HZ1      LYS  32  47.181  31.007  14.897
 1106    HZ2  LYS  32           HZ2      LYS  32  46.641  30.385  13.412
 1107    HZ3  LYS  32           HZ3      LYS  32  48.035  31.352  13.474
 1108    H    ARG  33           HN       ARG  33  54.155  28.170  12.660
 1109    HA   ARG  33           HA       ARG  33  54.171  27.973  15.583
 1110    HB2  ARG  33           HB2      ARG  33  55.854  26.374  13.990
 1111    HB3  ARG  33           HB1      ARG  33  56.870  27.677  14.608
 1112    HG2  ARG  33           HG2      ARG  33  55.980  27.213  16.904
 1113    HG3  ARG  33           HG1      ARG  33  55.120  25.821  16.244
 1114    HD2  ARG  33           HD2      ARG  33  57.013  24.669  16.729
 1115    HD3  ARG  33           HD1      ARG  33  57.656  25.421  15.272
 1116    HE   ARG  33           HE       ARG  33  58.058  27.219  17.376
 1117   HH11  ARG  33          HH11      ARG  33  59.059  24.014  16.432
 1118   HH12  ARG  33          HH12      ARG  33  60.586  24.126  17.234
 1119   HH21  ARG  33          HH21      ARG  33  60.064  27.338  18.416
 1120   HH22  ARG  33          HH22      ARG  33  61.154  25.993  18.351
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1  -0.041  11.370   1.343
    2    H2   MET   1           HT2      MET   1   0.322  11.820   2.941
    3    H3   MET   1           HT3      MET   1   1.538  11.833   1.756
    4    HA   MET   1           HA       MET   1   0.124  13.535   0.545
    5    HB2  MET   1           HB2      MET   1  -1.330  13.122   3.096
    6    HB3  MET   1           HB1      MET   1  -1.109  14.804   2.613
    7    HG2  MET   1           HG2      MET   1  -2.163  12.689   0.721
    8    HG3  MET   1           HG1      MET   1  -3.219  13.677   1.732
    9    HE1  MET   1           HE1      MET   1  -3.170  15.988   1.952
   10    HE2  MET   1           HE2      MET   1  -4.260  16.001   0.568
   11    HE3  MET   1           HE3      MET   1  -2.938  17.163   0.650
   12    H    PHE   2           HN       PHE   2   2.461  13.923   0.562
   13    HA   PHE   2           HA       PHE   2   4.346  15.112   1.129
   14    HB2  PHE   2           HB2      PHE   2   2.219  16.875   2.367
   15    HB3  PHE   2           HB1      PHE   2   3.909  17.345   2.177
   16    HD1  PHE   2           HD1      PHE   2   0.728  16.731   0.461
   17    HD2  PHE   2           HD2      PHE   2   4.892  17.641  -0.069
   18    HE1  PHE   2           HE1      PHE   2   0.284  17.400  -1.888
   19    HE2  PHE   2           HE2      PHE   2   4.449  18.308  -2.415
   20    HZ   PHE   2           HZ       PHE   2   2.145  18.189  -3.325
   21    H    GLU   3           HN       GLU   3   4.531  13.066   2.619
   22    HA   GLU   3           HA       GLU   3   4.240  13.553   5.444
   23    HB2  GLU   3           HB2      GLU   3   5.593  11.321   3.918
   24    HB3  GLU   3           HB1      GLU   3   5.355  11.335   5.667
   25    HG2  GLU   3           HG2      GLU   3   3.095  11.620   3.669
   26    HG3  GLU   3           HG1      GLU   3   3.577  10.082   4.383
   27    HA   PRO   4           HA       PRO   4   8.175  15.481   6.214
   28    HB2  PRO   4           HB2      PRO   4   8.770  14.471   8.705
   29    HB3  PRO   4           HB1      PRO   4   7.609  15.782   8.417
   30    HG2  PRO   4           HG2      PRO   4   7.115  12.879   8.869
   31    HG3  PRO   4           HG1      PRO   4   6.229  14.286   9.486
   32    HD2  PRO   4           HD2      PRO   4   5.296  12.822   7.403
   33    HD3  PRO   4           HD1      PRO   4   5.037  14.579   7.504
   34    H    PHE   5           HN       PHE   5   7.824  12.037   6.339
   35    HA   PHE   5           HA       PHE   5  10.460  11.216   6.769
   36    HB2  PHE   5           HB2      PHE   5   9.274   9.306   6.664
   37    HB3  PHE   5           HB1      PHE   5   8.017  10.045   5.673
   38    HD1  PHE   5           HD1      PHE   5  11.458   8.593   5.535
   39    HD2  PHE   5           HD2      PHE   5   7.931   9.684   3.338
   40    HE1  PHE   5           HE1      PHE   5  12.355   7.451   3.523
   41    HE2  PHE   5           HE2      PHE   5   8.829   8.543   1.329
   42    HZ   PHE   5           HZ       PHE   5  11.041   7.426   1.421
   43    H    GLN   6           HN       GLN   6   8.829  12.364   3.858
   44    HA   GLN   6           HA       GLN   6  10.828  11.686   1.997
   45    HB2  GLN   6           HB2      GLN   6   8.589  12.420   1.324
   46    HB3  GLN   6           HB1      GLN   6   8.920  14.034   1.954
   47    HG2  GLN   6           HG2      GLN   6  10.747  14.326   0.363
   48    HG3  GLN   6           HG1      GLN   6  10.536  12.677  -0.225
   49   HE21  GLN   6          HE21      GLN   6   9.617  12.847  -2.277
   50   HE22  GLN   6          HE22      GLN   6   8.293  13.836  -2.664
   51    H    ILE   7           HN       ILE   7  10.401  14.584   3.991
   52    HA   ILE   7           HA       ILE   7  12.530  16.081   2.898
   53    HB   ILE   7           HB       ILE   7  11.305  16.136   5.660
   54   HG12  ILE   7          HG12      ILE   7  10.890  17.998   3.311
   55   HG13  ILE   7          HG11      ILE   7   9.851  16.605   3.620
   56   HG21  ILE   7          HG21      ILE   7  12.276  18.461   5.695
   57   HG22  ILE   7          HG22      ILE   7  13.185  18.044   4.244
   58   HG23  ILE   7          HG23      ILE   7  13.488  17.182   5.750
   59   HD11  ILE   7          HD11      ILE   7   9.329  17.476   5.859
   60   HD12  ILE   7          HD12      ILE   7   8.910  18.659   4.619
   61   HD13  ILE   7          HD13      ILE   7  10.381  18.863   5.570
   62    H    LEU   8           HN       LEU   8  12.411  14.031   5.830
   63    HA   LEU   8           HA       LEU   8  15.121  14.378   6.533
   64    HB2  LEU   8           HB2      LEU   8  13.238  13.463   7.980
   65    HB3  LEU   8           HB1      LEU   8  13.459  11.932   7.130
   66    HG   LEU   8           HG       LEU   8  15.996  12.300   7.744
   67   HD11  LEU   8          HD11      LEU   8  15.582  14.581   8.667
   68   HD12  LEU   8          HD12      LEU   8  16.302  13.493   9.852
   69   HD13  LEU   8          HD13      LEU   8  14.579  13.860   9.925
   70   HD21  LEU   8          HD21      LEU   8  14.532  10.454   8.553
   71   HD22  LEU   8          HD22      LEU   8  13.954  11.505   9.845
   72   HD23  LEU   8          HD23      LEU   8  15.646  11.010   9.800
   73    H    SER   9           HN       SER   9  13.473  12.081   4.453
   74    HA   SER   9           HA       SER   9  15.621  10.269   4.105
   75    HB2  SER   9           HB2      SER   9  13.317   9.691   3.541
   76    HB3  SER   9           HB1      SER   9  13.303  10.913   2.275
   77    HG   SER   9           HG       SER   9  13.809   8.958   1.342
   78    H    ILE  10           HN       ILE  10  14.465  12.952   2.044
   79    HA   ILE  10           HA       ILE  10  16.615  12.683   0.186
   80    HB   ILE  10           HB       ILE  10  14.359  13.709  -0.288
   81   HG12  ILE  10          HG12      ILE  10  16.674  15.546  -0.944
   82   HG13  ILE  10          HG11      ILE  10  16.470  13.965  -1.699
   83   HG21  ILE  10          HG21      ILE  10  15.595  16.119   1.074
   84   HG22  ILE  10          HG22      ILE  10  14.300  15.138   1.757
   85   HG23  ILE  10          HG23      ILE  10  14.023  16.052   0.277
   86   HD11  ILE  10          HD11      ILE  10  14.132  14.695  -2.359
   87   HD12  ILE  10          HD12      ILE  10  15.435  15.567  -3.163
   88   HD13  ILE  10          HD13      ILE  10  14.566  16.318  -1.824
   89    H    CYS  11           HN       CYS  11  16.198  14.503   3.172
   90    HA   CYS  11           HA       CYS  11  18.372  16.303   2.753
   91    HB2  CYS  11           HB2      CYS  11  16.846  15.380   5.176
   92    HB3  CYS  11           HB1      CYS  11  18.244  16.443   5.326
   93    HG   CYS  11           HG       CYS  11  15.655  17.543   4.810
   94    H    SER  12           HN       SER  12  18.095  13.322   4.751
   95    HA   SER  12           HA       SER  12  20.808  13.246   5.475
   96    HB2  SER  12           HB2      SER  12  19.085  11.956   6.653
   97    HB3  SER  12           HB1      SER  12  18.838  10.962   5.219
   98    HG   SER  12           HG       SER  12  20.343   9.802   6.162
   99    H    PHE  13           HN       PHE  13  19.062  11.836   2.736
  100    HA   PHE  13           HA       PHE  13  21.133  10.236   1.729
  101    HB2  PHE  13           HB2      PHE  13  18.725  10.219   0.995
  102    HB3  PHE  13           HB1      PHE  13  19.057  11.694   0.086
  103    HD1  PHE  13           HD1      PHE  13  20.157   8.158   0.524
  104    HD2  PHE  13           HD2      PHE  13  20.079  11.598  -2.046
  105    HE1  PHE  13           HE1      PHE  13  21.098   6.797  -1.323
  106    HE2  PHE  13           HE2      PHE  13  21.020  10.236  -3.895
  107    HZ   PHE  13           HZ       PHE  13  21.529   7.836  -3.533
  108    H    ILE  14           HN       ILE  14  20.294  13.639   1.015
  109    HA   ILE  14           HA       ILE  14  22.320  14.080  -0.901
  110    HB   ILE  14           HB       ILE  14  20.849  15.955   0.954
  111   HG12  ILE  14          HG12      ILE  14  20.703  15.644  -2.052
  112   HG13  ILE  14          HG11      ILE  14  19.673  14.729  -0.955
  113   HG21  ILE  14          HG21      ILE  14  22.927  16.530  -1.168
  114   HG22  ILE  14          HG22      ILE  14  22.915  17.072   0.510
  115   HG23  ILE  14          HG23      ILE  14  21.753  17.737  -0.639
  116   HD11  ILE  14          HD11      ILE  14  19.853  17.756  -0.996
  117   HD12  ILE  14          HD12      ILE  14  18.735  16.780  -0.045
  118   HD13  ILE  14          HD13      ILE  14  18.591  16.823  -1.801
  119    H    LEU  15           HN       LEU  15  22.287  14.613   2.616
  120    HA   LEU  15           HA       LEU  15  24.899  15.716   2.773
  121    HB2  LEU  15           HB2      LEU  15  23.173  14.338   4.838
  122    HB3  LEU  15           HB1      LEU  15  24.692  15.152   5.210
  123    HG   LEU  15           HG       LEU  15  22.381  16.519   3.805
  124   HD11  LEU  15          HD11      LEU  15  23.143  16.785   6.724
  125   HD12  LEU  15          HD12      LEU  15  21.871  15.697   6.171
  126   HD13  LEU  15          HD13      LEU  15  21.714  17.435   5.917
  127   HD21  LEU  15          HD21      LEU  15  23.655  18.549   4.707
  128   HD22  LEU  15          HD22      LEU  15  24.446  17.662   3.406
  129   HD23  LEU  15          HD23      LEU  15  24.974  17.436   5.073
  130    H    SER  16           HN       SER  16  23.727  12.434   2.639
  131    HA   SER  16           HA       SER  16  26.131  11.226   3.682
  132    HB2  SER  16           HB2      SER  16  25.140   9.129   3.086
  133    HB3  SER  16           HB1      SER  16  23.846  10.145   3.712
  134    HG   SER  16           HG       SER  16  24.003   8.975   1.353
  135    H    ALA  17           HN       ALA  17  24.768  11.840   0.479
  136    HA   ALA  17           HA       ALA  17  26.812  10.520  -0.995
  137    HB1  ALA  17           HB1      ALA  17  25.947  12.137  -2.847
  138    HB2  ALA  17           HB2      ALA  17  24.708  12.552  -1.665
  139    HB3  ALA  17           HB3      ALA  17  24.865  10.889  -2.228
  140    H    LEU  18           HN       LEU  18  26.342  13.855   0.083
  141    HA   LEU  18           HA       LEU  18  28.633  14.876  -1.273
  142    HB2  LEU  18           HB2      LEU  18  27.015  15.951   1.048
  143    HB3  LEU  18           HB1      LEU  18  28.280  16.851   0.212
  144    HG   LEU  18           HG       LEU  18  25.857  15.672  -1.179
  145   HD11  LEU  18          HD11      LEU  18  25.002  17.987  -1.242
  146   HD12  LEU  18          HD12      LEU  18  26.380  18.523  -0.280
  147   HD13  LEU  18          HD13      LEU  18  25.187  17.431   0.422
  148   HD21  LEU  18          HD21      LEU  18  26.605  17.402  -2.924
  149   HD22  LEU  18          HD22      LEU  18  27.643  15.989  -2.739
  150   HD23  LEU  18          HD23      LEU  18  28.107  17.525  -2.006
  151    H    HIS  19           HN       HIS  19  28.038  13.387   1.872
  152    HA   HIS  19           HA       HIS  19  30.443  14.189   3.131
  153    HB2  HIS  19           HB2      HIS  19  28.543  13.308   4.393
  154    HB3  HIS  19           HB1      HIS  19  28.695  11.755   3.573
  155    HD2  HIS  19           HD2      HIS  19  30.426  10.007   4.841
  156    HE1  HIS  19           HE1      HIS  19  32.387  12.815   7.309
  157    HE2  HIS  19           HE2      HIS  19  32.174  10.347   6.751
  158    H    PHE  20           HN       PHE  20  29.538  11.231   1.329
  159    HA   PHE  20           HA       PHE  20  32.139  10.077   1.594
  160    HB2  PHE  20           HB2      PHE  20  29.612   9.320   0.384
  161    HB3  PHE  20           HB1      PHE  20  30.976   8.929  -0.667
  162    HD1  PHE  20           HD1      PHE  20  29.252   8.124   2.443
  163    HD2  PHE  20           HD2      PHE  20  32.888   7.567   0.221
  164    HE1  PHE  20           HE1      PHE  20  29.853   6.209   3.902
  165    HE2  PHE  20           HE2      PHE  20  33.487   5.652   1.680
  166    HZ   PHE  20           HZ       PHE  20  31.976   4.971   3.521
  167    H    MET  21           HN       MET  21  30.642  12.297  -0.631
  168    HA   MET  21           HA       MET  21  32.432  12.035  -2.793
  169    HB2  MET  21           HB2      MET  21  30.282  13.744  -2.071
  170    HB3  MET  21           HB1      MET  21  31.651  14.772  -2.497
  171    HG2  MET  21           HG2      MET  21  30.647  14.378  -4.583
  172    HG3  MET  21           HG1      MET  21  31.918  13.156  -4.533
  173    HE1  MET  21           HE1      MET  21  30.031  12.971  -6.494
  174    HE2  MET  21           HE2      MET  21  28.893  11.629  -6.420
  175    HE3  MET  21           HE3      MET  21  30.622  11.314  -6.305
  176    H    ALA  22           HN       ALA  22  32.456  14.378  -0.104
  177    HA   ALA  22           HA       ALA  22  34.956  15.530  -0.784
  178    HB1  ALA  22           HB1      ALA  22  33.748  15.385   1.982
  179    HB2  ALA  22           HB2      ALA  22  33.259  16.554   0.756
  180    HB3  ALA  22           HB3      ALA  22  34.908  16.572   1.382
  181    H    TRP  23           HN       TRP  23  34.066  12.819   1.314
  182    HA   TRP  23           HA       TRP  23  36.609  12.430   2.469
  183    HB2  TRP  23           HB2      TRP  23  34.089  11.204   2.599
  184    HB3  TRP  23           HB1      TRP  23  35.209   9.942   2.085
  185    HD1  TRP  23           HD1      TRP  23  34.230  12.009   5.055
  186    HE1  TRP  23           HE1      TRP  23  35.722  11.391   7.067
  187    HE3  TRP  23           HE3      TRP  23  37.738   9.146   2.700
  188    HZ2  TRP  23           HZ2      TRP  23  38.096   9.878   7.601
  189    HZ3  TRP  23           HZ3      TRP  23  39.601   8.129   3.977
  190    HH2  TRP  23           HH2      TRP  23  39.785   8.491   6.423
  191    H    THR  24           HN       THR  24  35.109  10.891  -0.382
  192    HA   THR  24           HA       THR  24  37.185   9.177  -1.076
  193    HB   THR  24           HB       THR  24  36.297   9.626  -3.489
  194    HG1  THR  24           HG1      THR  24  34.818  11.080  -3.635
  195   HG21  THR  24          HG21      THR  24  34.285   8.273  -3.004
  196   HG22  THR  24          HG22      THR  24  34.486   8.604  -1.283
  197   HG23  THR  24          HG23      THR  24  35.699   7.660  -2.150
  198    H    ILE  25           HN       ILE  25  36.635  12.542  -2.190
  199    HA   ILE  25           HA       ILE  25  39.033  12.624  -3.717
  200    HB   ILE  25           HB       ILE  25  37.216  14.202  -4.126
  201   HG12  ILE  25          HG12      ILE  25  39.593  15.765  -3.100
  202   HG13  ILE  25          HG11      ILE  25  39.698  14.754  -4.538
  203   HG21  ILE  25          HG21      ILE  25  36.779  16.034  -2.542
  204   HG22  ILE  25          HG22      ILE  25  37.946  15.340  -1.414
  205   HG23  ILE  25          HG23      ILE  25  36.462  14.466  -1.800
  206   HD11  ILE  25          HD11      ILE  25  38.493  16.217  -5.809
  207   HD12  ILE  25          HD12      ILE  25  38.960  17.386  -4.575
  208   HD13  ILE  25          HD13      ILE  25  37.378  16.614  -4.501
  209    H    GLY  26           HN       GLY  26  38.288  13.301  -0.378
  210    HA2  GLY  26           HA2      GLY  26  40.635  14.647   0.384
  211    HA3  GLY  26           HA1      GLY  26  39.640  13.670   1.461
  212    H    HIS  27           HN       HIS  27  39.867  11.162   0.491
  213    HA   HIS  27           HA       HIS  27  42.428  10.340   1.392
  214    HB2  HIS  27           HB2      HIS  27  40.315   8.961   1.500
  215    HB3  HIS  27           HB1      HIS  27  40.490   8.684  -0.234
  216    HD2  HIS  27           HD2      HIS  27  42.022   7.419   3.104
  217    HE1  HIS  27           HE1      HIS  27  44.228   5.643  -0.027
  218    HE2  HIS  27           HE2      HIS  27  43.827   5.638   2.481
  219    H    LEU  28           HN       LEU  28  41.060  10.902  -1.802
  220    HA   LEU  28           HA       LEU  28  43.059   9.646  -3.346
  221    HB2  LEU  28           HB2      LEU  28  40.829  11.456  -3.797
  222    HB3  LEU  28           HB1      LEU  28  42.205  11.851  -4.827
  223    HG   LEU  28           HG       LEU  28  42.297   9.276  -5.266
  224   HD11  LEU  28          HD11      LEU  28  40.178   8.128  -5.058
  225   HD12  LEU  28          HD12      LEU  28  39.382   9.597  -4.497
  226   HD13  LEU  28          HD13      LEU  28  40.580   8.801  -3.479
  227   HD21  LEU  28          HD21      LEU  28  40.004  10.922  -6.379
  228   HD22  LEU  28          HD22      LEU  28  40.795   9.556  -7.166
  229   HD23  LEU  28          HD23      LEU  28  41.680  11.060  -6.910
  230    H    ASN  29           HN       ASN  29  42.875  12.827  -1.852
  231    HA   ASN  29           HA       ASN  29  44.497  14.405  -1.439
  232    HB2  ASN  29           HB2      ASN  29  45.877  12.260  -1.014
  233    HB3  ASN  29           HB1      ASN  29  46.557  12.548  -2.614
  234   HD21  ASN  29          HD21      ASN  29  48.650  13.275  -2.046
  235   HD22  ASN  29          HD22      ASN  29  48.935  14.643  -1.084
  236    H    GLN  30           HN       GLN  30  46.217  15.736  -2.628
  237    HA   GLN  30           HA       GLN  30  45.162  16.565  -5.118
  238    HB2  GLN  30           HB2      GLN  30  47.133  17.477  -3.272
  239    HB3  GLN  30           HB1      GLN  30  47.864  17.435  -4.877
  240    HG2  GLN  30           HG2      GLN  30  46.815  19.591  -4.625
  241    HG3  GLN  30           HG1      GLN  30  45.829  18.652  -5.743
  242   HE21  GLN  30          HE21      GLN  30  43.634  18.752  -5.282
  243   HE22  GLN  30          HE22      GLN  30  42.972  19.000  -3.739
  244    H    ILE  31           HN       ILE  31  47.164  13.931  -4.349
  245    HA   ILE  31           HA       ILE  31  48.983  13.755  -6.424
  246    HB   ILE  31           HB       ILE  31  48.362  12.127  -4.414
  247   HG12  ILE  31          HG12      ILE  31  49.469  10.281  -6.081
  248   HG13  ILE  31          HG11      ILE  31  49.808  11.764  -6.976
  249   HG21  ILE  31          HG21      ILE  31  47.182  10.651  -6.776
  250   HG22  ILE  31          HG22      ILE  31  46.183  11.526  -5.615
  251   HG23  ILE  31          HG23      ILE  31  47.173  10.171  -5.080
  252   HD11  ILE  31          HD11      ILE  31  50.543  11.191  -4.090
  253   HD12  ILE  31          HD12      ILE  31  50.777  12.746  -4.888
  254   HD13  ILE  31          HD13      ILE  31  51.657  11.324  -5.451
  255    H    LYS  32           HN       LYS  32  45.516  13.414  -6.494
  256    HA   LYS  32           HA       LYS  32  45.155  11.994  -8.873
  257    HB2  LYS  32           HB2      LYS  32  43.237  12.452  -7.536
  258    HB3  LYS  32           HB1      LYS  32  43.523  14.191  -7.592
  259    HG2  LYS  32           HG2      LYS  32  42.759  14.390  -9.773
  260    HG3  LYS  32           HG1      LYS  32  43.156  12.720 -10.175
  261    HD2  LYS  32           HD2      LYS  32  41.153  12.964  -8.038
  262    HD3  LYS  32           HD1      LYS  32  40.626  13.642  -9.579
  263    HE2  LYS  32           HE2      LYS  32  41.991  10.991  -9.649
  264    HE3  LYS  32           HE1      LYS  32  40.345  11.037  -9.018
  265    HZ1  LYS  32           HZ1      LYS  32  40.380  10.671 -11.410
  266    HZ2  LYS  32           HZ2      LYS  32  41.218  12.131 -11.638
  267    HZ3  LYS  32           HZ3      LYS  32  39.631  12.145 -11.033
  268    H    ARG  33           HN       ARG  33  45.551  12.435 -10.949
  269    HA   ARG  33           HA       ARG  33  46.727  14.984 -11.679
  270    HB2  ARG  33           HB2      ARG  33  46.153  12.459 -13.244
  271    HB3  ARG  33           HB1      ARG  33  46.864  13.903 -13.966
  272    HG2  ARG  33           HG2      ARG  33  48.667  13.789 -12.193
  273    HG3  ARG  33           HG1      ARG  33  48.018  12.216 -11.729
  274    HD2  ARG  33           HD2      ARG  33  48.369  11.400 -14.042
  275    HD3  ARG  33           HD1      ARG  33  49.045  12.965 -14.486
  276    HE   ARG  33           HE       ARG  33  50.404  11.805 -12.241
  277   HH11  ARG  33          HH11      ARG  33  50.137  11.806 -15.720
  278   HH12  ARG  33          HH12      ARG  33  51.741  11.207 -15.960
  279   HH21  ARG  33          HH21      ARG  33  52.477  10.975 -12.586
  280   HH22  ARG  33          HH22      ARG  33  53.058  10.736 -14.201
  281    H1   MET   1           HT1      MET   1   2.131  -3.018   6.165
  282    H2   MET   1           HT2      MET   1   2.255  -1.369   5.779
  283    H3   MET   1           HT3      MET   1   3.650  -2.333   5.854
  284    HA   MET   1           HA       MET   1   2.617  -3.706   4.008
  285    HB2  MET   1           HB2      MET   1   0.717  -1.451   4.334
  286    HB3  MET   1           HB1      MET   1   1.162  -1.837   2.671
  287    HG2  MET   1           HG2      MET   1   0.268  -3.945   4.651
  288    HG3  MET   1           HG1      MET   1  -0.857  -3.096   3.590
  289    HE1  MET   1           HE1      MET   1  -0.644  -2.795   1.294
  290    HE2  MET   1           HE2      MET   1  -1.479  -4.341   1.165
  291    HE3  MET   1           HE3      MET   1  -0.097  -4.005   0.127
  292    H    PHE   2           HN       PHE   2   4.939  -3.282   3.833
  293    HA   PHE   2           HA       PHE   2   6.794  -2.365   2.830
  294    HB2  PHE   2           HB2      PHE   2   4.649  -1.448   0.903
  295    HB3  PHE   2           HB1      PHE   2   6.381  -1.336   0.585
  296    HD1  PHE   2           HD1      PHE   2   3.497  -3.580   0.879
  297    HD2  PHE   2           HD2      PHE   2   7.753  -3.375   0.345
  298    HE1  PHE   2           HE1      PHE   2   3.517  -5.947   0.135
  299    HE2  PHE   2           HE2      PHE   2   7.775  -5.741  -0.400
  300    HZ   PHE   2           HZ       PHE   2   5.656  -7.026  -0.505
  301    H    GLU   3           HN       GLU   3   6.549  -0.933   4.909
  302    HA   GLU   3           HA       GLU   3   5.820   1.817   4.446
  303    HB2  GLU   3           HB2      GLU   3   7.217   0.471   6.765
  304    HB3  GLU   3           HB1      GLU   3   6.687   2.154   6.757
  305    HG2  GLU   3           HG2      GLU   3   4.832  -0.185   6.240
  306    HG3  GLU   3           HG1      GLU   3   5.052   0.551   7.827
  307    HA   PRO   4           HA       PRO   4   9.713   3.299   2.891
  308    HB2  PRO   4           HB2      PRO   4   9.784   5.822   3.994
  309    HB3  PRO   4           HB1      PRO   4   8.809   5.384   2.578
  310    HG2  PRO   4           HG2      PRO   4   7.993   5.654   5.429
  311    HG3  PRO   4           HG1      PRO   4   7.140   6.154   3.957
  312    HD2  PRO   4           HD2      PRO   4   6.458   3.902   5.300
  313    HD3  PRO   4           HD1      PRO   4   6.335   4.009   3.529
  314    H    PHE   5           HN       PHE   5   9.054   3.254   6.291
  315    HA   PHE   5           HA       PHE   5  11.500   4.096   7.350
  316    HB2  PHE   5           HB2      PHE   5  10.194   3.735   9.148
  317    HB3  PHE   5           HB1      PHE   5   9.190   2.570   8.283
  318    HD1  PHE   5           HD1      PHE   5  12.476   2.964  10.023
  319    HD2  PHE   5           HD2      PHE   5   9.470   0.246   8.599
  320    HE1  PHE   5           HE1      PHE   5  13.610   1.092  11.197
  321    HE2  PHE   5           HE2      PHE   5  10.599  -1.622   9.774
  322    HZ   PHE   5           HZ       PHE   5  12.672  -1.201  11.069
  323    H    GLN   6           HN       GLN   6  10.495   0.994   6.007
  324    HA   GLN   6           HA       GLN   6  12.714  -0.528   6.838
  325    HB2  GLN   6           HB2      GLN   6  10.692  -1.545   5.896
  326    HB3  GLN   6           HB1      GLN   6  11.049  -0.817   4.329
  327    HG2  GLN   6           HG2      GLN   6  13.139  -2.069   4.178
  328    HG3  GLN   6           HG1      GLN   6  12.887  -2.737   5.788
  329   HE21  GLN   6          HE21      GLN   6  12.357  -4.908   5.491
  330   HE22  GLN   6          HE22      GLN   6  11.207  -5.479   4.382
  331    H    ILE   7           HN       ILE   7  12.207   1.474   3.947
  332    HA   ILE   7           HA       ILE   7  14.611   0.787   2.632
  333    HB   ILE   7           HB       ILE   7  12.942   3.301   2.512
  334   HG12  ILE   7          HG12      ILE   7  13.098   0.978   0.581
  335   HG13  ILE   7          HG11      ILE   7  11.906   1.060   1.881
  336   HG21  ILE   7          HG21      ILE   7  14.089   3.577   0.287
  337   HG22  ILE   7          HG22      ILE   7  15.191   2.281   0.753
  338   HG23  ILE   7          HG23      ILE   7  15.162   3.787   1.670
  339   HD11  ILE   7          HD11      ILE   7  11.080   3.204   1.007
  340   HD12  ILE   7          HD12      ILE   7  10.983   1.951  -0.230
  341   HD13  ILE   7          HD13      ILE   7  12.280   3.145  -0.284
  342    H    LEU   8           HN       LEU   8  13.819   3.607   4.709
  343    HA   LEU   8           HA       LEU   8  16.389   4.751   4.620
  344    HB2  LEU   8           HB2      LEU   8  14.216   5.832   5.389
  345    HB3  LEU   8           HB1      LEU   8  14.447   4.981   6.917
  346    HG   LEU   8           HG       LEU   8  16.864   6.023   6.793
  347   HD11  LEU   8          HD11      LEU   8  16.502   6.936   4.499
  348   HD12  LEU   8          HD12      LEU   8  16.906   8.193   5.669
  349   HD13  LEU   8          HD13      LEU   8  15.236   7.981   5.144
  350   HD21  LEU   8          HD21      LEU   8  15.130   6.514   8.512
  351   HD22  LEU   8          HD22      LEU   8  14.431   7.722   7.433
  352   HD23  LEU   8          HD23      LEU   8  16.057   7.951   8.078
  353    H    SER   9           HN       SER   9  14.929   2.350   6.723
  354    HA   SER   9           HA       SER   9  16.940   2.311   8.716
  355    HB2  SER   9           HB2      SER   9  14.723   1.354   9.067
  356    HB3  SER   9           HB1      SER   9  15.032   0.140   7.831
  357    HG   SER   9           HG       SER   9  15.516  -0.755   9.809
  358    H    ILE  10           HN       ILE  10  16.388   0.177   5.899
  359    HA   ILE  10           HA       ILE  10  18.790  -1.302   6.333
  360    HB   ILE  10           HB       ILE  10  16.744  -2.121   5.103
  361   HG12  ILE  10          HG12      ILE  10  19.284  -2.317   3.471
  362   HG13  ILE  10          HG11      ILE  10  19.076  -3.148   5.013
  363   HG21  ILE  10          HG21      ILE  10  17.927  -0.494   2.836
  364   HG22  ILE  10          HG22      ILE  10  16.455  -0.071   3.711
  365   HG23  ILE  10          HG23      ILE  10  16.515  -1.548   2.751
  366   HD11  ILE  10          HD11      ILE  10  16.959  -4.168   4.064
  367   HD12  ILE  10          HD12      ILE  10  18.449  -4.709   3.293
  368   HD13  ILE  10          HD13      ILE  10  17.430  -3.509   2.497
  369    H    CYS  11           HN       CYS  11  18.031   1.638   4.544
  370    HA   CYS  11           HA       CYS  11  20.385   1.635   2.931
  371    HB2  CYS  11           HB2      CYS  11  18.395   3.736   3.752
  372    HB3  CYS  11           HB1      CYS  11  19.833   4.153   2.819
  373    HG   CYS  11           HG       CYS  11  17.476   3.248   1.482
  374    H    SER  12           HN       SER  12  19.523   3.473   5.911
  375    HA   SER  12           HA       SER  12  22.056   4.627   6.239
  376    HB2  SER  12           HB2      SER  12  20.055   5.461   7.389
  377    HB3  SER  12           HB1      SER  12  19.967   3.976   8.331
  378    HG   SER  12           HG       SER  12  21.183   5.122   9.639
  379    H    PHE  13           HN       PHE  13  20.683   1.595   7.440
  380    HA   PHE  13           HA       PHE  13  22.749   0.902   9.205
  381    HB2  PHE  13           HB2      PHE  13  20.508  -0.225   8.998
  382    HB3  PHE  13           HB1      PHE  13  21.112  -1.020   7.543
  383    HD1  PHE  13           HD1      PHE  13  21.814  -0.520  11.171
  384    HD2  PHE  13           HD2      PHE  13  22.476  -2.949   7.690
  385    HE1  PHE  13           HE1      PHE  13  22.936  -2.224  12.576
  386    HE2  PHE  13           HE2      PHE  13  23.600  -4.656   9.097
  387    HZ   PHE  13           HZ       PHE  13  23.830  -4.293  11.540
  388    H    ILE  14           HN       ILE  14  22.341   0.170   5.721
  389    HA   ILE  14           HA       ILE  14  24.692  -1.370   5.439
  390    HB   ILE  14           HB       ILE  14  23.091   0.269   3.472
  391   HG12  ILE  14          HG12      ILE  14  23.440  -2.728   3.720
  392   HG13  ILE  14          HG11      ILE  14  22.161  -1.849   4.555
  393   HG21  ILE  14          HG21      ILE  14  25.544  -1.451   3.048
  394   HG22  ILE  14          HG22      ILE  14  25.290   0.219   2.538
  395   HG23  ILE  14          HG23      ILE  14  24.404  -1.088   1.752
  396   HD11  ILE  14          HD11      ILE  14  22.608  -1.766   1.556
  397   HD12  ILE  14          HD12      ILE  14  21.261  -1.049   2.441
  398   HD13  ILE  14          HD13      ILE  14  21.427  -2.802   2.355
  399    H    LEU  15           HN       LEU  15  24.112   2.120   4.960
  400    HA   LEU  15           HA       LEU  15  26.741   2.734   4.100
  401    HB2  LEU  15           HB2      LEU  15  24.580   4.434   5.356
  402    HB3  LEU  15           HB1      LEU  15  26.077   5.082   4.686
  403    HG   LEU  15           HG       LEU  15  24.162   3.354   3.095
  404   HD11  LEU  15          HD11      LEU  15  24.437   6.367   2.946
  405   HD12  LEU  15          HD12      LEU  15  23.190   5.574   3.909
  406   HD13  LEU  15          HD13      LEU  15  23.227   5.352   2.161
  407   HD21  LEU  15          HD21      LEU  15  25.432   4.523   1.202
  408   HD22  LEU  15          HD22      LEU  15  26.355   3.343   2.133
  409   HD23  LEU  15          HD23      LEU  15  26.570   5.069   2.433
  410    H    SER  16           HN       SER  16  25.328   2.314   7.267
  411    HA   SER  16           HA       SER  16  27.412   3.696   8.700
  412    HB2  SER  16           HB2      SER  16  26.360   2.875  10.689
  413    HB3  SER  16           HB1      SER  16  25.071   3.308   9.569
  414    HG   SER  16           HG       SER  16  25.531   0.968  10.709
  415    H    ALA  17           HN       ALA  17  26.674   0.332   7.909
  416    HA   ALA  17           HA       ALA  17  28.815  -0.820   9.384
  417    HB1  ALA  17           HB1      ALA  17  28.418  -2.740   7.667
  418    HB2  ALA  17           HB2      ALA  17  27.034  -1.769   7.160
  419    HB3  ALA  17           HB3      ALA  17  27.143  -2.349   8.822
  420    H    LEU  18           HN       LEU  18  28.462   0.281   6.035
  421    HA   LEU  18           HA       LEU  18  31.026  -0.649   5.208
  422    HB2  LEU  18           HB2      LEU  18  29.132   1.399   4.027
  423    HB3  LEU  18           HB1      LEU  18  30.596   0.816   3.232
  424    HG   LEU  18           HG       LEU  18  28.354  -0.999   4.168
  425   HD11  LEU  18          HD11      LEU  18  27.722  -1.136   1.784
  426   HD12  LEU  18          HD12      LEU  18  28.952   0.066   1.389
  427   HD13  LEU  18          HD13      LEU  18  27.567   0.516   2.383
  428   HD21  LEU  18          HD21      LEU  18  29.532  -2.538   2.482
  429   HD22  LEU  18          HD22      LEU  18  30.398  -2.226   3.986
  430   HD23  LEU  18          HD23      LEU  18  30.860  -1.378   2.510
  431    H    HIS  19           HN       HIS  19  29.777   2.298   6.698
  432    HA   HIS  19           HA       HIS  19  31.992   3.971   6.129
  433    HB2  HIS  19           HB2      HIS  19  29.838   4.871   6.853
  434    HB3  HIS  19           HB1      HIS  19  29.992   4.038   8.400
  435    HD2  HIS  19           HD2      HIS  19  31.327   5.520  10.320
  436    HE1  HIS  19           HE1      HIS  19  33.077   8.371   7.745
  437    HE2  HIS  19           HE2      HIS  19  32.751   7.704  10.173
  438    H    PHE  20           HN       PHE  20  31.153   1.962   8.964
  439    HA   PHE  20           HA       PHE  20  33.564   2.611  10.349
  440    HB2  PHE  20           HB2      PHE  20  31.223   0.971  10.854
  441    HB3  PHE  20           HB1      PHE  20  32.707   0.153  11.348
  442    HD1  PHE  20           HD1      PHE  20  30.417   2.897  12.044
  443    HD2  PHE  20           HD2      PHE  20  34.318   1.306  12.890
  444    HE1  PHE  20           HE1      PHE  20  30.591   4.372  14.031
  445    HE2  PHE  20           HE2      PHE  20  34.490   2.780  14.877
  446    HZ   PHE  20           HZ       PHE  20  32.624   4.310  15.448
  447    H    MET  21           HN       MET  21  32.665   0.246   7.957
  448    HA   MET  21           HA       MET  21  34.763  -1.598   8.350
  449    HB2  MET  21           HB2      MET  21  32.676  -1.194   6.469
  450    HB3  MET  21           HB1      MET  21  34.181  -1.349   5.560
  451    HG2  MET  21           HG2      MET  21  33.520  -3.587   5.827
  452    HG3  MET  21           HG1      MET  21  34.656  -3.359   7.157
  453    HE1  MET  21           HE1      MET  21  33.129  -5.618   7.143
  454    HE2  MET  21           HE2      MET  21  31.882  -5.781   8.376
  455    HE3  MET  21           HE3      MET  21  33.532  -5.386   8.850
  456    H    ALA  22           HN       ALA  22  34.536   1.146   6.062
  457    HA   ALA  22           HA       ALA  22  37.199   0.920   5.132
  458    HB1  ALA  22           HB1      ALA  22  35.527   3.439   5.215
  459    HB2  ALA  22           HB2      ALA  22  35.356   2.187   3.985
  460    HB3  ALA  22           HB3      ALA  22  36.869   3.083   4.126
  461    H    TRP  23           HN       TRP  23  35.738   2.755   7.787
  462    HA   TRP  23           HA       TRP  23  38.006   4.304   8.422
  463    HB2  TRP  23           HB2      TRP  23  35.405   3.968   9.418
  464    HB3  TRP  23           HB1      TRP  23  36.484   3.611  10.769
  465    HD1  TRP  23           HD1      TRP  23  35.192   6.438   8.669
  466    HE1  TRP  23           HE1      TRP  23  36.261   8.652   9.449
  467    HE3  TRP  23           HE3      TRP  23  38.792   4.619  11.796
  468    HZ2  TRP  23           HZ2      TRP  23  38.372   9.531  11.179
  469    HZ3  TRP  23           HZ3      TRP  23  40.316   6.159  12.997
  470    HH2  TRP  23           HH2      TRP  23  40.110   8.611  12.693
  471    H    THR  24           HN       THR  24  36.884   1.195   9.775
  472    HA   THR  24           HA       THR  24  38.893   0.802  11.655
  473    HB   THR  24           HB       THR  24  38.470  -1.711  11.084
  474    HG1  THR  24           HG1      THR  24  37.174  -2.053   9.497
  475   HG21  THR  24          HG21      THR  24  36.299  -1.614  12.261
  476   HG22  THR  24          HG22      THR  24  36.231   0.126  11.978
  477   HG23  THR  24          HG23      THR  24  37.489  -0.554  13.012
  478    H    ILE  25           HN       ILE  25  38.834  -0.280   8.231
  479    HA   ILE  25           HA       ILE  25  41.452  -1.379   8.346
  480    HB   ILE  25           HB       ILE  25  39.876  -2.037   6.602
  481   HG12  ILE  25          HG12      ILE  25  42.169  -0.576   5.276
  482   HG13  ILE  25          HG11      ILE  25  42.433  -2.007   6.268
  483   HG21  ILE  25          HG21      ILE  25  39.333  -0.491   4.766
  484   HG22  ILE  25          HG22      ILE  25  40.229   0.793   5.580
  485   HG23  ILE  25          HG23      ILE  25  38.763   0.135   6.311
  486   HD11  ILE  25          HD11      ILE  25  41.593  -3.416   4.681
  487   HD12  ILE  25          HD12      ILE  25  41.937  -2.085   3.580
  488   HD13  ILE  25          HD13      ILE  25  40.306  -2.303   4.209
  489    H    GLY  26           HN       GLY  26  40.214   1.816   7.662
  490    HA2  GLY  26           HA2      GLY  26  42.505   2.993   6.542
  491    HA3  GLY  26           HA1      GLY  26  41.263   3.857   7.446
  492    H    HIS  27           HN       HIS  27  41.432   2.865   9.943
  493    HA   HIS  27           HA       HIS  27  43.722   4.151  11.011
  494    HB2  HIS  27           HB2      HIS  27  41.510   3.859  12.196
  495    HB3  HIS  27           HB1      HIS  27  41.956   2.171  12.459
  496    HD2  HIS  27           HD2      HIS  27  42.777   5.676  13.914
  497    HE1  HIS  27           HE1      HIS  27  45.331   2.912  15.823
  498    HE2  HIS  27           HE2      HIS  27  44.504   5.312  15.838
  499    H    LEU  28           HN       LEU  28  42.973   0.792  10.272
  500    HA   LEU  28           HA       LEU  28  45.091  -0.431  11.680
  501    HB2  LEU  28           HB2      LEU  28  43.135  -1.193   9.669
  502    HB3  LEU  28           HB1      LEU  28  44.695  -1.965   9.384
  503    HG   LEU  28           HG       LEU  28  44.635  -2.460  11.950
  504   HD11  LEU  28          HD11      LEU  28  42.422  -2.648  12.904
  505   HD12  LEU  28          HD12      LEU  28  41.672  -2.183  11.377
  506   HD13  LEU  28          HD13      LEU  28  42.606  -1.003  12.297
  507   HD21  LEU  28          HD21      LEU  28  42.717  -3.893  10.087
  508   HD22  LEU  28          HD22      LEU  28  43.510  -4.578  11.506
  509   HD23  LEU  28          HD23      LEU  28  44.465  -4.130  10.091
  510    H    ASN  29           HN       ASN  29  44.927   1.113   8.523
  511    HA   ASN  29           HA       ASN  29  46.583   1.843   7.103
  512    HB2  ASN  29           HB2      ASN  29  47.683   2.425   9.369
  513    HB3  ASN  29           HB1      ASN  29  48.648   0.973   9.116
  514   HD21  ASN  29          HD21      ASN  29  50.667   1.909   8.589
  515   HD22  ASN  29          HD22      ASN  29  50.900   2.950   7.269
  516    H    GLN  30           HN       GLN  30  48.590   1.005   5.910
  517    HA   GLN  30           HA       GLN  30  48.047  -1.600   4.949
  518    HB2  GLN  30           HB2      GLN  30  49.745   0.578   4.246
  519    HB3  GLN  30           HB1      GLN  30  50.733  -0.881   4.328
  520    HG2  GLN  30           HG2      GLN  30  49.845  -0.744   2.092
  521    HG3  GLN  30           HG1      GLN  30  48.987  -2.041   2.921
  522   HE21  GLN  30          HE21      GLN  30  46.762  -1.950   2.634
  523   HE22  GLN  30          HE22      GLN  30  45.872  -0.534   2.350
  524    H    ILE  31           HN       ILE  31  49.655  -0.590   7.763
  525    HA   ILE  31           HA       ILE  31  51.779  -2.335   8.069
  526    HB   ILE  31           HB       ILE  31  50.687  -0.511   9.667
  527   HG12  ILE  31          HG12      ILE  31  51.902  -2.023  11.577
  528   HG13  ILE  31          HG11      ILE  31  52.514  -2.802  10.116
  529   HG21  ILE  31          HG21      ILE  31  49.806  -3.082  10.994
  530   HG22  ILE  31          HG22      ILE  31  48.702  -2.084  10.048
  531   HG23  ILE  31          HG23      ILE  31  49.465  -1.427  11.495
  532   HD11  ILE  31          HD11      ILE  31  52.695   0.147  10.799
  533   HD12  ILE  31          HD12      ILE  31  53.191  -0.550   9.257
  534   HD13  ILE  31          HD13      ILE  31  54.033  -1.002  10.740
  535    H    LYS  32           HN       LYS  32  48.361  -2.999   8.089
  536    HA   LYS  32           HA       LYS  32  48.291  -5.448   9.433
  537    HB2  LYS  32           HB2      LYS  32  46.218  -4.441   8.829
  538    HB3  LYS  32           HB1      LYS  32  46.660  -4.389   7.121
  539    HG2  LYS  32           HG2      LYS  32  46.296  -6.662   6.815
  540    HG3  LYS  32           HG1      LYS  32  46.612  -7.046   8.509
  541    HD2  LYS  32           HD2      LYS  32  44.303  -5.269   8.122
  542    HD3  LYS  32           HD1      LYS  32  44.105  -6.855   7.375
  543    HE2  LYS  32           HE2      LYS  32  45.232  -6.776  10.135
  544    HE3  LYS  32           HE1      LYS  32  43.513  -6.429   9.953
  545    HZ1  LYS  32           HZ1      LYS  32  43.919  -8.792  10.281
  546    HZ2  LYS  32           HZ2      LYS  32  44.908  -8.831   8.900
  547    HZ3  LYS  32           HZ3      LYS  32  43.248  -8.500   8.751
  548    H    ARG  33           HN       ARG  33  49.071  -7.413   8.996
  549    HA   ARG  33           HA       ARG  33  50.569  -7.855   6.552
  550    HB2  ARG  33           HB2      ARG  33  50.055  -9.571   8.989
  551    HB3  ARG  33           HB1      ARG  33  51.000 -10.117   7.605
  552    HG2  ARG  33           HG2      ARG  33  52.457  -8.072   7.909
  553    HG3  ARG  33           HG1      ARG  33  51.605  -7.773   9.424
  554    HD2  ARG  33           HD2      ARG  33  52.273 -10.017  10.232
  555    HD3  ARG  33           HD1      ARG  33  53.147 -10.292   8.728
  556    HE   ARG  33           HE       ARG  33  53.999  -7.888  10.042
  557   HH11  ARG  33          HH11      ARG  33  54.330 -11.359   9.957
  558   HH12  ARG  33          HH12      ARG  33  55.896 -11.346  10.693
  559   HH21  ARG  33          HH21      ARG  33  56.021  -7.906  11.048
  560   HH22  ARG  33          HH22      ARG  33  56.849  -9.405  11.309
  561    H1   MET   1           HT1      MET   1   1.859   2.031  19.979
  562    H2   MET   1           HT2      MET   1   2.228   1.682  18.358
  563    H3   MET   1           HT3      MET   1   3.477   1.975  19.472
  564    HA   MET   1           HA       MET   1   2.606  -0.022  20.740
  565    HB2  MET   1           HB2      MET   1   0.945   0.008  18.283
  566    HB3  MET   1           HB1      MET   1   1.604  -1.563  18.736
  567    HG2  MET   1           HG2      MET   1   0.173   0.232  20.707
  568    HG3  MET   1           HG1      MET   1  -0.665  -0.988  19.750
  569    HE1  MET   1           HE1      MET   1  -0.052  -3.218  19.496
  570    HE2  MET   1           HE2      MET   1  -1.023  -3.498  20.940
  571    HE3  MET   1           HE3      MET   1   0.539  -4.292  20.770
  572    H    PHE   2           HN       PHE   2   4.958   0.178  20.585
  573    HA   PHE   2           HA       PHE   2   7.042  -0.506  19.891
  574    HB2  PHE   2           HB2      PHE   2   5.349  -2.743  18.758
  575    HB3  PHE   2           HB1      PHE   2   7.111  -2.779  18.842
  576    HD1  PHE   2           HD1      PHE   2   3.986  -2.971  20.749
  577    HD2  PHE   2           HD2      PHE   2   8.270  -2.814  21.021
  578    HE1  PHE   2           HE1      PHE   2   3.862  -3.721  23.110
  579    HE2  PHE   2           HE2      PHE   2   8.147  -3.564  23.382
  580    HZ   PHE   2           HZ       PHE   2   5.943  -4.018  24.426
  581    H    GLU   3           HN       GLU   3   6.626   1.519  18.422
  582    HA   GLU   3           HA       GLU   3   6.294   0.969  15.613
  583    HB2  GLU   3           HB2      GLU   3   7.142   3.471  17.082
  584    HB3  GLU   3           HB1      GLU   3   6.813   3.391  15.350
  585    HG2  GLU   3           HG2      GLU   3   4.814   2.566  17.472
  586    HG3  GLU   3           HG1      GLU   3   4.858   4.171  16.748
  587    HA   PRO   4           HA       PRO   4  10.524   0.072  14.590
  588    HB2  PRO   4           HB2      PRO   4  10.684   1.209  12.095
  589    HB3  PRO   4           HB1      PRO   4   9.927  -0.358  12.418
  590    HG2  PRO   4           HG2      PRO   4   8.688   2.319  12.033
  591    HG3  PRO   4           HG1      PRO   4   8.148   0.731  11.459
  592    HD2  PRO   4           HD2      PRO   4   7.011   1.932  13.607
  593    HD3  PRO   4           HD1      PRO   4   7.188   0.164  13.503
  594    H    PHE   5           HN       PHE   5   9.328   3.324  14.527
  595    HA   PHE   5           HA       PHE   5  11.649   4.769  13.950
  596    HB2  PHE   5           HB2      PHE   5  10.038   6.327  14.148
  597    HB3  PHE   5           HB1      PHE   5   9.063   5.302  15.201
  598    HD1  PHE   5           HD1      PHE   5  12.039   7.563  15.156
  599    HD2  PHE   5           HD2      PHE   5   9.030   5.637  17.542
  600    HE1  PHE   5           HE1      PHE   5  12.742   8.898  17.126
  601    HE2  PHE   5           HE2      PHE   5   9.733   6.972  19.508
  602    HZ   PHE   5           HZ       PHE   5  11.588   8.606  19.301
  603    H    GLN   6           HN       GLN   6  10.532   3.267  16.942
  604    HA   GLN   6           HA       GLN   6  12.413   4.421  18.686
  605    HB2  GLN   6           HB2      GLN   6  10.471   3.159  19.483
  606    HB3  GLN   6           HB1      GLN   6  11.151   1.675  18.812
  607    HG2  GLN   6           HG2      GLN   6  13.088   1.846  20.290
  608    HG3  GLN   6           HG1      GLN   6  12.510   3.391  20.911
  609   HE21  GLN   6          HE21      GLN   6  11.791   2.996  23.011
  610   HE22  GLN   6          HE22      GLN   6  10.778   1.710  23.460
  611    H    ILE   7           HN       ILE   7  12.594   1.498  16.690
  612    HA   ILE   7           HA       ILE   7  15.093   0.580  17.633
  613    HB   ILE   7           HB       ILE   7  13.755   0.216  14.948
  614   HG12  ILE   7          HG12      ILE   7  13.955  -1.686  17.293
  615   HG13  ILE   7          HG11      ILE   7  12.588  -0.594  17.065
  616   HG21  ILE   7          HG21      ILE   7  15.267  -1.796  14.825
  617   HG22  ILE   7          HG22      ILE   7  16.129  -1.169  16.230
  618   HG23  ILE   7          HG23      ILE   7  16.122  -0.256  14.719
  619   HD11  ILE   7          HD11      ILE   7  12.156  -1.572  14.855
  620   HD12  ILE   7          HD12      ILE   7  12.131  -2.824  16.097
  621   HD13  ILE   7          HD13      ILE   7  13.540  -2.646  15.050
  622    H    LEU   8           HN       LEU   8  14.292   2.528  14.740
  623    HA   LEU   8           HA       LEU   8  16.959   2.862  13.876
  624    HB2  LEU   8           HB2      LEU   8  14.826   3.279  12.551
  625    HB3  LEU   8           HB1      LEU   8  14.711   4.817  13.406
  626    HG   LEU   8           HG       LEU   8  17.218   5.092  12.643
  627   HD11  LEU   8          HD11      LEU   8  17.333   2.777  11.719
  628   HD12  LEU   8          HD12      LEU   8  17.685   4.008  10.504
  629   HD13  LEU   8          HD13      LEU   8  16.107   3.222  10.530
  630   HD21  LEU   8          HD21      LEU   8  15.300   6.516  11.942
  631   HD22  LEU   8          HD22      LEU   8  14.918   5.349  10.676
  632   HD23  LEU   8          HD23      LEU   8  16.437   6.245  10.620
  633    H    SER   9           HN       SER   9  14.917   4.689  16.071
  634    HA   SER   9           HA       SER   9  16.566   6.975  16.318
  635    HB2  SER   9           HB2      SER   9  14.230   6.966  17.023
  636    HB3  SER   9           HB1      SER   9  14.593   5.778  18.270
  637    HG   SER   9           HG       SER   9  14.650   7.810  19.190
  638    H    ILE  10           HN       ILE  10  16.237   4.098  18.413
  639    HA   ILE  10           HA       ILE  10  18.360   4.891  20.144
  640    HB   ILE  10           HB       ILE  10  16.463   3.335  20.736
  641   HG12  ILE  10          HG12      ILE  10  19.195   2.134  21.231
  642   HG13  ILE  10          HG11      ILE  10  18.650   3.617  22.017
  643   HG21  ILE  10          HG21      ILE  10  18.176   1.309  19.268
  644   HG22  ILE  10          HG22      ILE  10  16.632   1.931  18.681
  645   HG23  ILE  10          HG23      ILE  10  16.690   0.979  20.164
  646   HD11  ILE  10          HD11      ILE  10  16.614   2.334  22.808
  647   HD12  ILE  10          HD12      ILE  10  18.139   1.804  23.516
  648   HD13  ILE  10          HD13      ILE  10  17.397   0.867  22.220
  649    H    CYS  11           HN       CYS  11  18.232   3.015  17.167
  650    HA   CYS  11           HA       CYS  11  20.804   1.814  17.434
  651    HB2  CYS  11           HB2      CYS  11  18.953   2.322  15.118
  652    HB3  CYS  11           HB1      CYS  11  20.560   1.640  14.870
  653    HG   CYS  11           HG       CYS  11  18.363  -0.068  15.526
  654    H    SER  12           HN       SER  12  19.679   4.627  15.492
  655    HA   SER  12           HA       SER  12  22.241   5.373  14.612
  656    HB2  SER  12           HB2      SER  12  20.185   6.192  13.552
  657    HB3  SER  12           HB1      SER  12  19.783   7.095  15.010
  658    HG   SER  12           HG       SER  12  20.891   8.592  13.992
  659    H    PHE  13           HN       PHE  13  20.362   6.316  17.466
  660    HA   PHE  13           HA       PHE  13  22.030   8.380  18.367
  661    HB2  PHE  13           HB2      PHE  13  19.742   7.802  19.240
  662    HB3  PHE  13           HB1      PHE  13  20.481   6.458  20.111
  663    HD1  PHE  13           HD1      PHE  13  20.639  10.155  19.658
  664    HD2  PHE  13           HD2      PHE  13  21.575   6.806  22.179
  665    HE1  PHE  13           HE1      PHE  13  21.322  11.709  21.467
  666    HE2  PHE  13           HE2      PHE  13  22.255   8.360  23.989
  667    HZ   PHE  13           HZ       PHE  13  22.129  10.812  23.633
  668    H    ILE  14           HN       ILE  14  22.101   4.882  19.096
  669    HA   ILE  14           HA       ILE  14  24.288   4.962  20.880
  670    HB   ILE  14           HB       ILE  14  23.220   2.773  19.092
  671   HG12  ILE  14          HG12      ILE  14  23.181   3.050  22.106
  672   HG13  ILE  14          HG11      ILE  14  21.893   3.678  21.081
  673   HG21  ILE  14          HG21      ILE  14  25.498   2.740  21.082
  674   HG22  ILE  14          HG22      ILE  14  25.520   2.206  19.402
  675   HG23  ILE  14          HG23      ILE  14  24.631   1.279  20.611
  676   HD11  ILE  14          HD11      ILE  14  22.819   0.789  21.081
  677   HD12  ILE  14          HD12      ILE  14  21.441   1.453  20.205
  678   HD13  ILE  14          HD13      ILE  14  21.414   1.384  21.965
  679    H    LEU  15           HN       LEU  15  24.175   4.427  17.369
  680    HA   LEU  15           HA       LEU  15  26.965   4.004  17.040
  681    HB2  LEU  15           HB2      LEU  15  24.834   4.907  15.096
  682    HB3  LEU  15           HB1      LEU  15  26.482   4.492  14.629
  683    HG   LEU  15           HG       LEU  15  24.663   2.602  16.146
  684   HD11  LEU  15          HD11      LEU  15  25.305   2.521  13.188
  685   HD12  LEU  15          HD12      LEU  15  23.837   3.263  13.820
  686   HD13  LEU  15          HD13      LEU  15  24.129   1.541  14.065
  687   HD21  LEU  15          HD21      LEU  15  26.348   0.946  15.151
  688   HD22  LEU  15          HD22      LEU  15  26.963   2.002  16.422
  689   HD23  LEU  15          HD23      LEU  15  27.331   2.351  14.733
  690    H    SER  16           HN       SER  16  25.027   6.893  17.284
  691    HA   SER  16           HA       SER  16  26.990   8.657  16.117
  692    HB2  SER  16           HB2      SER  16  25.547  10.445  16.794
  693    HB3  SER  16           HB1      SER  16  24.509   9.135  16.237
  694    HG   SER  16           HG       SER  16  24.528  10.319  18.600
  695    H    ALA  17           HN       ALA  17  26.013   7.737  19.389
  696    HA   ALA  17           HA       ALA  17  27.753   9.520  20.756
  697    HB1  ALA  17           HB1      ALA  17  27.430   7.740  22.633
  698    HB2  ALA  17           HB2      ALA  17  26.263   7.028  21.518
  699    HB3  ALA  17           HB3      ALA  17  26.035   8.678  22.097
  700    H    LEU  18           HN       LEU  18  28.059   6.169  19.675
  701    HA   LEU  18           HA       LEU  18  30.611   5.754  20.874
  702    HB2  LEU  18           HB2      LEU  18  29.176   4.304  18.638
  703    HB3  LEU  18           HB1      LEU  18  30.673   3.751  19.388
  704    HG   LEU  18           HG       LEU  18  28.121   4.293  20.933
  705   HD11  LEU  18          HD11      LEU  18  27.873   1.838  21.020
  706   HD12  LEU  18          HD12      LEU  18  29.279   1.658  19.969
  707   HD13  LEU  18          HD13      LEU  18  27.811   2.418  19.355
  708   HD21  LEU  18          HD21      LEU  18  29.376   2.810  22.611
  709   HD22  LEU  18          HD22      LEU  18  30.021   4.435  22.381
  710   HD23  LEU  18          HD23      LEU  18  30.803   3.059  21.606
  711    H    HIS  19           HN       HIS  19  29.481   7.041  17.783
  712    HA   HIS  19           HA       HIS  19  31.931   6.859  16.384
  713    HB2  HIS  19           HB2      HIS  19  29.806   7.231  15.238
  714    HB3  HIS  19           HB1      HIS  19  29.608   8.775  16.067
  715    HD2  HIS  19           HD2      HIS  19  30.772  10.899  14.727
  716    HE1  HIS  19           HE1      HIS  19  33.232   8.671  12.118
  717    HE2  HIS  19           HE2      HIS  19  32.437  11.008  12.720
  718    H    PHE  20           HN       PHE  20  30.428   9.501  18.270
  719    HA   PHE  20           HA       PHE  20  32.641  11.265  17.865
  720    HB2  PHE  20           HB2      PHE  20  30.083  11.375  19.234
  721    HB3  PHE  20           HB1      PHE  20  31.370  12.095  20.206
  722    HD1  PHE  20           HD1      PHE  20  29.316  12.431  17.214
  723    HD2  PHE  20           HD2      PHE  20  32.824  13.888  19.222
  724    HE1  PHE  20           HE1      PHE  20  29.332  14.429  15.740
  725    HE2  PHE  20           HE2      PHE  20  32.838  15.884  17.749
  726    HZ   PHE  20           HZ       PHE  20  31.094  16.154  16.006
  727    H    MET  21           HN       MET  21  31.875   8.751  20.154
  728    HA   MET  21           HA       MET  21  33.672   9.452  22.206
  729    HB2  MET  21           HB2      MET  21  31.972   7.263  21.589
  730    HB3  MET  21           HB1      MET  21  33.578   6.607  21.922
  731    HG2  MET  21           HG2      MET  21  32.628   6.745  24.067
  732    HG3  MET  21           HG1      MET  21  33.558   8.240  23.957
  733    HE1  MET  21           HE1      MET  21  31.802   7.961  26.026
  734    HE2  MET  21           HE2      MET  21  30.365   8.980  26.034
  735    HE3  MET  21           HE3      MET  21  31.955   9.712  25.828
  736    H    ALA  22           HN       ALA  22  34.112   7.185  19.493
  737    HA   ALA  22           HA       ALA  22  36.856   6.688  20.006
  738    HB1  ALA  22           HB1      ALA  22  35.489   6.520  17.317
  739    HB2  ALA  22           HB2      ALA  22  35.377   5.270  18.556
  740    HB3  ALA  22           HB3      ALA  22  36.939   5.658  17.835
  741    H    TRP  23           HN       TRP  23  35.199   9.090  17.999
  742    HA   TRP  23           HA       TRP  23  37.496  10.093  16.703
  743    HB2  TRP  23           HB2      TRP  23  34.747  10.656  16.734
  744    HB3  TRP  23           HB1      TRP  23  35.548  12.158  17.197
  745    HD1  TRP  23           HD1      TRP  23  34.935   9.904  14.264
  746    HE1  TRP  23           HE1      TRP  23  36.107  10.863  12.176
  747    HE3  TRP  23           HE3      TRP  23  37.763  13.550  16.444
  748    HZ2  TRP  23           HZ2      TRP  23  37.998  12.913  11.522
  749    HZ3  TRP  23           HZ3      TRP  23  39.238  14.991  15.072
  750    HH2  TRP  23           HH2      TRP  23  39.360  14.678  12.615
  751    H    THR  24           HN       THR  24  35.830  11.223  19.652
  752    HA   THR  24           HA       THR  24  37.452  13.398  20.249
  753    HB   THR  24           HB       THR  24  36.850  12.739  22.704
  754    HG1  THR  24           HG1      THR  24  35.796  10.960  22.909
  755   HG21  THR  24          HG21      THR  24  34.541  13.553  22.357
  756   HG22  THR  24          HG22      THR  24  34.717  13.287  20.621
  757   HG23  THR  24          HG23      THR  24  35.708  14.499  21.434
  758    H    ILE  25           HN       ILE  25  37.820  10.007  21.359
  759    HA   ILE  25           HA       ILE  25  40.253  10.521  22.736
  760    HB   ILE  25           HB       ILE  25  38.913   8.542  23.228
  761   HG12  ILE  25          HG12      ILE  25  41.538   7.616  22.045
  762   HG13  ILE  25          HG11      ILE  25  41.474   8.625  23.486
  763   HG21  ILE  25          HG21      ILE  25  38.850   6.658  21.647
  764   HG22  ILE  25          HG22      ILE  25  39.738   7.618  20.463
  765   HG23  ILE  25          HG23      ILE  25  38.110   8.096  20.947
  766   HD11  ILE  25          HD11      ILE  25  40.753   6.909  24.808
  767   HD12  ILE  25          HD12      ILE  25  41.411   5.889  23.531
  768   HD13  ILE  25          HD13      ILE  25  39.686   6.248  23.565
  769    H    GLY  26           HN       GLY  26  39.504   9.676  19.438
  770    HA2  GLY  26           HA2      GLY  26  42.061   8.953  18.523
  771    HA3  GLY  26           HA1      GLY  26  40.793   9.650  17.519
  772    H    HIS  27           HN       HIS  27  40.450  12.137  18.508
  773    HA   HIS  27           HA       HIS  27  42.666  13.569  17.468
  774    HB2  HIS  27           HB2      HIS  27  40.275  14.380  17.502
  775    HB3  HIS  27           HB1      HIS  27  40.481  14.697  19.226
  776    HD2  HIS  27           HD2      HIS  27  41.445  16.293  15.819
  777    HE1  HIS  27           HE1      HIS  27  43.326  18.571  18.833
  778    HE2  HIS  27           HE2      HIS  27  42.785  18.469  16.355
  779    H    LEU  28           HN       LEU  28  41.672  12.698  20.730
  780    HA   LEU  28           HA       LEU  28  43.389  14.408  22.170
  781    HB2  LEU  28           HB2      LEU  28  41.710  12.103  22.728
  782    HB3  LEU  28           HB1      LEU  28  43.199  12.067  23.670
  783    HG   LEU  28           HG       LEU  28  42.674  14.585  24.134
  784   HD11  LEU  28          HD11      LEU  28  40.330  15.170  24.064
  785   HD12  LEU  28          HD12      LEU  28  39.892  13.547  23.530
  786   HD13  LEU  28          HD13      LEU  28  40.793  14.616  22.455
  787   HD21  LEU  28          HD21      LEU  28  40.930  12.425  25.360
  788   HD22  LEU  28          HD22      LEU  28  41.404  13.945  26.116
  789   HD23  LEU  28          HD23      LEU  28  42.616  12.707  25.790
  790    H    ASN  29           HN       ASN  29  43.910  11.278  20.649
  791    HA   ASN  29           HA       ASN  29  45.844  10.148  20.125
  792    HB2  ASN  29           HB2      ASN  29  46.623  12.567  19.641
  793    HB3  ASN  29           HB1      ASN  29  47.447  12.464  21.195
  794   HD21  ASN  29          HD21      ASN  29  49.617  12.275  20.497
  795   HD22  ASN  29          HD22      ASN  29  50.174  11.017  19.504
  796    H    GLN  30           HN       GLN  30  47.908   9.290  21.193
  797    HA   GLN  30           HA       GLN  30  47.241   8.234  23.729
  798    HB2  GLN  30           HB2      GLN  30  49.265   7.832  21.763
  799    HB3  GLN  30           HB1      GLN  30  50.054   8.059  23.324
  800    HG2  GLN  30           HG2      GLN  30  49.559   5.710  23.106
  801    HG3  GLN  30           HG1      GLN  30  48.438   6.378  24.289
  802   HE21  GLN  30          HE21      GLN  30  46.314   5.737  23.951
  803   HE22  GLN  30          HE22      GLN  30  45.646   5.327  22.446
  804    H    ILE  31           HN       ILE  31  48.480  11.277  22.877
  805    HA   ILE  31           HA       ILE  31  50.318  11.907  24.845
  806    HB   ILE  31           HB       ILE  31  49.193  13.324  22.894
  807   HG12  ILE  31          HG12      ILE  31  49.907  15.392  24.514
  808   HG13  ILE  31          HG11      ILE  31  50.656  14.043  25.370
  809   HG21  ILE  31          HG21      ILE  31  47.828  14.469  25.340
  810   HG22  ILE  31          HG22      ILE  31  47.009  13.368  24.232
  811   HG23  ILE  31          HG23      ILE  31  47.598  14.924  23.651
  812   HD11  ILE  31          HD11      ILE  31  51.052  14.770  22.454
  813   HD12  ILE  31          HD12      ILE  31  51.709  13.322  23.218
  814   HD13  ILE  31          HD13      ILE  31  52.245  14.917  23.746
  815    H    LYS  32           HN       LYS  32  46.888  11.373  25.124
  816    HA   LYS  32           HA       LYS  32  46.327  12.665  27.533
  817    HB2  LYS  32           HB2      LYS  32  44.504  11.744  26.308
  818    HB3  LYS  32           HB1      LYS  32  45.218  10.131  26.324
  819    HG2  LYS  32           HG2      LYS  32  44.658   9.751  28.545
  820    HG3  LYS  32           HG1      LYS  32  44.651  11.470  28.944
  821    HD2  LYS  32           HD2      LYS  32  42.649  10.730  26.924
  822    HD3  LYS  32           HD1      LYS  32  42.398   9.948  28.486
  823    HE2  LYS  32           HE2      LYS  32  43.066  12.854  28.508
  824    HE3  LYS  32           HE1      LYS  32  41.449  12.400  27.969
  825    HZ1  LYS  32           HZ1      LYS  32  41.524  12.769  30.360
  826    HZ2  LYS  32           HZ2      LYS  32  42.715  11.567  30.525
  827    HZ3  LYS  32           HZ3      LYS  32  41.150  11.152  30.009
  828    H    ARG  33           HN       ARG  33  46.941  12.342  29.580
  829    HA   ARG  33           HA       ARG  33  48.752  10.165  30.210
  830    HB2  ARG  33           HB2      ARG  33  47.666  12.474  31.837
  831    HB3  ARG  33           HB1      ARG  33  48.754  11.253  32.496
  832    HG2  ARG  33           HG2      ARG  33  50.364  11.808  30.624
  833    HG3  ARG  33           HG1      ARG  33  49.317  13.168  30.216
  834    HD2  ARG  33           HD2      ARG  33  49.591  14.056  32.512
  835    HD3  ARG  33           HD1      ARG  33  50.657  12.710  32.899
  836    HE   ARG  33           HE       ARG  33  51.553  14.163  30.592
  837   HH11  ARG  33          HH11      ARG  33  51.504  14.103  34.079
  838   HH12  ARG  33          HH12      ARG  33  52.920  15.082  34.232
  839   HH21  ARG  33          HH21      ARG  33  53.372  15.479  30.825
  840   HH22  ARG  33          HH22      ARG  33  53.974  15.859  32.404
  841    H1   MET   1           HT1      MET   1  -0.035  16.710  15.517
  842    H2   MET   1           HT2      MET   1   0.499  15.134  15.862
  843    H3   MET   1           HT3      MET   1   1.621  16.401  15.707
  844    HA   MET   1           HA       MET   1   0.427  17.488  17.646
  845    HB2  MET   1           HB2      MET   1  -0.902  14.846  17.411
  846    HB3  MET   1           HB1      MET   1  -0.442  15.323  19.046
  847    HG2  MET   1           HG2      MET   1  -1.949  17.162  17.176
  848    HG3  MET   1           HG1      MET   1  -2.764  16.067  18.293
  849    HE1  MET   1           HE1      MET   1  -2.323  15.815  20.561
  850    HE2  MET   1           HE2      MET   1  -3.486  17.118  20.788
  851    HE3  MET   1           HE3      MET   1  -1.988  17.112  21.716
  852    H    PHE   2           HN       PHE   2   2.789  17.632  17.654
  853    HA   PHE   2           HA       PHE   2   4.876  17.180  18.508
  854    HB2  PHE   2           HB2      PHE   2   3.153  15.771  20.558
  855    HB3  PHE   2           HB1      PHE   2   4.880  16.072  20.755
  856    HD1  PHE   2           HD1      PHE   2   1.533  17.572  20.704
  857    HD2  PHE   2           HD2      PHE   2   5.747  18.375  20.944
  858    HE1  PHE   2           HE1      PHE   2   1.050  19.872  21.494
  859    HE2  PHE   2           HE2      PHE   2   5.263  20.675  21.735
  860    HZ   PHE   2           HZ       PHE   2   2.915  21.424  22.010
  861    H    GLU   3           HN       GLU   3   4.826  15.739  16.421
  862    HA   GLU   3           HA       GLU   3   4.809  12.892  16.875
  863    HB2  GLU   3           HB2      GLU   3   5.675  14.542  14.495
  864    HB3  GLU   3           HB1      GLU   3   5.561  12.780  14.503
  865    HG2  GLU   3           HG2      GLU   3   3.248  14.609  15.196
  866    HG3  GLU   3           HG1      GLU   3   3.521  13.953  13.583
  867    HA   PRO   4           HA       PRO   4   9.045  12.372  18.124
  868    HB2  PRO   4           HB2      PRO   4   9.633   9.946  16.962
  869    HB3  PRO   4           HB1      PRO   4   8.689  10.131  18.453
  870    HG2  PRO   4           HG2      PRO   4   7.754   9.689  15.660
  871    HG3  PRO   4           HG1      PRO   4   7.154   8.992  17.176
  872    HD2  PRO   4           HD2      PRO   4   5.860  11.025  15.934
  873    HD3  PRO   4           HD1      PRO   4   5.896  10.881  17.707
  874    H    PHE   5           HN       PHE   5   8.148  12.271  14.780
  875    HA   PHE   5           HA       PHE   5  10.638  12.043  13.532
  876    HB2  PHE   5           HB2      PHE   5   9.150  12.089  11.842
  877    HB3  PHE   5           HB1      PHE   5   7.969  12.982  12.802
  878    HD1  PHE   5           HD1      PHE   5  11.107  13.378  10.812
  879    HD2  PHE   5           HD2      PHE   5   7.669  15.308  12.515
  880    HE1  PHE   5           HE1      PHE   5  11.667  15.462   9.588
  881    HE2  PHE   5           HE2      PHE   5   8.229  17.389  11.292
  882    HZ   PHE   5           HZ       PHE   5  10.229  17.467   9.827
  883    H    GLN   6           HN       GLN   6   9.027  14.813  15.003
  884    HA   GLN   6           HA       GLN   6  10.762  16.819  14.061
  885    HB2  GLN   6           HB2      GLN   6   8.630  17.327  15.156
  886    HB3  GLN   6           HB1      GLN   6   9.254  16.695  16.679
  887    HG2  GLN   6           HG2      GLN   6  10.998  18.404  16.722
  888    HG3  GLN   6           HG1      GLN   6  10.487  19.001  15.145
  889   HE21  GLN   6          HE21      GLN   6   9.473  20.981  15.512
  890   HE22  GLN   6          HE22      GLN   6   8.304  21.259  16.711
  891    H    ILE   7           HN       ILE   7  10.949  14.741  16.939
  892    HA   ILE   7           HA       ILE   7  13.210  15.978  18.098
  893    HB   ILE   7           HB       ILE   7  12.199  13.137  18.280
  894   HG12  ILE   7          HG12      ILE   7  11.937  15.419  20.246
  895   HG13  ILE   7          HG11      ILE   7  10.709  15.061  19.029
  896   HG21  ILE   7          HG21      ILE   7  13.534  13.135  20.415
  897   HG22  ILE   7          HG22      ILE   7  14.265  14.656  19.898
  898   HG23  ILE   7          HG23      ILE   7  14.525  13.186  18.957
  899   HD11  ILE   7          HD11      ILE   7  10.476  12.782  19.913
  900   HD12  ILE   7          HD12      ILE   7  10.184  13.969  21.185
  901   HD13  ILE   7          HD13      ILE   7  11.723  13.112  21.114
  902    H    LEU   8           HN       LEU   8  12.965  13.052  16.027
  903    HA   LEU   8           HA       LEU   8  15.730  12.562  15.913
  904    HB2  LEU   8           HB2      LEU   8  13.827  10.999  15.271
  905    HB3  LEU   8           HB1      LEU   8  13.739  11.884  13.749
  906    HG   LEU   8           HG       LEU   8  16.338  11.442  13.685
  907   HD11  LEU   8          HD11      LEU   8  16.358  10.462  15.982
  908   HD12  LEU   8          HD12      LEU   8  16.974   9.346  14.763
  909   HD13  LEU   8          HD13      LEU   8  15.341   9.147  15.397
  910   HD21  LEU   8          HD21      LEU   8  14.649  10.559  12.080
  911   HD22  LEU   8          HD22      LEU   8  14.335   9.217  13.180
  912   HD23  LEU   8          HD23      LEU   8  15.918   9.382  12.421
  913    H    SER   9           HN       SER   9  13.590  14.544  13.955
  914    HA   SER   9           HA       SER   9  15.388  15.075  11.835
  915    HB2  SER   9           HB2      SER   9  12.987  15.481  11.649
  916    HB3  SER   9           HB1      SER   9  13.084  16.723  12.893
  917    HG   SER   9           HG       SER   9  13.201  17.712  10.898
  918    H    ILE  10           HN       ILE  10  14.548  17.009  14.725
  919    HA   ILE  10           HA       ILE  10  16.495  19.019  14.161
  920    HB   ILE  10           HB       ILE  10  14.407  19.321  15.550
  921   HG12  ILE  10          HG12      ILE  10  16.942  20.110  17.002
  922   HG13  ILE  10          HG11      ILE  10  16.432  20.871  15.495
  923   HG21  ILE  10          HG21      ILE  10  16.110  18.014  17.691
  924   HG22  ILE  10          HG22      ILE  10  14.718  17.256  16.916
  925   HG23  ILE  10          HG23      ILE  10  14.499  18.702  17.902
  926   HD11  ILE  10          HD11      ILE  10  14.209  21.357  16.609
  927   HD12  ILE  10          HD12      ILE  10  15.580  22.235  17.283
  928   HD13  ILE  10          HD13      ILE  10  14.934  20.826  18.126
  929    H    CYS  11           HN       CYS  11  16.593  15.970  15.930
  930    HA   CYS  11           HA       CYS  11  18.988  16.535  17.378
  931    HB2  CYS  11           HB2      CYS  11  17.500  14.023  16.652
  932    HB3  CYS  11           HB1      CYS  11  19.061  13.958  17.473
  933    HG   CYS  11           HG       CYS  11  16.651  14.279  18.984
  934    H    SER  12           HN       SER  12  18.374  14.542  14.433
  935    HA   SER  12           HA       SER  12  21.075  14.036  13.900
  936    HB2  SER  12           HB2      SER  12  19.252  12.756  12.877
  937    HB3  SER  12           HB1      SER  12  18.743  14.183  11.979
  938    HG   SER  12           HG       SER  12  20.094  13.365  10.561
  939    H    PHE  13           HN       PHE  13  18.938  16.658  12.858
  940    HA   PHE  13           HA       PHE  13  20.648  17.835  10.973
  941    HB2  PHE  13           HB2      PHE  13  18.223  18.396  11.363
  942    HB3  PHE  13           HB1      PHE  13  18.728  19.304  12.789
  943    HD1  PHE  13           HD1      PHE  13  19.268  19.001   9.113
  944    HD2  PHE  13           HD2      PHE  13  19.573  21.506  12.589
  945    HE1  PHE  13           HE1      PHE  13  19.849  20.931   7.670
  946    HE2  PHE  13           HE2      PHE  13  20.155  23.436  11.145
  947    HZ   PHE  13           HZ       PHE  13  20.293  23.149   8.686
  948    H    ILE  14           HN       ILE  14  20.329  18.437  14.490
  949    HA   ILE  14           HA       ILE  14  22.265  20.487  14.641
  950    HB   ILE  14           HB       ILE  14  21.247  18.509  16.683
  951   HG12  ILE  14          HG12      ILE  14  20.850  21.503  16.475
  952   HG13  ILE  14          HG11      ILE  14  19.763  20.347  15.707
  953   HG21  ILE  14          HG21      ILE  14  23.245  20.764  16.963
  954   HG22  ILE  14          HG22      ILE  14  23.431  19.083  17.464
  955   HG23  ILE  14          HG23      ILE  14  22.322  20.144  18.331
  956   HD11  ILE  14          HD11      ILE  14  20.425  20.360  18.667
  957   HD12  ILE  14          HD12      ILE  14  19.234  19.342  17.859
  958   HD13  ILE  14          HD13      ILE  14  18.975  21.084  17.968
  959    H    LEU  15           HN       LEU  15  22.566  16.956  15.086
  960    HA   LEU  15           HA       LEU  15  25.318  16.986  15.748
  961    HB2  LEU  15           HB2      LEU  15  23.539  14.823  14.610
  962    HB3  LEU  15           HB1      LEU  15  25.192  14.549  15.162
  963    HG   LEU  15           HG       LEU  15  23.036  15.764  16.914
  964   HD11  LEU  15          HD11      LEU  15  24.034  12.905  16.984
  965   HD12  LEU  15          HD12      LEU  15  22.568  13.379  16.127
  966   HD13  LEU  15          HD13      LEU  15  22.677  13.599  17.873
  967   HD21  LEU  15          HD21      LEU  15  24.679  14.930  18.694
  968   HD22  LEU  15          HD22      LEU  15  25.224  16.299  17.725
  969   HD23  LEU  15          HD23      LEU  15  25.825  14.678  17.377
  970    H    SER  16           HN       SER  16  23.618  17.061  12.696
  971    HA   SER  16           HA       SER  16  25.860  16.226  11.094
  972    HB2  SER  16           HB2      SER  16  24.502  16.780   9.201
  973    HB3  SER  16           HB1      SER  16  23.434  16.055  10.400
  974    HG   SER  16           HG       SER  16  23.250  18.438   9.275
  975    H    ALA  17           HN       ALA  17  24.400  19.316  11.998
  976    HA   ALA  17           HA       ALA  17  26.097  20.952  10.412
  977    HB1  ALA  17           HB1      ALA  17  25.381  22.711  12.196
  978    HB2  ALA  17           HB2      ALA  17  24.309  21.436  12.774
  979    HB3  ALA  17           HB3      ALA  17  24.155  22.038  11.123
  980    H    LEU  18           HN       LEU  18  26.260  19.784  13.753
  981    HA   LEU  18           HA       LEU  18  28.585  21.295  14.417
  982    HB2  LEU  18           HB2      LEU  18  27.323  18.851  15.685
  983    HB3  LEU  18           HB1      LEU  18  28.659  19.762  16.387
  984    HG   LEU  18           HG       LEU  18  25.990  20.994  15.651
  985   HD11  LEU  18          HD11      LEU  18  25.518  20.964  18.073
  986   HD12  LEU  18          HD12      LEU  18  27.025  20.093  18.358
  987   HD13  LEU  18          HD13      LEU  18  25.721  19.326  17.452
  988   HD21  LEU  18          HD21      LEU  18  26.888  22.763  17.280
  989   HD22  LEU  18          HD22      LEU  18  27.692  22.671  15.715
  990   HD23  LEU  18          HD23      LEU  18  28.447  21.952  17.137
  991    H    HIS  19           HN       HIS  19  27.968  18.145  12.949
  992    HA   HIS  19           HA       HIS  19  30.550  17.040  13.337
  993    HB2  HIS  19           HB2      HIS  19  28.623  15.658  12.743
  994    HB3  HIS  19           HB1      HIS  19  28.463  16.510  11.209
  995    HD2  HIS  19           HD2      HIS  19  29.962  15.390   9.169
  996    HE1  HIS  19           HE1      HIS  19  32.527  13.033  11.554
  997    HE2  HIS  19           HE2      HIS  19  31.870  13.608   9.169
  998    H    PHE  20           HN       PHE  20  29.056  18.798  10.604
  999    HA   PHE  20           HA       PHE  20  31.446  18.752   9.045
 1000    HB2  PHE  20           HB2      PHE  20  28.753  19.791   8.736
 1001    HB3  PHE  20           HB1      PHE  20  29.962  20.939   8.157
 1002    HD1  PHE  20           HD1      PHE  20  28.343  17.729   7.572
 1003    HD2  PHE  20           HD2      PHE  20  31.682  20.207   6.481
 1004    HE1  PHE  20           HE1      PHE  20  28.717  16.343   5.549
 1005    HE2  PHE  20           HE2      PHE  20  32.052  18.820   4.459
 1006    HZ   PHE  20           HZ       PHE  20  30.565  16.888   3.992
 1007    H    MET  21           HN       MET  21  30.185  20.829  11.539
 1008    HA   MET  21           HA       MET  21  31.756  23.117  11.044
 1009    HB2  MET  21           HB2      MET  21  29.965  22.220  13.056
 1010    HB3  MET  21           HB1      MET  21  31.452  22.726  13.861
 1011    HG2  MET  21           HG2      MET  21  30.256  24.741  13.688
 1012    HG3  MET  21           HG1      MET  21  31.316  24.799  12.279
 1013    HE1  MET  21           HE1      MET  21  29.294  26.624  12.448
 1014    HE2  MET  21           HE2      MET  21  27.962  26.488  11.303
 1015    HE3  MET  21           HE3      MET  21  29.623  26.504  10.714
 1016    H    ALA  22           HN       ALA  22  32.353  20.392  13.286
 1017    HA   ALA  22           HA       ALA  22  34.947  21.246  14.030
 1018    HB1  ALA  22           HB1      ALA  22  33.926  18.402  14.019
 1019    HB2  ALA  22           HB2      ALA  22  33.550  19.576  15.280
 1020    HB3  ALA  22           HB3      ALA  22  35.219  19.069  15.015
 1021    H    TRP  23           HN       TRP  23  33.771  19.129  11.448
 1022    HA   TRP  23           HA       TRP  23  36.290  18.162  10.624
 1023    HB2  TRP  23           HB2      TRP  23  33.618  17.872   9.818
 1024    HB3  TRP  23           HB1      TRP  23  34.481  18.480   8.404
 1025    HD1  TRP  23           HD1      TRP  23  34.051  15.419  10.526
 1026    HE1  TRP  23           HE1      TRP  23  35.555  13.526   9.625
 1027    HE3  TRP  23           HE3      TRP  23  36.884  18.057   7.199
 1028    HZ2  TRP  23           HZ2      TRP  23  37.684  13.183   7.738
 1029    HZ3  TRP  23           HZ3      TRP  23  38.640  16.929   5.864
 1030    HH2  TRP  23           HH2      TRP  23  39.044  14.497   6.129
 1031    H    THR  24           HN       THR  24  34.366  20.914   9.407
 1032    HA   THR  24           HA       THR  24  36.085  21.784   7.409
 1033    HB   THR  24           HB       THR  24  35.122  24.120   8.066
 1034    HG1  THR  24           HG1      THR  24  33.895  24.136   9.743
 1035   HG21  THR  24          HG21      THR  24  32.955  23.517   7.039
 1036   HG22  THR  24          HG22      THR  24  33.325  21.810   7.283
 1037   HG23  THR  24          HG23      THR  24  34.307  22.778   6.183
 1038    H    ILE  25           HN       ILE  25  36.015  22.808  10.848
 1039    HA   ILE  25           HA       ILE  25  38.287  24.496  10.583
 1040    HB   ILE  25           HB       ILE  25  36.728  24.751  12.445
 1041   HG12  ILE  25          HG12      ILE  25  39.393  23.875  13.574
 1042   HG13  ILE  25          HG11      ILE  25  39.234  25.331  12.599
 1043   HG21  ILE  25          HG21      ILE  25  36.707  23.112  14.280
 1044   HG22  ILE  25          HG22      ILE  25  37.815  22.082  13.376
 1045   HG23  ILE  25          HG23      ILE  25  36.186  22.376  12.767
 1046   HD11  ILE  25          HD11      ILE  25  38.205  26.493  14.273
 1047   HD12  ILE  25          HD12      ILE  25  38.931  25.274  15.318
 1048   HD13  ILE  25          HD13      ILE  25  37.254  25.106  14.805
 1049    H    GLY  26           HN       GLY  26  37.897  21.091  11.281
 1050    HA2  GLY  26           HA2      GLY  26  40.478  20.494  12.214
 1051    HA3  GLY  26           HA1      GLY  26  39.415  19.362  11.382
 1052    H    HIS  27           HN       HIS  27  39.160  20.377   8.901
 1053    HA   HIS  27           HA       HIS  27  41.604  19.677   7.648
 1054    HB2  HIS  27           HB2      HIS  27  39.309  19.439   6.627
 1055    HB3  HIS  27           HB1      HIS  27  39.319  21.185   6.369
 1056    HD2  HIS  27           HD2      HIS  27  40.846  17.979   4.791
 1057    HE1  HIS  27           HE1      HIS  27  42.511  21.283   2.754
 1058    HE2  HIS  27           HE2      HIS  27  42.288  18.753   2.755
 1059    H    LEU  28           HN       LEU  28  40.132  22.758   8.499
 1060    HA   LEU  28           HA       LEU  28  41.794  24.457   6.984
 1061    HB2  LEU  28           HB2      LEU  28  39.863  24.723   9.142
 1062    HB3  LEU  28           HB1      LEU  28  41.213  25.840   9.335
 1063    HG   LEU  28           HG       LEU  28  40.854  26.325   6.791
 1064   HD11  LEU  28          HD11      LEU  28  38.598  25.985   5.995
 1065   HD12  LEU  28          HD12      LEU  28  38.090  25.348   7.560
 1066   HD13  LEU  28          HD13      LEU  28  39.208  24.428   6.553
 1067   HD21  LEU  28          HD21      LEU  28  38.789  27.249   8.814
 1068   HD22  LEU  28          HD22      LEU  28  39.296  28.111   7.360
 1069   HD23  LEU  28          HD23      LEU  28  40.426  27.893   8.696
 1070    H    ASN  29           HN       ASN  29  42.229  22.909  10.115
 1071    HA   ASN  29           HA       ASN  29  44.110  22.589  11.400
 1072    HB2  ASN  29           HB2      ASN  29  45.149  22.288   9.051
 1073    HB3  ASN  29           HB1      ASN  29  45.757  23.928   9.264
 1074   HD21  ASN  29          HD21      ASN  29  47.974  23.504   9.630
 1075   HD22  ASN  29          HD22      ASN  29  48.543  22.545  10.910
 1076    H    GLN  30           HN       GLN  30  45.943  23.875  12.464
 1077    HA   GLN  30           HA       GLN  30  44.871  26.274  13.515
 1078    HB2  GLN  30           HB2      GLN  30  47.085  24.559  14.051
 1079    HB3  GLN  30           HB1      GLN  30  47.688  26.212  13.933
 1080    HG2  GLN  30           HG2      GLN  30  47.024  25.852  16.223
 1081    HG3  GLN  30           HG1      GLN  30  45.826  26.912  15.485
 1082   HE21  GLN  30          HE21      GLN  30  43.713  26.296  15.924
 1083   HE22  GLN  30          HE22      GLN  30  43.205  24.706  16.234
 1084    H    ILE  31           HN       ILE  31  46.463  25.687  10.575
 1085    HA   ILE  31           HA       ILE  31  48.087  27.886  10.160
 1086    HB   ILE  31           HB       ILE  31  47.347  25.861   8.603
 1087   HG12  ILE  31          HG12      ILE  31  48.025  27.631   6.647
 1088   HG13  ILE  31          HG11      ILE  31  48.541  28.522   8.080
 1089   HG21  ILE  31          HG21      ILE  31  45.786  28.154   7.397
 1090   HG22  ILE  31          HG22      ILE  31  45.024  26.914   8.393
 1091   HG23  ILE  31          HG23      ILE  31  45.815  26.468   6.883
 1092   HD11  ILE  31          HD11      ILE  31  49.360  25.704   7.318
 1093   HD12  ILE  31          HD12      ILE  31  49.793  26.493   8.835
 1094   HD13  ILE  31          HD13      ILE  31  50.390  27.136   7.304
 1095    H    LYS  32           HN       LYS  32  44.615  27.716  10.385
 1096    HA   LYS  32           HA       LYS  32  43.868  30.084   9.104
 1097    HB2  LYS  32           HB2      LYS  32  42.144  28.609   9.832
 1098    HB3  LYS  32           HB1      LYS  32  42.708  28.661  11.503
 1099    HG2  LYS  32           HG2      LYS  32  41.840  30.779  11.878
 1100    HG3  LYS  32           HG1      LYS  32  41.930  31.232  10.175
 1101    HD2  LYS  32           HD2      LYS  32  40.143  28.956  10.687
 1102    HD3  LYS  32           HD1      LYS  32  39.630  30.447  11.480
 1103    HE2  LYS  32           HE2      LYS  32  40.538  30.650   8.646
 1104    HE3  LYS  32           HE1      LYS  32  38.968  29.901   8.941
 1105    HZ1  LYS  32           HZ1      LYS  32  38.779  32.295   8.635
 1106    HZ2  LYS  32           HZ2      LYS  32  39.827  32.563   9.944
 1107    HZ3  LYS  32           HZ3      LYS  32  38.309  31.846  10.202
 1108    H    ARG  33           HN       ARG  33  44.187  32.179   9.530
 1109    HA   ARG  33           HA       ARG  33  45.711  32.951  11.874
 1110    HB2  ARG  33           HB2      ARG  33  44.633  34.509   9.516
 1111    HB3  ARG  33           HB1      ARG  33  45.517  35.257  10.844
 1112    HG2  ARG  33           HG2      ARG  33  47.393  33.617  10.395
 1113    HG3  ARG  33           HG1      ARG  33  46.529  33.130   8.937
 1114    HD2  ARG  33           HD2      ARG  33  46.587  35.474   8.133
 1115    HD3  ARG  33           HD1      ARG  33  47.476  35.941   9.580
 1116    HE   ARG  33           HE       ARG  33  48.777  33.815   8.158
 1117   HH11  ARG  33          HH11      ARG  33  48.282  37.265   8.292
 1118   HH12  ARG  33          HH12      ARG  33  49.748  37.627   7.449
 1119   HH21  ARG  33          HH21      ARG  33  50.659  34.317   7.015
 1120   HH22  ARG  33          HH22      ARG  33  51.086  35.971   6.728
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1   5.526  13.376  -0.163
    2    H2   MET   1           HT2      MET   1   6.205  13.067  -1.689
    3    H3   MET   1           HT3      MET   1   4.517  13.104  -1.498
    4    HA   MET   1           HA       MET   1   6.418  15.298  -1.739
    5    HB2  MET   1           HB2      MET   1   3.723  14.493  -2.704
    6    HB3  MET   1           HB1      MET   1   4.017  16.223  -2.532
    7    HG2  MET   1           HG2      MET   1   5.917  14.379  -3.994
    8    HG3  MET   1           HG1      MET   1   4.610  15.245  -4.802
    9    HE1  MET   1           HE1      MET   1   5.439  18.649  -5.193
   10    HE2  MET   1           HE2      MET   1   4.632  18.402  -3.646
   11    HE3  MET   1           HE3      MET   1   4.221  17.378  -5.019
   12    H    PHE   2           HN       PHE   2   3.678  14.281   0.216
   13    HA   PHE   2           HA       PHE   2   3.862  16.804   1.745
   14    HB2  PHE   2           HB2      PHE   2   1.611  15.019   1.013
   15    HB3  PHE   2           HB1      PHE   2   1.574  15.686   2.646
   16    HD1  PHE   2           HD1      PHE   2   0.775  16.309  -0.749
   17    HD2  PHE   2           HD2      PHE   2   2.142  18.260   2.825
   18    HE1  PHE   2           HE1      PHE   2   0.018  18.494  -1.651
   19    HE2  PHE   2           HE2      PHE   2   1.386  20.443   1.925
   20    HZ   PHE   2           HZ       PHE   2   0.324  20.559  -0.314
   21    H    GLU   3           HN       GLU   3   5.124  13.812   1.818
   22    HA   GLU   3           HA       GLU   3   4.560  13.262   4.618
   23    HB2  GLU   3           HB2      GLU   3   6.156  11.766   2.535
   24    HB3  GLU   3           HB1      GLU   3   6.016  11.261   4.220
   25    HG2  GLU   3           HG2      GLU   3   3.557  11.216   4.000
   26    HG3  GLU   3           HG1      GLU   3   3.706  11.685   2.307
   27    HA   PRO   4           HA       PRO   4   8.191  15.614   5.814
   28    HB2  PRO   4           HB2      PRO   4   8.381  14.654   8.395
   29    HB3  PRO   4           HB1      PRO   4   7.246  15.917   7.885
   30    HG2  PRO   4           HG2      PRO   4   6.771  13.006   8.308
   31    HG3  PRO   4           HG1      PRO   4   5.750  14.392   8.727
   32    HD2  PRO   4           HD2      PRO   4   5.265  12.856   6.550
   33    HD3  PRO   4           HD1      PRO   4   4.910  14.595   6.580
   34    H    PHE   5           HN       PHE   5   7.947  12.142   6.093
   35    HA   PHE   5           HA       PHE   5  10.593  11.532   6.831
   36    HB2  PHE   5           HB2      PHE   5   9.566   9.538   6.908
   37    HB3  PHE   5           HB1      PHE   5   8.264  10.098   5.859
   38    HD1  PHE   5           HD1      PHE   5  11.648   8.592   5.938
   39    HD2  PHE   5           HD2      PHE   5   8.315   9.721   3.478
   40    HE1  PHE   5           HE1      PHE   5  12.603   7.298   4.049
   41    HE2  PHE   5           HE2      PHE   5   9.269   8.428   1.589
   42    HZ   PHE   5           HZ       PHE   5  11.415   7.218   1.875
   43    H    GLN   6           HN       GLN   6   9.107  12.308   3.745
   44    HA   GLN   6           HA       GLN   6  11.217  11.458   2.069
   45    HB2  GLN   6           HB2      GLN   6   9.012  13.478   1.762
   46    HB3  GLN   6           HB1      GLN   6  10.229  13.252   0.504
   47    HG2  GLN   6           HG2      GLN   6   8.762  10.895   1.667
   48    HG3  GLN   6           HG1      GLN   6   8.053  11.844   0.364
   49   HE21  GLN   6          HE21      GLN   6   9.035  11.710  -1.754
   50   HE22  GLN   6          HE22      GLN   6  10.236  10.568  -2.117
   51    H    ILE   7           HN       ILE   7  10.622  14.485   3.797
   52    HA   ILE   7           HA       ILE   7  12.694  15.990   2.586
   53    HB   ILE   7           HB       ILE   7  11.389  16.220   5.304
   54   HG12  ILE   7          HG12      ILE   7  10.986  17.881   2.806
   55   HG13  ILE   7          HG11      ILE   7   9.988  16.478   3.190
   56   HG21  ILE   7          HG21      ILE   7  13.524  17.353   5.391
   57   HG22  ILE   7          HG22      ILE   7  12.275  18.580   5.185
   58   HG23  ILE   7          HG23      ILE   7  13.253  18.080   3.806
   59   HD11  ILE   7          HD11      ILE   7   9.132  18.797   3.951
   60   HD12  ILE   7          HD12      ILE   7  10.381  18.702   5.195
   61   HD13  ILE   7          HD13      ILE   7   9.102  17.488   5.131
   62    H    LEU   8           HN       LEU   8  12.577  14.219   5.696
   63    HA   LEU   8           HA       LEU   8  15.286  14.701   6.359
   64    HB2  LEU   8           HB2      LEU   8  13.532  13.968   7.975
   65    HB3  LEU   8           HB1      LEU   8  13.558  12.371   7.227
   66    HG   LEU   8           HG       LEU   8  16.075  12.347   7.701
   67   HD11  LEU   8          HD11      LEU   8  16.408  14.724   8.110
   68   HD12  LEU   8          HD12      LEU   8  16.766  13.840   9.595
   69   HD13  LEU   8          HD13      LEU   8  15.234  14.696   9.427
   70   HD21  LEU   8          HD21      LEU   8  14.238  12.499  10.112
   71   HD22  LEU   8          HD22      LEU   8  15.742  11.585   9.988
   72   HD23  LEU   8          HD23      LEU   8  14.340  11.112   9.029
   73    H    SER   9           HN       SER   9  13.694  12.200   4.487
   74    HA   SER   9           HA       SER   9  15.905  10.410   4.343
   75    HB2  SER   9           HB2      SER   9  14.663   9.341   2.539
   76    HB3  SER   9           HB1      SER   9  13.564   9.750   3.853
   77    HG   SER   9           HG       SER   9  13.645  10.650   1.283
   78    H    ILE  10           HN       ILE  10  14.656  12.883   2.120
   79    HA   ILE  10           HA       ILE  10  16.619  12.560   0.127
   80    HB   ILE  10           HB       ILE  10  14.858  14.885   0.875
   81   HG12  ILE  10          HG12      ILE  10  14.041  12.659  -0.213
   82   HG13  ILE  10          HG11      ILE  10  13.525  14.184  -0.934
   83   HG21  ILE  10          HG21      ILE  10  15.600  15.713  -1.480
   84   HG22  ILE  10          HG22      ILE  10  17.003  14.671  -1.242
   85   HG23  ILE  10          HG23      ILE  10  16.687  15.999  -0.122
   86   HD11  ILE  10          HD11      ILE  10  15.059  13.997  -2.723
   87   HD12  ILE  10          HD12      ILE  10  14.446  12.354  -2.526
   88   HD13  ILE  10          HD13      ILE  10  16.031  12.787  -1.883
   89    H    CYS  11           HN       CYS  11  16.506  14.590   3.038
   90    HA   CYS  11           HA       CYS  11  18.804  16.126   2.513
   91    HB2  CYS  11           HB2      CYS  11  17.492  15.254   5.094
   92    HB3  CYS  11           HB1      CYS  11  18.841  16.389   5.028
   93    HG   CYS  11           HG       CYS  11  17.211  18.154   4.454
   94    H    SER  12           HN       SER  12  18.435  13.089   4.410
   95    HA   SER  12           HA       SER  12  21.147  12.837   5.071
   96    HB2  SER  12           HB2      SER  12  20.608  10.496   5.529
   97    HB3  SER  12           HB1      SER  12  19.330  11.550   6.133
   98    HG   SER  12           HG       SER  12  18.021  10.886   4.562
   99    H    PHE  13           HN       PHE  13  19.296  11.649   2.285
  100    HA   PHE  13           HA       PHE  13  21.243  10.044   1.101
  101    HB2  PHE  13           HB2      PHE  13  18.805  11.440   0.225
  102    HB3  PHE  13           HB1      PHE  13  19.974  11.132  -1.057
  103    HD1  PHE  13           HD1      PHE  13  18.767   9.290   1.988
  104    HD2  PHE  13           HD2      PHE  13  19.578   9.171  -2.228
  105    HE1  PHE  13           HE1      PHE  13  18.073   6.911   1.922
  106    HE2  PHE  13           HE2      PHE  13  18.882   6.790  -2.296
  107    HZ   PHE  13           HZ       PHE  13  18.130   5.660  -0.220
  108    H    ILE  14           HN       ILE  14  20.568  13.507   0.483
  109    HA   ILE  14           HA       ILE  14  22.761  13.836  -1.303
  110    HB   ILE  14           HB       ILE  14  22.294  16.233  -1.094
  111   HG12  ILE  14          HG12      ILE  14  20.294  15.457   1.053
  112   HG13  ILE  14          HG11      ILE  14  21.883  16.125   1.418
  113   HG21  ILE  14          HG21      ILE  14  19.836  16.134  -1.661
  114   HG22  ILE  14          HG22      ILE  14  19.847  14.438  -1.177
  115   HG23  ILE  14          HG23      ILE  14  20.819  14.969  -2.549
  116   HD11  ILE  14          HD11      ILE  14  21.325  18.126   0.062
  117   HD12  ILE  14          HD12      ILE  14  20.202  17.901   1.402
  118   HD13  ILE  14          HD13      ILE  14  19.720  17.456  -0.234
  119    H    LEU  15           HN       LEU  15  22.464  13.867   2.163
  120    HA   LEU  15           HA       LEU  15  24.825  15.379   2.703
  121    HB2  LEU  15           HB2      LEU  15  22.923  13.695   4.258
  122    HB3  LEU  15           HB1      LEU  15  24.524  13.955   4.951
  123    HG   LEU  15           HG       LEU  15  22.921  16.268   3.868
  124   HD11  LEU  15          HD11      LEU  15  21.571  14.961   5.571
  125   HD12  LEU  15          HD12      LEU  15  21.936  16.621   6.041
  126   HD13  LEU  15          HD13      LEU  15  22.855  15.287   6.735
  127   HD21  LEU  15          HD21      LEU  15  25.268  16.685   4.349
  128   HD22  LEU  15          HD22      LEU  15  25.116  15.935   5.937
  129   HD23  LEU  15          HD23      LEU  15  24.299  17.462   5.602
  130    H    SER  16           HN       SER  16  24.178  11.892   3.209
  131    HA   SER  16           HA       SER  16  26.793  11.104   3.579
  132    HB2  SER  16           HB2      SER  16  26.040   8.856   2.884
  133    HB3  SER  16           HB1      SER  16  24.866   9.625   3.950
  134    HG   SER  16           HG       SER  16  23.556   9.998   2.254
  135    H    ALA  17           HN       ALA  17  25.080  11.812   0.598
  136    HA   ALA  17           HA       ALA  17  26.923  10.657  -1.214
  137    HB1  ALA  17           HB1      ALA  17  25.864  12.086  -2.886
  138    HB2  ALA  17           HB2      ALA  17  25.137  13.069  -1.616
  139    HB3  ALA  17           HB3      ALA  17  24.635  11.392  -1.828
  140    H    LEU  18           HN       LEU  18  26.603  13.994   0.021
  141    HA   LEU  18           HA       LEU  18  28.925  14.955  -1.326
  142    HB2  LEU  18           HB2      LEU  18  27.325  16.040   0.994
  143    HB3  LEU  18           HB1      LEU  18  28.686  16.894   0.265
  144    HG   LEU  18           HG       LEU  18  26.331  15.901  -1.356
  145   HD11  LEU  18          HD11      LEU  18  26.775  18.559   0.026
  146   HD12  LEU  18          HD12      LEU  18  25.400  17.470   0.204
  147   HD13  LEU  18          HD13      LEU  18  25.639  18.349  -1.306
  148   HD21  LEU  18          HD21      LEU  18  28.634  17.815  -1.827
  149   HD22  LEU  18          HD22      LEU  18  27.214  17.771  -2.872
  150   HD23  LEU  18          HD23      LEU  18  28.246  16.349  -2.728
  151    H    HIS  19           HN       HIS  19  28.377  13.304   1.680
  152    HA   HIS  19           HA       HIS  19  30.747  14.051   3.037
  153    HB2  HIS  19           HB2      HIS  19  29.080  13.083   4.379
  154    HB3  HIS  19           HB1      HIS  19  28.834  11.737   3.267
  155    HD2  HIS  19           HD2      HIS  19  31.567  12.896   5.903
  156    HE1  HIS  19           HE1      HIS  19  32.126   8.796   5.060
  157    HE2  HIS  19           HE2      HIS  19  32.900  10.734   6.509
  158    H    PHE  20           HN       PHE  20  29.939  11.181   1.062
  159    HA   PHE  20           HA       PHE  20  32.574  10.098   1.224
  160    HB2  PHE  20           HB2      PHE  20  30.037   9.415  -0.092
  161    HB3  PHE  20           HB1      PHE  20  31.466   8.967  -1.026
  162    HD1  PHE  20           HD1      PHE  20  29.289   7.943   1.574
  163    HD2  PHE  20           HD2      PHE  20  33.414   7.847   0.393
  164    HE1  PHE  20           HE1      PHE  20  29.673   6.007   3.088
  165    HE2  PHE  20           HE2      PHE  20  33.809   5.915   1.900
  166    HZ   PHE  20           HZ       PHE  20  31.950   4.985   3.267
  167    H    MET  21           HN       MET  21  30.971  12.405  -0.842
  168    HA   MET  21           HA       MET  21  32.697  12.301  -3.063
  169    HB2  MET  21           HB2      MET  21  30.813  14.288  -1.900
  170    HB3  MET  21           HB1      MET  21  31.988  14.885  -3.072
  171    HG2  MET  21           HG2      MET  21  31.271  13.101  -4.659
  172    HG3  MET  21           HG1      MET  21  30.047  12.590  -3.497
  173    HE1  MET  21           HE1      MET  21  29.822  14.222  -6.825
  174    HE2  MET  21           HE2      MET  21  28.115  14.171  -6.391
  175    HE3  MET  21           HE3      MET  21  29.166  12.824  -5.963
  176    H    ALA  22           HN       ALA  22  32.741  14.535  -0.280
  177    HA   ALA  22           HA       ALA  22  35.201  15.757  -0.930
  178    HB1  ALA  22           HB1      ALA  22  35.172  16.613   1.357
  179    HB2  ALA  22           HB2      ALA  22  33.933  15.440   1.803
  180    HB3  ALA  22           HB3      ALA  22  33.557  16.725   0.654
  181    H    TRP  23           HN       TRP  23  34.372  12.952   1.066
  182    HA   TRP  23           HA       TRP  23  36.908  12.482   2.174
  183    HB2  TRP  23           HB2      TRP  23  34.395  11.065   1.929
  184    HB3  TRP  23           HB1      TRP  23  35.756   9.965   1.718
  185    HD1  TRP  23           HD1      TRP  23  34.696  12.782   4.164
  186    HE1  TRP  23           HE1      TRP  23  35.508  12.128   6.518
  187    HE3  TRP  23           HE3      TRP  23  37.123   8.416   3.090
  188    HZ2  TRP  23           HZ2      TRP  23  36.998  10.042   7.780
  189    HZ3  TRP  23           HZ3      TRP  23  38.228   7.116   4.888
  190    HH2  TRP  23           HH2      TRP  23  38.168   7.923   7.231
  191    H    THR  24           HN       THR  24  35.453  11.263  -0.837
  192    HA   THR  24           HA       THR  24  37.533   9.631  -1.684
  193    HB   THR  24           HB       THR  24  35.645  11.336  -3.331
  194    HG1  THR  24           HG1      THR  24  35.558   8.582  -2.674
  195   HG21  THR  24          HG21      THR  24  37.510  10.685  -4.718
  196   HG22  THR  24          HG22      THR  24  36.151   9.633  -5.114
  197   HG23  THR  24          HG23      THR  24  37.461   9.038  -4.094
  198    H    ILE  25           HN       ILE  25  37.016  13.099  -2.226
  199    HA   ILE  25           HA       ILE  25  39.342  13.513  -3.802
  200    HB   ILE  25           HB       ILE  25  37.824  15.446  -2.030
  201   HG12  ILE  25          HG12      ILE  25  37.704  15.064  -5.035
  202   HG13  ILE  25          HG11      ILE  25  36.585  14.274  -3.925
  203   HG21  ILE  25          HG21      ILE  25  40.096  16.256  -2.560
  204   HG22  ILE  25          HG22      ILE  25  38.887  17.179  -3.455
  205   HG23  ILE  25          HG23      ILE  25  39.820  15.922  -4.270
  206   HD11  ILE  25          HD11      ILE  25  36.048  16.573  -2.997
  207   HD12  ILE  25          HD12      ILE  25  35.515  16.295  -4.655
  208   HD13  ILE  25          HD13      ILE  25  36.966  17.246  -4.343
  209    H    GLY  26           HN       GLY  26  38.722  13.623  -0.346
  210    HA2  GLY  26           HA2      GLY  26  41.197  14.687   0.507
  211    HA3  GLY  26           HA1      GLY  26  40.142  13.672   1.487
  212    H    HIS  27           HN       HIS  27  40.148  11.306   0.120
  213    HA   HIS  27           HA       HIS  27  42.569  10.106   0.926
  214    HB2  HIS  27           HB2      HIS  27  40.058   9.263  -0.236
  215    HB3  HIS  27           HB1      HIS  27  41.406   8.417  -0.996
  216    HD2  HIS  27           HD2      HIS  27  43.191   7.138   1.012
  217    HE1  HIS  27           HE1      HIS  27  40.098   6.858   3.872
  218    HE2  HIS  27           HE2      HIS  27  42.428   6.054   3.261
  219    H    LEU  28           HN       LEU  28  41.416  11.228  -2.219
  220    HA   LEU  28           HA       LEU  28  43.708  10.238  -3.653
  221    HB2  LEU  28           HB2      LEU  28  41.564  12.226  -4.434
  222    HB3  LEU  28           HB1      LEU  28  42.781  11.569  -5.529
  223    HG   LEU  28           HG       LEU  28  40.867   9.842  -3.939
  224   HD11  LEU  28          HD11      LEU  28  40.676  10.544  -6.876
  225   HD12  LEU  28          HD12      LEU  28  39.762  11.396  -5.632
  226   HD13  LEU  28          HD13      LEU  28  39.497   9.672  -5.897
  227   HD21  LEU  28          HD21      LEU  28  42.846   9.357  -6.180
  228   HD22  LEU  28          HD22      LEU  28  41.564   8.208  -5.797
  229   HD23  LEU  28          HD23      LEU  28  42.794   8.590  -4.592
  230    H    ASN  29           HN       ASN  29  42.950  13.068  -1.829
  231    HA   ASN  29           HA       ASN  29  44.817  14.850  -3.059
  232    HB2  ASN  29           HB2      ASN  29  43.382  16.132  -1.865
  233    HB3  ASN  29           HB1      ASN  29  43.058  14.855  -0.693
  234   HD21  ASN  29          HD21      ASN  29  44.335  14.798   1.235
  235   HD22  ASN  29          HD22      ASN  29  45.493  15.981   1.604
  236    H    GLN  30           HN       GLN  30  44.935  12.648  -0.294
  237    HA   GLN  30           HA       GLN  30  47.429  13.437   0.734
  238    HB2  GLN  30           HB2      GLN  30  45.795  11.934   1.887
  239    HB3  GLN  30           HB1      GLN  30  46.250  10.649   0.769
  240    HG2  GLN  30           HG2      GLN  30  48.297  10.334   1.745
  241    HG3  GLN  30           HG1      GLN  30  48.485  12.040   2.144
  242   HE21  GLN  30          HE21      GLN  30  46.233   9.358   3.070
  243   HE22  GLN  30          HE22      GLN  30  46.248   9.737   4.724
  244    H    ILE  31           HN       ILE  31  46.566  11.127  -1.793
  245    HA   ILE  31           HA       ILE  31  49.357  11.162  -2.710
  246    HB   ILE  31           HB       ILE  31  49.335   9.139  -1.471
  247   HG12  ILE  31          HG12      ILE  31  48.576   8.233  -4.251
  248   HG13  ILE  31          HG11      ILE  31  50.089   9.079  -3.932
  249   HG21  ILE  31          HG21      ILE  31  46.811   9.051  -1.227
  250   HG22  ILE  31          HG22      ILE  31  47.571   7.492  -1.542
  251   HG23  ILE  31          HG23      ILE  31  46.747   8.347  -2.845
  252   HD11  ILE  31          HD11      ILE  31  50.795   7.361  -2.378
  253   HD12  ILE  31          HD12      ILE  31  50.293   6.570  -3.873
  254   HD13  ILE  31          HD13      ILE  31  49.223   6.569  -2.471
  255    H    LYS  32           HN       LYS  32  48.912  12.313  -4.543
  256    HA   LYS  32           HA       LYS  32  46.808  11.272  -6.327
  257    HB2  LYS  32           HB2      LYS  32  46.866  13.727  -5.632
  258    HB3  LYS  32           HB1      LYS  32  48.303  13.870  -6.645
  259    HG2  LYS  32           HG2      LYS  32  46.974  12.928  -8.556
  260    HG3  LYS  32           HG1      LYS  32  45.541  12.989  -7.529
  261    HD2  LYS  32           HD2      LYS  32  47.270  15.411  -8.078
  262    HD3  LYS  32           HD1      LYS  32  45.864  14.997  -9.058
  263    HE2  LYS  32           HE2      LYS  32  44.445  15.054  -7.024
  264    HE3  LYS  32           HE1      LYS  32  45.854  15.521  -6.070
  265    HZ1  LYS  32           HZ1      LYS  32  45.871  17.598  -6.934
  266    HZ2  LYS  32           HZ2      LYS  32  44.212  17.288  -7.124
  267    HZ3  LYS  32           HZ3      LYS  32  45.266  17.115  -8.443
  268    H    ARG  33           HN       ARG  33  50.238  12.086  -6.163
  269    HA   ARG  33           HA       ARG  33  50.701  11.278  -8.915
  270    HB2  ARG  33           HB2      ARG  33  52.973  11.933  -8.549
  271    HB3  ARG  33           HB1      ARG  33  51.964  13.138  -7.750
  272    HG2  ARG  33           HG2      ARG  33  52.265  11.903  -5.598
  273    HG3  ARG  33           HG1      ARG  33  53.378  10.807  -6.419
  274    HD2  ARG  33           HD2      ARG  33  54.802  12.748  -7.025
  275    HD3  ARG  33           HD1      ARG  33  53.714  13.804  -6.126
  276    HE   ARG  33           HE       ARG  33  55.671  11.983  -5.013
  277   HH11  ARG  33          HH11      ARG  33  52.709  13.752  -4.471
  278   HH12  ARG  33          HH12      ARG  33  52.906  13.783  -2.747
  279   HH21  ARG  33          HH21      ARG  33  55.890  12.034  -2.760
  280   HH22  ARG  33          HH22      ARG  33  54.687  12.816  -1.789
  281    H1   MET   1           HT1      MET   1   7.885  -3.046   5.067
  282    H2   MET   1           HT2      MET   1   8.775  -4.451   5.414
  283    H3   MET   1           HT3      MET   1   7.085  -4.530   5.256
  284    HA   MET   1           HA       MET   1   9.150  -4.428   3.205
  285    HB2  MET   1           HB2      MET   1   6.592  -5.819   3.804
  286    HB3  MET   1           HB1      MET   1   6.975  -5.572   2.101
  287    HG2  MET   1           HG2      MET   1   8.947  -6.751   4.068
  288    HG3  MET   1           HG1      MET   1   7.851  -7.737   3.103
  289    HE1  MET   1           HE1      MET   1   8.968  -7.929  -0.234
  290    HE2  MET   1           HE2      MET   1   7.914  -6.533  -0.037
  291    HE3  MET   1           HE3      MET   1   7.652  -7.972   0.946
  292    H    PHE   2           HN       PHE   2   6.063  -2.956   4.027
  293    HA   PHE   2           HA       PHE   2   6.187  -1.366   1.538
  294    HB2  PHE   2           HB2      PHE   2   3.956  -2.475   3.146
  295    HB3  PHE   2           HB1      PHE   2   3.712  -0.856   2.489
  296    HD1  PHE   2           HD1      PHE   2   3.504  -4.322   1.787
  297    HD2  PHE   2           HD2      PHE   2   4.427  -0.544  -0.036
  298    HE1  PHE   2           HE1      PHE   2   3.059  -5.293  -0.453
  299    HE2  PHE   2           HE2      PHE   2   3.983  -1.514  -2.274
  300    HZ   PHE   2           HZ       PHE   2   3.298  -3.887  -2.483
  301    H    GLU   3           HN       GLU   3   7.205  -1.150   4.612
  302    HA   GLU   3           HA       GLU   3   6.168   1.514   5.142
  303    HB2  GLU   3           HB2      GLU   3   7.960  -0.324   6.734
  304    HB3  GLU   3           HB1      GLU   3   7.525   1.311   7.242
  305    HG2  GLU   3           HG2      GLU   3   5.132   0.713   7.103
  306    HG3  GLU   3           HG1      GLU   3   5.576  -0.929   6.638
  307    HA   PRO   4           HA       PRO   4   9.724   3.317   3.073
  308    HB2  PRO   4           HB2      PRO   4   9.431   5.876   4.064
  309    HB3  PRO   4           HB1      PRO   4   8.482   5.216   2.718
  310    HG2  PRO   4           HG2      PRO   4   7.745   5.502   5.589
  311    HG3  PRO   4           HG1      PRO   4   6.767   5.780   4.138
  312    HD2  PRO   4           HD2      PRO   4   6.532   3.526   5.619
  313    HD3  PRO   4           HD1      PRO   4   6.293   3.534   3.860
  314    H    PHE   5           HN       PHE   5   9.189   3.489   6.520
  315    HA   PHE   5           HA       PHE   5  11.634   4.619   7.331
  316    HB2  PHE   5           HB2      PHE   5  10.468   4.497   9.245
  317    HB3  PHE   5           HB1      PHE   5   9.391   3.268   8.582
  318    HD1  PHE   5           HD1      PHE   5  12.604   3.844  10.332
  319    HD2  PHE   5           HD2      PHE   5   9.787   0.915   8.945
  320    HE1  PHE   5           HE1      PHE   5  13.751   2.099  11.667
  321    HE2  PHE   5           HE2      PHE   5  10.937  -0.827  10.284
  322    HZ   PHE   5           HZ       PHE   5  12.927  -0.235  11.639
  323    H    GLN   6           HN       GLN   6  10.717   1.359   6.410
  324    HA   GLN   6           HA       GLN   6  12.997   0.017   7.410
  325    HB2  GLN   6           HB2      GLN   6  11.019  -0.593   5.231
  326    HB3  GLN   6           HB1      GLN   6  12.402  -1.648   5.535
  327    HG2  GLN   6           HG2      GLN   6  10.603  -0.778   7.787
  328    HG3  GLN   6           HG1      GLN   6  10.180  -2.157   6.777
  329   HE21  GLN   6          HE21      GLN   6  11.473  -4.097   6.967
  330   HE22  GLN   6          HE22      GLN   6  12.633  -4.288   8.193
  331    H    ILE   7           HN       ILE   7  12.356   1.692   4.362
  332    HA   ILE   7           HA       ILE   7  14.696   0.849   3.006
  333    HB   ILE   7           HB       ILE   7  12.997   3.331   2.699
  334   HG12  ILE   7          HG12      ILE   7  13.112   0.830   0.998
  335   HG13  ILE   7          HG11      ILE   7  11.969   1.029   2.326
  336   HG21  ILE   7          HG21      ILE   7  15.166   3.772   1.725
  337   HG22  ILE   7          HG22      ILE   7  14.056   3.391   0.409
  338   HG23  ILE   7          HG23      ILE   7  15.205   2.177   0.973
  339   HD11  ILE   7          HD11      ILE   7  11.174   1.685  -0.047
  340   HD12  ILE   7          HD12      ILE   7  12.199   3.106   0.149
  341   HD13  ILE   7          HD13      ILE   7  10.862   2.822   1.264
  342    H    LEU   8           HN       LEU   8  13.961   3.866   4.789
  343    HA   LEU   8           HA       LEU   8  16.561   4.954   4.514
  344    HB2  LEU   8           HB2      LEU   8  14.526   6.261   5.122
  345    HB3  LEU   8           HB1      LEU   8  14.551   5.499   6.711
  346    HG   LEU   8           HG       LEU   8  16.955   6.362   6.925
  347   HD11  LEU   8          HD11      LEU   8  17.392   6.864   4.587
  348   HD12  LEU   8          HD12      LEU   8  17.436   8.372   5.503
  349   HD13  LEU   8          HD13      LEU   8  16.021   7.971   4.530
  350   HD21  LEU   8          HD21      LEU   8  14.774   8.456   6.659
  351   HD22  LEU   8          HD22      LEU   8  16.209   8.550   7.680
  352   HD23  LEU   8          HD23      LEU   8  14.946   7.373   8.041
  353    H    SER   9           HN       SER   9  15.109   2.803   6.868
  354    HA   SER   9           HA       SER   9  17.174   2.979   8.823
  355    HB2  SER   9           HB2      SER   9  16.161   0.980   9.782
  356    HB3  SER   9           HB1      SER   9  14.901   2.116   9.305
  357    HG   SER   9           HG       SER   9  15.442  -0.390   8.393
  358    H    ILE  10           HN       ILE  10  16.479   0.642   6.241
  359    HA   ILE  10           HA       ILE  10  18.702  -1.031   6.700
  360    HB   ILE  10           HB       ILE  10  17.016  -0.525   4.257
  361   HG12  ILE  10          HG12      ILE  10  16.222  -1.766   6.409
  362   HG13  ILE  10          HG11      ILE  10  15.939  -2.533   4.847
  363   HG21  ILE  10          HG21      ILE  10  18.180  -2.723   3.474
  364   HG22  ILE  10          HG22      ILE  10  19.449  -2.283   4.617
  365   HG23  ILE  10          HG23      ILE  10  19.054  -1.204   3.276
  366   HD11  ILE  10          HD11      ILE  10  17.719  -4.063   5.138
  367   HD12  ILE  10          HD12      ILE  10  16.963  -3.993   6.730
  368   HD13  ILE  10          HD13      ILE  10  18.453  -3.100   6.421
  369    H    CYS  11           HN       CYS  11  18.277   1.870   4.694
  370    HA   CYS  11           HA       CYS  11  20.732   1.739   3.324
  371    HB2  CYS  11           HB2      CYS  11  18.970   4.064   4.116
  372    HB3  CYS  11           HB1      CYS  11  20.390   4.233   3.083
  373    HG   CYS  11           HG       CYS  11  19.014   3.429   1.198
  374    H    SER  12           HN       SER  12  19.852   3.494   6.342
  375    HA   SER  12           HA       SER  12  22.401   4.569   6.796
  376    HB2  SER  12           HB2      SER  12  21.629   4.898   9.092
  377    HB3  SER  12           HB1      SER  12  20.352   5.312   7.951
  378    HG   SER  12           HG       SER  12  19.259   3.550   8.512
  379    H    PHE  13           HN       PHE  13  20.934   1.506   7.812
  380    HA   PHE  13           HA       PHE  13  22.919   0.610   9.558
  381    HB2  PHE  13           HB2      PHE  13  20.755  -0.607   7.979
  382    HB3  PHE  13           HB1      PHE  13  22.087  -1.698   8.360
  383    HD1  PHE  13           HD1      PHE  13  20.290   1.083  10.138
  384    HD2  PHE  13           HD2      PHE  13  21.743  -2.957  10.276
  385    HE1  PHE  13           HE1      PHE  13  19.449   0.858  12.461
  386    HE2  PHE  13           HE2      PHE  13  20.903  -3.181  12.598
  387    HZ   PHE  13           HZ       PHE  13  19.756  -1.273  13.691
  388    H    ILE  14           HN       ILE  14  22.607  -0.029   6.045
  389    HA   ILE  14           HA       ILE  14  25.070  -1.452   5.870
  390    HB   ILE  14           HB       ILE  14  24.751  -1.266   3.447
  391   HG12  ILE  14          HG12      ILE  14  22.381   0.515   4.094
  392   HG13  ILE  14          HG11      ILE  14  23.934   1.142   3.545
  393   HG21  ILE  14          HG21      ILE  14  22.421  -2.227   3.358
  394   HG22  ILE  14          HG22      ILE  14  22.227  -1.780   5.052
  395   HG23  ILE  14          HG23      ILE  14  23.446  -2.965   4.588
  396   HD11  ILE  14          HD11      ILE  14  23.742  -0.250   1.499
  397   HD12  ILE  14          HD12      ILE  14  22.410   0.896   1.651
  398   HD13  ILE  14          HD13      ILE  14  22.159  -0.804   2.047
  399    H    LEU  15           HN       LEU  15  24.229   1.925   5.835
  400    HA   LEU  15           HA       LEU  15  26.581   2.861   4.511
  401    HB2  LEU  15           HB2      LEU  15  24.342   4.066   6.063
  402    HB3  LEU  15           HB1      LEU  15  25.829   5.005   5.923
  403    HG   LEU  15           HG       LEU  15  24.585   3.727   3.492
  404   HD11  LEU  15          HD11      LEU  15  22.891   5.167   4.704
  405   HD12  LEU  15          HD12      LEU  15  23.301   5.728   3.083
  406   HD13  LEU  15          HD13      LEU  15  23.995   6.525   4.494
  407   HD21  LEU  15          HD21      LEU  15  26.848   4.578   3.244
  408   HD22  LEU  15          HD22      LEU  15  26.400   6.104   4.003
  409   HD23  LEU  15          HD23      LEU  15  25.751   5.685   2.418
  410    H    SER  16           HN       SER  16  25.612   3.197   7.943
  411    HA   SER  16           HA       SER  16  28.071   3.956   8.929
  412    HB2  SER  16           HB2      SER  16  27.274   3.112  11.108
  413    HB3  SER  16           HB1      SER  16  26.006   3.994  10.261
  414    HG   SER  16           HG       SER  16  25.015   2.117   9.773
  415    H    ALA  17           HN       ALA  17  26.908   0.759   8.064
  416    HA   ALA  17           HA       ALA  17  28.927  -0.761   9.349
  417    HB1  ALA  17           HB1      ALA  17  28.249  -2.557   7.840
  418    HB2  ALA  17           HB2      ALA  17  27.403  -1.402   6.812
  419    HB3  ALA  17           HB3      ALA  17  26.822  -1.716   8.446
  420    H    LEU  18           HN       LEU  18  28.658   0.477   6.006
  421    HA   LEU  18           HA       LEU  18  31.222  -0.480   5.210
  422    HB2  LEU  18           HB2      LEU  18  29.355   1.579   4.027
  423    HB3  LEU  18           HB1      LEU  18  30.873   1.093   3.269
  424    HG   LEU  18           HG       LEU  18  28.743  -0.900   4.075
  425   HD11  LEU  18          HD11      LEU  18  29.152   0.578   1.464
  426   HD12  LEU  18          HD12      LEU  18  27.691   0.523   2.451
  427   HD13  LEU  18          HD13      LEU  18  28.228  -0.918   1.586
  428   HD21  LEU  18          HD21      LEU  18  31.227  -0.965   2.339
  429   HD22  LEU  18          HD22      LEU  18  29.992  -2.221   2.261
  430   HD23  LEU  18          HD23      LEU  18  30.876  -1.946   3.762
  431    H    HIS  19           HN       HIS  19  30.086   2.373   6.830
  432    HA   HIS  19           HA       HIS  19  32.263   4.098   6.278
  433    HB2  HIS  19           HB2      HIS  19  30.338   5.144   7.129
  434    HB3  HIS  19           HB1      HIS  19  30.176   3.983   8.446
  435    HD2  HIS  19           HD2      HIS  19  32.534   7.038   7.509
  436    HE1  HIS  19           HE1      HIS  19  32.927   6.216  11.632
  437    HE2  HIS  19           HE2      HIS  19  33.598   7.805   9.767
  438    H    PHE  20           HN       PHE  20  31.571   1.968   9.063
  439    HA   PHE  20           HA       PHE  20  34.060   2.514  10.346
  440    HB2  PHE  20           HB2      PHE  20  31.721   0.807  10.820
  441    HB3  PHE  20           HB1      PHE  20  33.242   0.102  11.368
  442    HD1  PHE  20           HD1      PHE  20  30.610   2.298  12.236
  443    HD2  PHE  20           HD2      PHE  20  34.855   1.785  12.644
  444    HE1  PHE  20           HE1      PHE  20  30.600   3.798  14.212
  445    HE2  PHE  20           HE2      PHE  20  34.846   3.284  14.620
  446    HZ   PHE  20           HZ       PHE  20  32.714   4.291  15.409
  447    H    MET  21           HN       MET  21  32.979   0.278   7.900
  448    HA   MET  21           HA       MET  21  35.023  -1.654   8.123
  449    HB2  MET  21           HB2      MET  21  33.123  -0.765   6.010
  450    HB3  MET  21           HB1      MET  21  34.509  -1.728   5.494
  451    HG2  MET  21           HG2      MET  21  33.926  -3.438   7.208
  452    HG3  MET  21           HG1      MET  21  32.502  -2.493   7.640
  453    HE1  MET  21           HE1      MET  21  32.925  -5.780   5.965
  454    HE2  MET  21           HE2      MET  21  31.171  -5.627   5.899
  455    HE3  MET  21           HE3      MET  21  32.045  -5.063   7.322
  456    H    ALA  22           HN       ALA  22  34.786   1.151   5.916
  457    HA   ALA  22           HA       ALA  22  37.399   0.911   4.880
  458    HB1  ALA  22           HB1      ALA  22  37.074   3.178   4.034
  459    HB2  ALA  22           HB2      ALA  22  35.698   3.406   5.114
  460    HB3  ALA  22           HB3      ALA  22  35.602   2.233   3.799
  461    H    TRP  23           HN       TRP  23  36.063   2.699   7.625
  462    HA   TRP  23           HA       TRP  23  38.348   4.185   8.292
  463    HB2  TRP  23           HB2      TRP  23  35.810   3.520   9.512
  464    HB3  TRP  23           HB1      TRP  23  37.103   3.507  10.711
  465    HD1  TRP  23           HD1      TRP  23  35.875   5.809   7.839
  466    HE1  TRP  23           HE1      TRP  23  36.257   8.248   8.574
  467    HE3  TRP  23           HE3      TRP  23  38.120   5.044  12.367
  468    HZ2  TRP  23           HZ2      TRP  23  37.375   9.688  10.773
  469    HZ3  TRP  23           HZ3      TRP  23  38.831   6.969  13.758
  470    HH2  TRP  23           HH2      TRP  23  38.460   9.289  12.968
  471    H    THR  24           HN       THR  24  37.309   0.958   9.370
  472    HA   THR  24           HA       THR  24  39.369   0.420  11.152
  473    HB   THR  24           HB       THR  24  37.895  -1.471   9.299
  474    HG1  THR  24           HG1      THR  24  37.508  -0.887  12.044
  475   HG21  THR  24          HG21      THR  24  39.903  -2.560  10.073
  476   HG22  THR  24          HG22      THR  24  38.554  -3.184  11.022
  477   HG23  THR  24          HG23      THR  24  39.642  -1.983  11.718
  478    H    ILE  25           HN       ILE  25  39.202  -0.121   7.644
  479    HA   ILE  25           HA       ILE  25  41.768  -1.309   7.401
  480    HB   ILE  25           HB       ILE  25  40.131   0.239   5.371
  481   HG12  ILE  25          HG12      ILE  25  40.472  -2.754   5.721
  482   HG13  ILE  25          HG11      ILE  25  39.132  -1.854   6.433
  483   HG21  ILE  25          HG21      ILE  25  42.509   0.098   4.728
  484   HG22  ILE  25          HG22      ILE  25  41.531  -0.965   3.713
  485   HG23  ILE  25          HG23      ILE  25  42.492  -1.641   5.027
  486   HD11  ILE  25          HD11      ILE  25  38.624  -0.980   4.106
  487   HD12  ILE  25          HD12      ILE  25  38.343  -2.706   4.332
  488   HD13  ILE  25          HD13      ILE  25  39.792  -2.152   3.494
  489    H    GLY  26           HN       GLY  26  40.621   2.009   7.267
  490    HA2  GLY  26           HA2      GLY  26  42.999   3.259   6.399
  491    HA3  GLY  26           HA1      GLY  26  41.732   4.044   7.339
  492    H    HIS  27           HN       HIS  27  41.784   2.650   9.689
  493    HA   HIS  27           HA       HIS  27  43.955   3.802  11.073
  494    HB2  HIS  27           HB2      HIS  27  41.604   2.244  11.718
  495    HB3  HIS  27           HB1      HIS  27  42.992   1.692  12.657
  496    HD2  HIS  27           HD2      HIS  27  44.335   3.934  14.078
  497    HE1  HIS  27           HE1      HIS  27  40.814   6.261  14.144
  498    HE2  HIS  27           HE2      HIS  27  43.147   6.013  15.117
  499    H    LEU  28           HN       LEU  28  43.398   0.540   9.832
  500    HA   LEU  28           HA       LEU  28  45.812  -0.535  10.985
  501    HB2  LEU  28           HB2      LEU  28  43.965  -1.608   8.842
  502    HB3  LEU  28           HB1      LEU  28  45.288  -2.509   9.580
  503    HG   LEU  28           HG       LEU  28  43.030  -1.271  11.172
  504   HD11  LEU  28          HD11      LEU  28  43.359  -4.189  10.437
  505   HD12  LEU  28          HD12      LEU  28  42.318  -3.087   9.535
  506   HD13  LEU  28          HD13      LEU  28  41.983  -3.425  11.234
  507   HD21  LEU  28          HD21      LEU  28  45.304  -3.174  11.787
  508   HD22  LEU  28          HD22      LEU  28  43.896  -3.027  12.841
  509   HD23  LEU  28          HD23      LEU  28  44.937  -1.631  12.560
  510    H    ASN  29           HN       ASN  29  44.979   1.202   8.122
  511    HA   ASN  29           HA       ASN  29  47.138   0.311   6.473
  512    HB2  ASN  29           HB2      ASN  29  45.627   1.289   5.098
  513    HB3  ASN  29           HB1      ASN  29  45.031   2.372   6.354
  514   HD21  ASN  29          HD21      ASN  29  45.983   4.474   6.521
  515   HD22  ASN  29          HD22      ASN  29  47.150   5.042   5.427
  516    H    GLN  30           HN       GLN  30  46.659   3.014   8.703
  517    HA   GLN  30           HA       GLN  30  49.009   4.439   8.105
  518    HB2  GLN  30           HB2      GLN  30  47.108   5.287   9.496
  519    HB3  GLN  30           HB1      GLN  30  47.649   4.230  10.803
  520    HG2  GLN  30           HG2      GLN  30  49.482   5.517  11.271
  521    HG3  GLN  30           HG1      GLN  30  49.724   5.971   9.584
  522   HE21  GLN  30          HE21      GLN  30  47.166   6.477  12.099
  523   HE22  GLN  30          HE22      GLN  30  46.944   8.119  11.734
  524    H    ILE  31           HN       ILE  31  48.396   1.764  10.330
  525    HA   ILE  31           HA       ILE  31  51.291   1.298  10.490
  526    HB   ILE  31           HB       ILE  31  50.931   2.480  12.515
  527   HG12  ILE  31          HG12      ILE  31  50.556  -0.402  13.341
  528   HG13  ILE  31          HG11      ILE  31  52.058   0.168  12.613
  529   HG21  ILE  31          HG21      ILE  31  48.400   2.324  12.420
  530   HG22  ILE  31          HG22      ILE  31  49.088   2.102  14.029
  531   HG23  ILE  31          HG23      ILE  31  48.541   0.703  13.104
  532   HD11  ILE  31          HD11      ILE  31  52.387   1.775  14.391
  533   HD12  ILE  31          HD12      ILE  31  52.065   0.209  15.133
  534   HD13  ILE  31          HD13      ILE  31  50.793   1.428  15.061
  535    H    LYS  32           HN       LYS  32  51.224  -0.559   9.295
  536    HA   LYS  32           HA       LYS  32  49.361  -2.672  10.166
  537    HB2  LYS  32           HB2      LYS  32  49.485  -1.930   7.726
  538    HB3  LYS  32           HB1      LYS  32  51.069  -2.702   7.684
  539    HG2  LYS  32           HG2      LYS  32  49.996  -4.816   8.511
  540    HG3  LYS  32           HG1      LYS  32  48.427  -4.026   8.351
  541    HD2  LYS  32           HD2      LYS  32  50.390  -4.252   6.060
  542    HD3  LYS  32           HD1      LYS  32  49.128  -5.447   6.363
  543    HE2  LYS  32           HE2      LYS  32  47.416  -3.660   6.212
  544    HE3  LYS  32           HE1      LYS  32  48.688  -2.489   5.860
  545    HZ1  LYS  32           HZ1      LYS  32  48.989  -3.297   3.784
  546    HZ2  LYS  32           HZ2      LYS  32  47.364  -3.754   3.968
  547    HZ3  LYS  32           HZ3      LYS  32  48.603  -4.893   4.208
  548    H    ARG  33           HN       ARG  33  52.771  -1.953   9.613
  549    HA   ARG  33           HA       ARG  33  53.605  -4.613  10.431
  550    HB2  ARG  33           HB2      ARG  33  55.833  -3.881   9.951
  551    HB3  ARG  33           HB1      ARG  33  54.798  -3.231   8.678
  552    HG2  ARG  33           HG2      ARG  33  54.661  -1.080   9.945
  553    HG3  ARG  33           HG1      ARG  33  55.809  -1.733  11.115
  554    HD2  ARG  33           HD2      ARG  33  57.446  -2.073   9.277
  555    HD3  ARG  33           HD1      ARG  33  56.306  -1.334   8.152
  556    HE   ARG  33           HE       ARG  33  57.928   0.037  10.122
  557   HH11  ARG  33          HH11      ARG  33  55.054   0.141   8.140
  558   HH12  ARG  33          HH12      ARG  33  54.979   1.874   8.138
  559   HH21  ARG  33          HH21      ARG  33  57.794   2.296  10.105
  560   HH22  ARG  33          HH22      ARG  33  56.513   3.082   9.242
  561    H1   MET   1           HT1      MET   1   7.660   1.913  21.204
  562    H2   MET   1           HT2      MET   1   8.349   2.392  22.682
  563    H3   MET   1           HT3      MET   1   6.707   1.962  22.606
  564    HA   MET   1           HA       MET   1   9.076   0.271  22.712
  565    HB2  MET   1           HB2      MET   1   6.337   0.443  23.857
  566    HB3  MET   1           HB1      MET   1   7.009  -1.176  23.658
  567    HG2  MET   1           HG2      MET   1   8.526   1.072  24.998
  568    HG3  MET   1           HG1      MET   1   7.510  -0.061  25.888
  569    HE1  MET   1           HE1      MET   1   9.118  -3.184  26.203
  570    HE2  MET   1           HE2      MET   1   8.177  -3.141  24.715
  571    HE3  MET   1           HE3      MET   1   7.633  -2.224  26.119
  572    H    PHE   2           HN       PHE   2   6.054   0.601  20.947
  573    HA   PHE   2           HA       PHE   2   6.718  -1.827  19.400
  574    HB2  PHE   2           HB2      PHE   2   4.166  -0.602  20.280
  575    HB3  PHE   2           HB1      PHE   2   4.182  -1.279  18.650
  576    HD1  PHE   2           HD1      PHE   2   3.761  -2.029  22.087
  577    HD2  PHE   2           HD2      PHE   2   5.317  -3.654  18.428
  578    HE1  PHE   2           HE1      PHE   2   3.587  -4.318  23.028
  579    HE2  PHE   2           HE2      PHE   2   5.142  -5.942  19.369
  580    HZ   PHE   2           HZ       PHE   2   4.278  -6.273  21.669
  581    H    GLU   3           HN       GLU   3   7.250   1.371  19.255
  582    HA   GLU   3           HA       GLU   3   6.395   1.748  16.502
  583    HB2  GLU   3           HB2      GLU   3   7.730   3.591  18.488
  584    HB3  GLU   3           HB1      GLU   3   7.379   4.034  16.815
  585    HG2  GLU   3           HG2      GLU   3   4.993   3.515  17.179
  586    HG3  GLU   3           HG1      GLU   3   5.344   3.112  18.859
  587    HA   PRO   4           HA       PRO   4  10.384   0.283  15.054
  588    HB2  PRO   4           HB2      PRO   4  10.178   1.236  12.471
  589    HB3  PRO   4           HB1      PRO   4   9.401  -0.249  13.050
  590    HG2  PRO   4           HG2      PRO   4   8.242   2.467  12.671
  591    HG3  PRO   4           HG1      PRO   4   7.539   0.878  12.319
  592    HD2  PRO   4           HD2      PRO   4   6.864   2.292  14.528
  593    HD3  PRO   4           HD1      PRO   4   6.908   0.517  14.515
  594    H    PHE   5           HN       PHE   5   9.330   3.604  14.808
  595    HA   PHE   5           HA       PHE   5  11.714   4.798  13.901
  596    HB2  PHE   5           HB2      PHE   5  10.252   6.501  13.900
  597    HB3  PHE   5           HB1      PHE   5   9.186   5.669  15.033
  598    HD1  PHE   5           HD1      PHE   5  12.122   7.908  14.735
  599    HD2  PHE   5           HD2      PHE   5   9.303   6.075  17.408
  600    HE1  PHE   5           HE1      PHE   5  12.886   9.400  16.566
  601    HE2  PHE   5           HE2      PHE   5  10.066   7.566  19.238
  602    HZ   PHE   5           HZ       PHE   5  11.869   9.219  18.822
  603    H    GLN   6           HN       GLN   6  10.655   3.722  17.072
  604    HA   GLN   6           HA       GLN   6  12.616   5.060  18.612
  605    HB2  GLN   6           HB2      GLN   6  10.964   2.587  19.055
  606    HB3  GLN   6           HB1      GLN   6  12.173   3.106  20.231
  607    HG2  GLN   6           HG2      GLN   6  10.126   5.043  19.170
  608    HG3  GLN   6           HG1      GLN   6   9.740   3.970  20.514
  609   HE21  GLN   6          HE21      GLN   6  10.807   4.349  22.564
  610   HE22  GLN   6          HE22      GLN   6  11.724   5.747  22.853
  611    H    ILE   7           HN       ILE   7  12.620   1.957  16.916
  612    HA   ILE   7           HA       ILE   7  15.061   0.982  17.974
  613    HB   ILE   7           HB       ILE   7  13.669   0.429  15.349
  614   HG12  ILE   7          HG12      ILE   7  13.820  -1.249  17.864
  615   HG13  ILE   7          HG11      ILE   7  12.504  -0.119  17.548
  616   HG21  ILE   7          HG21      ILE   7  15.995  -0.186  15.115
  617   HG22  ILE   7          HG22      ILE   7  15.079  -1.666  15.408
  618   HG23  ILE   7          HG23      ILE   7  16.007  -0.930  16.715
  619   HD11  ILE   7          HD11      ILE   7  12.162  -2.585  16.840
  620   HD12  ILE   7          HD12      ILE   7  13.270  -2.219  15.517
  621   HD13  ILE   7          HD13      ILE   7  11.751  -1.333  15.668
  622    H    LEU   8           HN       LEU   8  14.333   2.657  14.898
  623    HA   LEU   8           HA       LEU   8  17.035   2.802  14.052
  624    HB2  LEU   8           HB2      LEU   8  15.061   3.087  12.561
  625    HB3  LEU   8           HB1      LEU   8  14.763   4.658  13.304
  626    HG   LEU   8           HG       LEU   8  17.171   5.251  12.662
  627   HD11  LEU   8          HD11      LEU   8  18.014   3.011  12.225
  628   HD12  LEU   8          HD12      LEU   8  18.052   3.927  10.719
  629   HD13  LEU   8          HD13      LEU   8  16.775   2.743  11.000
  630   HD21  LEU   8          HD21      LEU   8  15.258   4.650  10.383
  631   HD22  LEU   8          HD22      LEU   8  16.519   5.882  10.404
  632   HD23  LEU   8          HD23      LEU   8  15.114   6.041  11.458
  633    H    SER   9           HN       SER   9  15.036   4.879  16.042
  634    HA   SER   9           HA       SER   9  16.776   7.136  16.042
  635    HB2  SER   9           HB2      SER   9  15.444   7.910  17.931
  636    HB3  SER   9           HB1      SER   9  14.386   7.250  16.685
  637    HG   SER   9           HG       SER   9  14.811   6.422  19.238
  638    H    ILE  10           HN       ILE  10  16.278   4.465  18.328
  639    HA   ILE  10           HA       ILE  10  18.236   5.255  20.193
  640    HB   ILE  10           HB       ILE  10  17.014   2.576  19.552
  641   HG12  ILE  10          HG12      ILE  10  15.780   4.574  20.694
  642   HG13  ILE  10          HG11      ILE  10  15.664   2.979  21.436
  643   HG21  ILE  10          HG21      ILE  10  18.072   1.979  21.860
  644   HG22  ILE  10          HG22      ILE  10  19.181   3.309  21.529
  645   HG23  ILE  10          HG23      ILE  10  19.109   1.926  20.435
  646   HD11  ILE  10          HD11      ILE  10  17.216   3.522  23.134
  647   HD12  ILE  10          HD12      ILE  10  16.243   4.984  22.978
  648   HD13  ILE  10          HD13      ILE  10  17.844   4.909  22.243
  649    H    CYS  11           HN       CYS  11  18.406   3.218  17.292
  650    HA   CYS  11           HA       CYS  11  21.026   2.260  17.652
  651    HB2  CYS  11           HB2      CYS  11  19.383   2.775  15.171
  652    HB3  CYS  11           HB1      CYS  11  20.961   1.987  15.140
  653    HG   CYS  11           HG       CYS  11  19.836  -0.104  15.818
  654    H    SER  12           HN       SER  12  19.842   5.106  15.803
  655    HA   SER  12           HA       SER  12  22.377   5.966  14.960
  656    HB2  SER  12           HB2      SER  12  21.287   8.111  14.537
  657    HB3  SER  12           HB1      SER  12  20.249   6.785  14.018
  658    HG   SER  12           HG       SER  12  18.925   7.157  15.671
  659    H    PHE  13           HN       PHE  13  20.486   6.723  17.866
  660    HA   PHE  13           HA       PHE  13  22.079   8.753  18.925
  661    HB2  PHE  13           HB2      PHE  13  20.089   6.844  19.948
  662    HB3  PHE  13           HB1      PHE  13  21.235   7.424  21.156
  663    HD1  PHE  13           HD1      PHE  13  19.454   8.916  18.203
  664    HD2  PHE  13           HD2      PHE  13  20.468   9.248  22.363
  665    HE1  PHE  13           HE1      PHE  13  18.238  11.074  18.327
  666    HE2  PHE  13           HE2      PHE  13  19.252  11.407  22.487
  667    HZ   PHE  13           HZ       PHE  13  18.138  12.320  20.470
  668    H    ILE  14           HN       ILE  14  22.265   5.235  19.569
  669    HA   ILE  14           HA       ILE  14  24.583   5.443  21.213
  670    HB   ILE  14           HB       ILE  14  24.675   2.998  21.016
  671   HG12  ILE  14          HG12      ILE  14  22.403   3.275  19.020
  672   HG13  ILE  14          HG11      ILE  14  24.076   2.986  18.542
  673   HG21  ILE  14          HG21      ILE  14  22.314   2.533  21.765
  674   HG22  ILE  14          HG22      ILE  14  21.890   4.175  21.282
  675   HG23  ILE  14          HG23      ILE  14  23.054   3.910  22.579
  676   HD11  ILE  14          HD11      ILE  14  24.087   0.924  19.929
  677   HD12  ILE  14          HD12      ILE  14  22.863   0.868  18.661
  678   HD13  ILE  14          HD13      ILE  14  22.390   1.207  20.327
  679    H    LEU  15           HN       LEU  15  24.080   5.289  17.773
  680    HA   LEU  15           HA       LEU  15  26.689   4.366  17.072
  681    HB2  LEU  15           HB2      LEU  15  24.357   5.549  15.651
  682    HB3  LEU  15           HB1      LEU  15  25.928   5.654  14.856
  683    HG   LEU  15           HG       LEU  15  24.971   3.048  16.030
  684   HD11  LEU  15          HD11      LEU  15  23.254   3.996  14.420
  685   HD12  LEU  15          HD12      LEU  15  23.955   2.454  13.929
  686   HD13  LEU  15          HD13      LEU  15  24.503   3.953  13.176
  687   HD21  LEU  15          HD21      LEU  15  27.316   3.175  15.400
  688   HD22  LEU  15          HD22      LEU  15  26.895   3.855  13.827
  689   HD23  LEU  15          HD23      LEU  15  26.476   2.185  14.208
  690    H    SER  16           HN       SER  16  25.222   7.603  16.638
  691    HA   SER  16           HA       SER  16  27.555   8.972  16.090
  692    HB2  SER  16           HB2      SER  16  26.349  10.990  16.844
  693    HB3  SER  16           HB1      SER  16  25.322   9.961  15.848
  694    HG   SER  16           HG       SER  16  24.244   9.306  17.623
  695    H    ALA  17           HN       ALA  17  26.252   7.917  19.177
  696    HA   ALA  17           HA       ALA  17  27.896   9.497  20.862
  697    HB1  ALA  17           HB1      ALA  17  27.304   7.887  22.602
  698    HB2  ALA  17           HB2      ALA  17  26.736   6.747  21.382
  699    HB3  ALA  17           HB3      ALA  17  25.882   8.270  21.631
  700    H    LEU  18           HN       LEU  18  28.269   6.161  19.640
  701    HA   LEU  18           HA       LEU  18  30.830   5.772  20.830
  702    HB2  LEU  18           HB2      LEU  18  29.373   4.322  18.617
  703    HB3  LEU  18           HB1      LEU  18  30.939   3.812  19.246
  704    HG   LEU  18           HG       LEU  18  28.535   4.254  21.030
  705   HD11  LEU  18          HD11      LEU  18  29.488   1.753  19.614
  706   HD12  LEU  18          HD12      LEU  18  27.890   2.493  19.527
  707   HD13  LEU  18          HD13      LEU  18  28.422   1.715  21.018
  708   HD21  LEU  18          HD21      LEU  18  31.244   2.935  21.336
  709   HD22  LEU  18          HD22      LEU  18  29.926   2.654  22.473
  710   HD23  LEU  18          HD23      LEU  18  30.585   4.278  22.270
  711    H    HIS  19           HN       HIS  19  29.722   7.209  17.868
  712    HA   HIS  19           HA       HIS  19  32.110   7.021  16.361
  713    HB2  HIS  19           HB2      HIS  19  30.185   7.561  15.131
  714    HB3  HIS  19           HB1      HIS  19  29.703   8.826  16.260
  715    HD2  HIS  19           HD2      HIS  19  32.458   8.301  13.449
  716    HE1  HIS  19           HE1      HIS  19  32.110  12.427  14.275
  717    HE2  HIS  19           HE2      HIS  19  33.215  10.706  12.768
  718    H    PHE  20           HN       PHE  20  30.791   9.647  18.398
  719    HA   PHE  20           HA       PHE  20  33.086  11.310  18.066
  720    HB2  PHE  20           HB2      PHE  20  30.552  11.395  19.548
  721    HB3  PHE  20           HB1      PHE  20  31.894  12.176  20.386
  722    HD1  PHE  20           HD1      PHE  20  29.371  12.625  17.945
  723    HD2  PHE  20           HD2      PHE  20  33.430  13.703  18.848
  724    HE1  PHE  20           HE1      PHE  20  29.188  14.579  16.428
  725    HE2  PHE  20           HE2      PHE  20  33.250  15.658  17.330
  726    HZ   PHE  20           HZ       PHE  20  31.124  16.098  16.117
  727    H    MET  21           HN       MET  21  32.200   8.714  20.223
  728    HA   MET  21           HA       MET  21  33.998   9.246  22.327
  729    HB2  MET  21           HB2      MET  21  32.551   6.860  21.289
  730    HB3  MET  21           HB1      MET  21  33.905   6.571  22.383
  731    HG2  MET  21           HG2      MET  21  32.895   8.156  24.014
  732    HG3  MET  21           HG1      MET  21  31.518   8.365  22.932
  733    HE1  MET  21           HE1      MET  21  31.887   6.752  26.257
  734    HE2  MET  21           HE2      MET  21  30.188   6.411  25.940
  735    HE3  MET  21           HE3      MET  21  30.875   7.958  25.451
  736    H    ALA  22           HN       ALA  22  34.373   7.042  19.544
  737    HA   ALA  22           HA       ALA  22  37.087   6.433  20.026
  738    HB1  ALA  22           HB1      ALA  22  37.114   5.559  17.750
  739    HB2  ALA  22           HB2      ALA  22  35.614   6.413  17.381
  740    HB3  ALA  22           HB3      ALA  22  35.612   5.093  18.551
  741    H    TRP  23           HN       TRP  23  35.503   8.945  18.100
  742    HA   TRP  23           HA       TRP  23  37.783   9.972  16.826
  743    HB2  TRP  23           HB2      TRP  23  35.034  10.774  17.237
  744    HB3  TRP  23           HB1      TRP  23  36.113  12.162  17.367
  745    HD1  TRP  23           HD1      TRP  23  35.583   9.150  14.986
  746    HE1  TRP  23           HE1      TRP  23  36.062   9.947  12.585
  747    HE3  TRP  23           HE3      TRP  23  36.989  13.971  15.913
  748    HZ2  TRP  23           HZ2      TRP  23  36.940  12.308  11.230
  749    HZ3  TRP  23           HZ3      TRP  23  37.641  15.471  14.051
  750    HH2  TRP  23           HH2      TRP  23  37.618  14.648  11.713
  751    H    THR  24           HN       THR  24  36.289  10.850  19.933
  752    HA   THR  24           HA       THR  24  37.980  12.933  20.646
  753    HB   THR  24           HB       THR  24  36.650  10.857  22.408
  754    HG1  THR  24           HG1      THR  24  35.883  13.506  21.757
  755   HG21  THR  24          HG21      THR  24  38.395  11.938  23.675
  756   HG22  THR  24          HG22      THR  24  36.858  12.658  24.156
  757   HG23  THR  24          HG23      THR  24  37.931  13.522  23.055
  758    H    ILE  25           HN       ILE  25  38.320   9.445  21.199
  759    HA   ILE  25           HA       ILE  25  40.773   9.598  22.622
  760    HB   ILE  25           HB       ILE  25  39.630   7.347  20.943
  761   HG12  ILE  25          HG12      ILE  25  39.622   7.725  23.952
  762   HG13  ILE  25          HG11      ILE  25  38.279   8.222  22.921
  763   HG21  ILE  25          HG21      ILE  25  42.060   7.093  21.323
  764   HG22  ILE  25          HG22      ILE  25  41.155   5.921  22.282
  765   HG23  ILE  25          HG23      ILE  25  41.821   7.364  23.049
  766   HD11  ILE  25          HD11      ILE  25  38.231   5.850  22.024
  767   HD12  ILE  25          HD12      ILE  25  37.755   6.017  23.713
  768   HD13  ILE  25          HD13      ILE  25  39.366   5.423  23.305
  769    H    GLY  26           HN       GLY  26  39.975   9.308  19.216
  770    HA2  GLY  26           HA2      GLY  26  42.565   8.837  18.195
  771    HA3  GLY  26           HA1      GLY  26  41.244   9.570  17.291
  772    H    HIS  27           HN       HIS  27  40.795  11.889  18.667
  773    HA   HIS  27           HA       HIS  27  42.817  13.606  17.709
  774    HB2  HIS  27           HB2      HIS  27  40.258  13.861  19.037
  775    HB3  HIS  27           HB1      HIS  27  41.422  15.004  19.705
  776    HD2  HIS  27           HD2      HIS  27  42.730  16.629  17.582
  777    HE1  HIS  27           HE1      HIS  27  39.469  16.156  14.943
  778    HE2  HIS  27           HE2      HIS  27  41.588  17.479  15.394
  779    H    LEU  28           HN       LEU  28  42.161  12.271  20.916
  780    HA   LEU  28           HA       LEU  28  44.251  13.782  22.200
  781    HB2  LEU  28           HB2      LEU  28  42.672  11.367  23.113
  782    HB3  LEU  28           HB1      LEU  28  43.775  12.297  24.129
  783    HG   LEU  28           HG       LEU  28  41.419  13.523  22.672
  784   HD11  LEU  28          HD11      LEU  28  41.583  12.827  25.614
  785   HD12  LEU  28          HD12      LEU  28  40.807  11.779  24.425
  786   HD13  LEU  28          HD13      LEU  28  40.177  13.401  24.717
  787   HD21  LEU  28          HD21      LEU  28  43.378  14.472  24.781
  788   HD22  LEU  28          HD22      LEU  28  41.843  15.293  24.490
  789   HD23  LEU  28          HD23      LEU  28  43.044  15.192  23.203
  790    H    ASN  29           HN       ASN  29  44.045  10.833  20.421
  791    HA   ASN  29           HA       ASN  29  46.345   9.541  21.519
  792    HB2  ASN  29           HB2      ASN  29  45.167   7.951  20.415
  793    HB3  ASN  29           HB1      ASN  29  44.484   9.107  19.271
  794   HD21  ASN  29          HD21      ASN  29  45.590   9.435  17.266
  795   HD22  ASN  29          HD22      ASN  29  46.964   8.542  16.818
  796    H    GLN  30           HN       GLN  30  45.774  11.687  18.767
  797    HA   GLN  30           HA       GLN  30  48.311  11.480  17.572
  798    HB2  GLN  30           HB2      GLN  30  46.302  12.558  16.539
  799    HB3  GLN  30           HB1      GLN  30  46.527  13.926  17.632
  800    HG2  GLN  30           HG2      GLN  30  48.378  14.685  16.520
  801    HG3  GLN  30           HG1      GLN  30  48.921  13.061  16.100
  802   HE21  GLN  30          HE21      GLN  30  46.060  15.151  15.344
  803   HE22  GLN  30          HE22      GLN  30  46.050  14.769  13.690
  804    H    ILE  31           HN       ILE  31  47.106  13.563  20.157
  805    HA   ILE  31           HA       ILE  31  49.881  14.177  20.892
  806    HB   ILE  31           HB       ILE  31  49.316  16.126  19.664
  807   HG12  ILE  31          HG12      ILE  31  48.548  16.866  22.490
  808   HG13  ILE  31          HG11      ILE  31  50.193  16.386  22.071
  809   HG21  ILE  31          HG21      ILE  31  46.827  15.628  19.587
  810   HG22  ILE  31          HG22      ILE  31  47.229  17.326  19.854
  811   HG23  ILE  31          HG23      ILE  31  46.710  16.320  21.207
  812   HD11  ILE  31          HD11      ILE  31  50.388  18.201  20.484
  813   HD12  ILE  31          HD12      ILE  31  49.807  18.875  22.008
  814   HD13  ILE  31          HD13      ILE  31  48.683  18.611  20.674
  815    H    LYS  32           HN       LYS  32  49.833  12.976  22.746
  816    HA   LYS  32           HA       LYS  32  47.665  13.527  24.667
  817    HB2  LYS  32           HB2      LYS  32  48.240  11.143  23.960
  818    HB3  LYS  32           HB1      LYS  32  49.734  11.345  24.876
  819    HG2  LYS  32           HG2      LYS  32  48.353  11.978  26.875
  820    HG3  LYS  32           HG1      LYS  32  46.908  11.578  25.945
  821    HD2  LYS  32           HD2      LYS  32  49.179   9.623  26.367
  822    HD3  LYS  32           HD1      LYS  32  47.782   9.715  27.440
  823    HE2  LYS  32           HE2      LYS  32  46.286   9.309  25.506
  824    HE3  LYS  32           HE1      LYS  32  47.696   9.171  24.457
  825    HZ1  LYS  32           HZ1      LYS  32  48.253   7.164  25.307
  826    HZ2  LYS  32           HZ2      LYS  32  46.582   7.083  25.608
  827    HZ3  LYS  32           HZ3      LYS  32  47.653   7.509  26.856
  828    H    ARG  33           HN       ARG  33  51.172  13.523  24.276
  829    HA   ARG  33           HA       ARG  33  51.613  14.446  26.995
  830    HB2  ARG  33           HB2      ARG  33  53.947  14.331  26.476
  831    HB3  ARG  33           HB1      ARG  33  53.194  12.915  25.746
  832    HG2  ARG  33           HG2      ARG  33  53.059  14.151  23.580
  833    HG3  ARG  33           HG1      ARG  33  53.937  15.489  24.324
  834    HD2  ARG  33           HD2      ARG  33  55.809  13.936  24.835
  835    HD3  ARG  33           HD1      ARG  33  54.940  12.647  24.003
  836    HE   ARG  33           HE       ARG  33  56.347  14.860  22.773
  837   HH11  ARG  33          HH11      ARG  33  53.847  12.449  22.417
  838   HH12  ARG  33          HH12      ARG  33  53.934  12.446  20.684
  839   HH21  ARG  33          HH21      ARG  33  56.429  14.837  20.511
  840   HH22  ARG  33          HH22      ARG  33  55.380  13.787  19.617
  841    H1   MET   1           HT1      MET   1   5.487  17.829  16.368
  842    H2   MET   1           HT2      MET   1   5.977  19.416  16.013
  843    H3   MET   1           HT3      MET   1   4.337  19.073  16.296
  844    HA   MET   1           HA       MET   1   6.520  19.440  18.187
  845    HB2  MET   1           HB2      MET   1   3.662  20.174  17.826
  846    HB3  MET   1           HB1      MET   1   4.227  19.994  19.487
  847    HG2  MET   1           HG2      MET   1   5.695  21.658  17.432
  848    HG3  MET   1           HG1      MET   1   4.469  22.328  18.508
  849    HE1  MET   1           HE1      MET   1   5.758  22.713  21.767
  850    HE2  MET   1           HE2      MET   1   5.065  21.105  21.586
  851    HE3  MET   1           HE3      MET   1   4.384  22.457  20.684
  852    H    PHE   2           HN       PHE   2   3.841  17.265  17.522
  853    HA   PHE   2           HA       PHE   2   4.534  15.708  19.937
  854    HB2  PHE   2           HB2      PHE   2   1.985  16.267  18.531
  855    HB3  PHE   2           HB1      PHE   2   2.192  14.625  19.139
  856    HD1  PHE   2           HD1      PHE   2   1.199  17.917  19.989
  857    HD2  PHE   2           HD2      PHE   2   3.154  14.445  21.593
  858    HE1  PHE   2           HE1      PHE   2   0.704  18.699  22.291
  859    HE2  PHE   2           HE2      PHE   2   2.659  15.226  23.894
  860    HZ   PHE   2           HZ       PHE   2   1.433  17.355  24.242
  861    H    GLU   3           HN       GLU   3   5.337  15.811  16.793
  862    HA   GLU   3           HA       GLU   3   4.940  12.986  16.234
  863    HB2  GLU   3           HB2      GLU   3   6.106  15.236  14.594
  864    HB3  GLU   3           HB1      GLU   3   6.039  13.556  14.056
  865    HG2  GLU   3           HG2      GLU   3   3.592  13.547  14.383
  866    HG3  GLU   3           HG1      GLU   3   3.660  15.237  14.883
  867    HA   PRO   4           HA       PRO   4   8.970  12.071  17.982
  868    HB2  PRO   4           HB2      PRO   4   9.237   9.539  16.913
  869    HB3  PRO   4           HB1      PRO   4   8.266   9.917  18.349
  870    HG2  PRO   4           HG2      PRO   4   7.395   9.513  15.530
  871    HG3  PRO   4           HG1      PRO   4   6.632   8.978  17.038
  872    HD2  PRO   4           HD2      PRO   4   5.741  11.133  15.661
  873    HD3  PRO   4           HD1      PRO   4   5.649  11.034  17.431
  874    H    PHE   5           HN       PHE   5   8.236  11.845  14.578
  875    HA   PHE   5           HA       PHE   5  10.816  11.363  13.560
  876    HB2  PHE   5           HB2      PHE   5   9.513  11.234  11.737
  877    HB3  PHE   5           HB1      PHE   5   8.225  12.152  12.517
  878    HD1  PHE   5           HD1      PHE   5  11.340  12.409  10.529
  879    HD2  PHE   5           HD2      PHE   5   8.013  14.536  12.218
  880    HE1  PHE   5           HE1      PHE   5  11.931  14.406   9.180
  881    HE2  PHE   5           HE2      PHE   5   8.602  16.531  10.870
  882    HZ   PHE   5           HZ       PHE   5  10.568  16.473   9.357
  883    H    GLN   6           HN       GLN   6   9.206  14.283  14.661
  884    HA   GLN   6           HA       GLN   6  11.011  16.161  13.561
  885    HB2  GLN   6           HB2      GLN   6   9.115  16.228  15.894
  886    HB3  GLN   6           HB1      GLN   6  10.170  17.596  15.530
  887    HG2  GLN   6           HG2      GLN   6   8.471  16.345  13.381
  888    HG3  GLN   6           HG1      GLN   6   7.801  17.560  14.468
  889   HE21  GLN   6          HE21      GLN   6   8.568  19.762  14.262
  890   HE22  GLN   6          HE22      GLN   6   9.544  20.255  12.962
  891    H    ILE   7           HN       ILE   7  11.025  14.325  16.582
  892    HA   ILE   7           HA       ILE   7  13.189  15.684  17.806
  893    HB   ILE   7           HB       ILE   7  12.172  12.856  18.131
  894   HG12  ILE   7          HG12      ILE   7  11.807  15.274  19.917
  895   HG13  ILE   7          HG11      ILE   7  10.648  14.826  18.666
  896   HG21  ILE   7          HG21      ILE   7  14.449  12.934  18.935
  897   HG22  ILE   7          HG22      ILE   7  13.387  13.012  20.341
  898   HG23  ILE   7          HG23      ILE   7  14.162  14.477  19.741
  899   HD11  ILE   7          HD11      ILE   7  10.220  13.946  21.059
  900   HD12  ILE   7          HD12      ILE   7  11.545  12.827  20.743
  901   HD13  ILE   7          HD13      ILE   7  10.099  12.793  19.732
  902    H    LEU   8           HN       LEU   8  13.072  12.622  15.959
  903    HA   LEU   8           HA       LEU   8  15.871  12.193  16.015
  904    HB2  LEU   8           HB2      LEU   8  14.170  10.442  15.495
  905    HB3  LEU   8           HB1      LEU   8  13.897  11.220  13.936
  906    HG   LEU   8           HG       LEU   8  16.413  10.971  13.531
  907   HD11  LEU   8          HD11      LEU   8  17.129  10.550  15.820
  908   HD12  LEU   8          HD12      LEU   8  17.476   9.120  14.846
  909   HD13  LEU   8          HD13      LEU   8  16.080   9.134  15.922
  910   HD21  LEU   8          HD21      LEU   8  14.829   8.405  13.874
  911   HD22  LEU   8          HD22      LEU   8  16.167   8.678  12.756
  912   HD23  LEU   8          HD23      LEU   8  14.635   9.518  12.520
  913    H    SER   9           HN       SER   9  13.770  13.974  13.852
  914    HA   SER   9           HA       SER   9  15.666  14.350  11.754
  915    HB2  SER   9           HB2      SER   9  14.128  16.054  10.942
  916    HB3  SER   9           HB1      SER   9  13.220  14.639  11.465
  917    HG   SER   9           HG       SER   9  13.204  17.185  12.422
  918    H    ILE  10           HN       ILE  10  14.616  16.393  14.465
  919    HA   ILE  10           HA       ILE  10  16.325  18.569  13.921
  920    HB   ILE  10           HB       ILE  10  15.003  17.611  16.454
  921   HG12  ILE  10          HG12      ILE  10  13.775  18.666  14.406
  922   HG13  ILE  10          HG11      ILE  10  13.423  19.299  16.015
  923   HG21  ILE  10          HG21      ILE  10  15.652  20.012  17.240
  924   HG22  ILE  10          HG22      ILE  10  16.898  19.921  15.997
  925   HG23  ILE  10          HG23      ILE  10  16.885  18.752  17.318
  926   HD11  ILE  10          HD11      ILE  10  14.742  21.231  15.677
  927   HD12  ILE  10          HD12      ILE  10  13.923  21.012  14.131
  928   HD13  ILE  10          HD13      ILE  10  15.605  20.515  14.315
  929    H    CYS  11           HN       CYS  11  16.770  15.619  15.848
  930    HA   CYS  11           HA       CYS  11  19.222  16.314  17.042
  931    HB2  CYS  11           HB2      CYS  11  18.017  13.647  16.289
  932    HB3  CYS  11           HB1      CYS  11  19.513  13.806  17.210
  933    HG   CYS  11           HG       CYS  11  18.128  14.187  19.218
  934    H    SER  12           HN       SER  12  18.559  14.458  14.034
  935    HA   SER  12           HA       SER  12  21.252  14.044  13.365
  936    HB2  SER  12           HB2      SER  12  20.413  13.580  11.116
  937    HB3  SER  12           HB1      SER  12  19.364  12.845  12.327
  938    HG   SER  12           HG       SER  12  17.841  14.307  11.917
  939    H    PHE  13           HN       PHE  13  19.012  16.676  12.562
  940    HA   PHE  13           HA       PHE  13  20.582  18.060  10.719
  941    HB2  PHE  13           HB2      PHE  13  18.316  18.682  12.488
  942    HB3  PHE  13           HB1      PHE  13  19.309  20.072  12.056
  943    HD1  PHE  13           HD1      PHE  13  18.116  16.970  10.304
  944    HD2  PHE  13           HD2      PHE  13  18.516  21.245  10.221
  945    HE1  PHE  13           HE1      PHE  13  17.069  17.025   8.056
  946    HE2  PHE  13           HE2      PHE  13  17.470  21.299   7.972
  947    HZ   PHE  13           HZ       PHE  13  16.748  19.189   6.890
  948    H    ILE  14           HN       ILE  14  20.387  18.543  14.262
  949    HA   ILE  14           HA       ILE  14  22.441  20.514  14.316
  950    HB   ILE  14           HB       ILE  14  22.365  20.213  16.750
  951   HG12  ILE  14          HG12      ILE  14  20.456  17.916  16.208
  952   HG13  ILE  14          HG11      ILE  14  22.152  17.678  16.619
  953   HG21  ILE  14          HG21      ILE  14  19.885  20.567  17.042
  954   HG22  ILE  14          HG22      ILE  14  19.675  20.119  15.349
  955   HG23  ILE  14          HG23      ILE  14  20.598  21.559  15.771
  956   HD11  ILE  14          HD11      ILE  14  21.792  18.940  18.727
  957   HD12  ILE  14          HD12      ILE  14  20.770  17.507  18.627
  958   HD13  ILE  14          HD13      ILE  14  20.084  19.101  18.316
  959    H    LEU  15           HN       LEU  15  22.450  17.024  14.285
  960    HA   LEU  15           HA       LEU  15  25.055  16.693  15.419
  961    HB2  LEU  15           HB2      LEU  15  23.073  15.004  13.988
  962    HB3  LEU  15           HB1      LEU  15  24.746  14.451  13.983
  963    HG   LEU  15           HG       LEU  15  23.419  15.332  16.542
  964   HD11  LEU  15          HD11      LEU  15  22.046  13.538  15.381
  965   HD12  LEU  15          HD12      LEU  15  22.685  13.075  16.957
  966   HD13  LEU  15          HD13      LEU  15  23.461  12.491  15.486
  967   HD21  LEU  15          HD21      LEU  15  25.835  15.062  16.582
  968   HD22  LEU  15          HD22      LEU  15  25.708  13.480  15.814
  969   HD23  LEU  15          HD23      LEU  15  25.109  13.714  17.455
  970    H    SER  16           HN       SER  16  23.920  16.249  12.033
  971    HA   SER  16           HA       SER  16  26.422  16.094  10.873
  972    HB2  SER  16           HB2      SER  16  25.286  16.764   8.781
  973    HB3  SER  16           HB1      SER  16  24.343  15.575   9.676
  974    HG   SER  16           HG       SER  16  22.956  17.135  10.300
  975    H    ALA  17           HN       ALA  17  24.590  18.890  11.925
  976    HA   ALA  17           HA       ALA  17  26.077  20.882  10.565
  977    HB1  ALA  17           HB1      ALA  17  25.102  22.426  12.189
  978    HB2  ALA  17           HB2      ALA  17  24.639  21.076  13.224
  979    HB3  ALA  17           HB3      ALA  17  23.878  21.277  11.646
  980    H    LEU  18           HN       LEU  18  26.366  19.552  13.868
  981    HA   LEU  18           HA       LEU  18  28.678  21.086  14.524
  982    HB2  LEU  18           HB2      LEU  18  27.466  18.607  15.752
  983    HB3  LEU  18           HB1      LEU  18  28.871  19.438  16.422
  984    HG   LEU  18           HG       LEU  18  26.264  20.862  15.843
  985   HD11  LEU  18          HD11      LEU  18  27.219  19.468  18.357
  986   HD12  LEU  18          HD12      LEU  18  25.715  19.189  17.478
  987   HD13  LEU  18          HD13      LEU  18  25.953  20.696  18.362
  988   HD21  LEU  18          HD21      LEU  18  28.776  21.496  17.414
  989   HD22  LEU  18          HD22      LEU  18  27.282  22.410  17.613
  990   HD23  LEU  18          HD23      LEU  18  28.099  22.390  16.050
  991    H    HIS  19           HN       HIS  19  28.150  18.071  12.881
  992    HA   HIS  19           HA       HIS  19  30.714  16.922  13.217
  993    HB2  HIS  19           HB2      HIS  19  29.044  15.454  12.461
  994    HB3  HIS  19           HB1      HIS  19  28.504  16.568  11.204
  995    HD2  HIS  19           HD2      HIS  19  31.597  14.165  11.857
  996    HE1  HIS  19           HE1      HIS  19  31.462  15.144   7.752
  997    HE2  HIS  19           HE2      HIS  19  32.638  13.729   9.502
  998    H    PHE  20           HN       PHE  20  29.319  18.877  10.566
  999    HA   PHE  20           HA       PHE  20  31.767  18.973   9.101
 1000    HB2  PHE  20           HB2      PHE  20  29.052  20.067   8.846
 1001    HB3  PHE  20           HB1      PHE  20  30.310  21.133   8.222
 1002    HD1  PHE  20           HD1      PHE  20  28.236  18.370   7.448
 1003    HD2  PHE  20           HD2      PHE  20  32.183  19.917   6.779
 1004    HE1  PHE  20           HE1      PHE  20  28.450  16.940   5.426
 1005    HE2  PHE  20           HE2      PHE  20  32.408  18.494   4.758
 1006    HZ   PHE  20           HZ       PHE  20  30.546  16.992   4.068
 1007    H    MET  21           HN       MET  21  30.358  20.839  11.691
 1008    HA   MET  21           HA       MET  21  31.852  23.210  11.398
 1009    HB2  MET  21           HB2      MET  21  30.395  21.850  13.609
 1010    HB3  MET  21           HB1      MET  21  31.539  23.117  14.055
 1011    HG2  MET  21           HG2      MET  21  30.419  24.658  12.454
 1012    HG3  MET  21           HG1      MET  21  29.246  23.394  12.087
 1013    HE1  MET  21           HE1      MET  21  28.972  26.650  13.857
 1014    HE2  MET  21           HE2      MET  21  27.320  26.062  14.032
 1015    HE3  MET  21           HE3      MET  21  28.199  25.766  12.535
 1016    H    ALA  22           HN       ALA  22  32.467  20.401  13.517
 1017    HA   ALA  22           HA       ALA  22  35.019  21.247  14.378
 1018    HB1  ALA  22           HB1      ALA  22  35.320  18.954  15.154
 1019    HB2  ALA  22           HB2      ALA  22  33.965  18.419  14.162
 1020    HB3  ALA  22           HB3      ALA  22  33.684  19.501  15.524
 1021    H    TRP  23           HN       TRP  23  33.951  19.242  11.663
 1022    HA   TRP  23           HA       TRP  23  36.474  18.376  10.789
 1023    HB2  TRP  23           HB2      TRP  23  33.766  18.418   9.767
 1024    HB3  TRP  23           HB1      TRP  23  34.924  18.776   8.485
 1025    HD1  TRP  23           HD1      TRP  23  34.521  16.189  11.347
 1026    HE1  TRP  23           HE1      TRP  23  35.434  13.928  10.504
 1027    HE3  TRP  23           HE3      TRP  23  36.149  17.565   6.703
 1028    HZ2  TRP  23           HZ2      TRP  23  36.686  12.848   8.173
 1029    HZ3  TRP  23           HZ3      TRP  23  37.195  15.899   5.193
 1030    HH2  TRP  23           HH2      TRP  23  37.465  13.545   5.922
 1031    H    THR  24           HN       THR  24  34.599  21.268   9.906
 1032    HA   THR  24           HA       THR  24  36.327  22.331   8.009
 1033    HB   THR  24           HB       THR  24  34.580  23.767  10.029
 1034    HG1  THR  24           HG1      THR  24  34.136  23.158   7.297
 1035   HG21  THR  24          HG21      THR  24  36.197  25.330   9.153
 1036   HG22  THR  24          HG22      THR  24  34.665  25.620   8.328
 1037   HG23  THR  24          HG23      THR  24  35.955  24.736   7.510
 1038    H    ILE  25           HN       ILE  25  36.296  22.749  11.534
 1039    HA   ILE  25           HA       ILE  25  38.508  24.522  11.650
 1040    HB   ILE  25           HB       ILE  25  37.460  22.579  13.726
 1041   HG12  ILE  25          HG12      ILE  25  37.015  25.567  13.467
 1042   HG13  ILE  25          HG11      ILE  25  35.893  24.373  12.815
 1043   HG21  ILE  25          HG21      ILE  25  39.773  23.306  14.203
 1044   HG22  ILE  25          HG22      ILE  25  38.641  24.055  15.331
 1045   HG23  ILE  25          HG23      ILE  25  39.291  24.987  13.983
 1046   HD11  ILE  25          HD11      ILE  25  35.795  23.355  15.136
 1047   HD12  ILE  25          HD12      ILE  25  35.079  24.961  14.996
 1048   HD13  ILE  25          HD13      ILE  25  36.680  24.767  15.710
 1049    H    GLY  26           HN       GLY  26  38.214  21.026  11.734
 1050    HA2  GLY  26           HA2      GLY  26  40.883  20.376  12.389
 1051    HA3  GLY  26           HA1      GLY  26  39.777  19.327  11.508
 1052    H    HIS  27           HN       HIS  27  39.312  20.740   9.216
 1053    HA   HIS  27           HA       HIS  27  41.586  20.182   7.645
 1054    HB2  HIS  27           HB2      HIS  27  38.886  21.126   7.221
 1055    HB3  HIS  27           HB1      HIS  27  40.021  22.023   6.213
 1056    HD2  HIS  27           HD2      HIS  27  41.763  20.211   4.620
 1057    HE1  HIS  27           HE1      HIS  27  38.918  17.091   4.696
 1058    HE2  HIS  27           HE2      HIS  27  41.043  17.925   3.583
 1059    H    LEU  28           HN       LEU  28  40.348  23.182   9.043
 1060    HA   LEU  28           HA       LEU  28  42.331  24.839   7.768
 1061    HB2  LEU  28           HB2      LEU  28  40.447  25.381  10.074
 1062    HB3  LEU  28           HB1      LEU  28  41.453  26.596   9.284
 1063    HG   LEU  28           HG       LEU  28  39.450  24.875   7.802
 1064   HD11  LEU  28          HD11      LEU  28  39.107  27.765   8.628
 1065   HD12  LEU  28          HD12      LEU  28  38.443  26.421   9.558
 1066   HD13  LEU  28          HD13      LEU  28  37.904  26.700   7.903
 1067   HD21  LEU  28          HD21      LEU  28  41.129  27.299   7.112
 1068   HD22  LEU  28          HD22      LEU  28  39.730  26.823   6.150
 1069   HD23  LEU  28          HD23      LEU  28  41.104  25.730   6.306
 1070    H    ASN  29           HN       ASN  29  42.163  22.898  10.617
 1071    HA   ASN  29           HA       ASN  29  44.161  24.253  12.145
 1072    HB2  ASN  29           HB2      ASN  29  43.044  22.905  13.581
 1073    HB3  ASN  29           HB1      ASN  29  42.636  21.736  12.327
 1074   HD21  ASN  29          HD21      ASN  29  44.052  19.934  12.019
 1075   HD22  ASN  29          HD22      ASN  29  45.404  19.648  13.005
 1076    H    GLN  30           HN       GLN  30  44.188  21.559   9.856
 1077    HA   GLN  30           HA       GLN  30  46.853  20.745  10.232
 1078    HB2  GLN  30           HB2      GLN  30  45.119  19.480   8.948
 1079    HB3  GLN  30           HB1      GLN  30  45.274  20.663   7.649
 1080    HG2  GLN  30           HG2      GLN  30  47.331  19.888   7.003
 1081    HG3  GLN  30           HG1      GLN  30  47.805  19.468   8.647
 1082   HE21  GLN  30          HE21      GLN  30  45.267  18.404   6.291
 1083   HE22  GLN  30          HE22      GLN  30  45.482  16.750   6.601
 1084    H    ILE  31           HN       ILE  31  45.436  23.229   8.157
 1085    HA   ILE  31           HA       ILE  31  48.110  24.396   7.814
 1086    HB   ILE  31           HB       ILE  31  47.893  23.201   5.775
 1087   HG12  ILE  31          HG12      ILE  31  46.768  25.918   5.083
 1088   HG13  ILE  31          HG11      ILE  31  48.411  25.723   5.689
 1089   HG21  ILE  31          HG21      ILE  31  45.414  22.731   6.052
 1090   HG22  ILE  31          HG22      ILE  31  45.902  23.146   4.410
 1091   HG23  ILE  31          HG23      ILE  31  45.105  24.351   5.421
 1092   HD11  ILE  31          HD11      ILE  31  48.991  24.275   3.839
 1093   HD12  ILE  31          HD12      ILE  31  48.249  25.731   3.177
 1094   HD13  ILE  31          HD13      ILE  31  47.317  24.238   3.287
 1095    H    LYS  32           HN       LYS  32  47.687  26.159   9.078
 1096    HA   LYS  32           HA       LYS  32  45.304  27.765   8.418
 1097    HB2  LYS  32           HB2      LYS  32  45.789  27.028  10.814
 1098    HB3  LYS  32           HB1      LYS  32  47.138  28.163  10.777
 1099    HG2  LYS  32           HG2      LYS  32  45.524  29.967  10.108
 1100    HG3  LYS  32           HG1      LYS  32  44.210  28.813  10.343
 1101    HD2  LYS  32           HD2      LYS  32  46.226  29.463  12.504
 1102    HD3  LYS  32           HD1      LYS  32  44.695  30.322  12.333
 1103    HE2  LYS  32           HE2      LYS  32  43.481  28.168  12.528
 1104    HE3  LYS  32           HE1      LYS  32  45.018  27.335  12.750
 1105    HZ1  LYS  32           HZ1      LYS  32  45.274  28.154  14.830
 1106    HZ2  LYS  32           HZ2      LYS  32  43.577  28.196  14.774
 1107    HZ3  LYS  32           HZ3      LYS  32  44.474  29.611  14.494
 1108    H    ARG  33           HN       ARG  33  48.818  27.899   8.717
 1109    HA   ARG  33           HA       ARG  33  48.915  30.696   7.941
 1110    HB2  ARG  33           HB2      ARG  33  51.283  30.524   8.239
 1111    HB3  ARG  33           HB1      ARG  33  50.540  29.616   9.553
 1112    HG2  ARG  33           HG2      ARG  33  50.835  27.522   8.222
 1113    HG3  ARG  33           HG1      ARG  33  51.692  28.458   6.998
 1114    HD2  ARG  33           HD2      ARG  33  53.338  29.157   8.722
 1115    HD3  ARG  33           HD1      ARG  33  52.505  28.142   9.900
 1116    HE   ARG  33           HE       ARG  33  54.254  27.247   7.772
 1117   HH11  ARG  33          HH11      ARG  33  51.646  26.405   9.937
 1118   HH12  ARG  33          HH12      ARG  33  51.992  24.705   9.880
 1119   HH21  ARG  33          HH21      ARG  33  54.671  25.022   7.713
 1120   HH22  ARG  33          HH22      ARG  33  53.686  23.932   8.629
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1  -2.223  10.271   0.928
    2    H2   MET   1           HT2      MET   1  -1.351  11.693   1.256
    3    H3   MET   1           HT3      MET   1  -0.665  10.176   1.591
    4    HA   MET   1           HA       MET   1  -1.002   9.752  -0.921
    5    HB2  MET   1           HB2      MET   1  -2.079  12.273  -0.756
    6    HB3  MET   1           HB1      MET   1  -0.427  12.624  -1.264
    7    HG2  MET   1           HG2      MET   1  -0.652  11.486  -3.271
    8    HG3  MET   1           HG1      MET   1  -1.906  10.415  -2.649
    9    HE1  MET   1           HE1      MET   1  -2.116  14.674  -2.533
   10    HE2  MET   1           HE2      MET   1  -1.991  14.565  -4.286
   11    HE3  MET   1           HE3      MET   1  -0.771  13.800  -3.276
   12    H    PHE   2           HN       PHE   2   0.769  12.517   0.494
   13    HA   PHE   2           HA       PHE   2   3.282  11.045  -0.031
   14    HB2  PHE   2           HB2      PHE   2   2.752  14.020  -0.171
   15    HB3  PHE   2           HB1      PHE   2   4.349  13.281  -0.295
   16    HD1  PHE   2           HD1      PHE   2   1.167  13.900  -1.987
   17    HD2  PHE   2           HD2      PHE   2   4.907  11.798  -2.206
   18    HE1  PHE   2           HE1      PHE   2   0.788  13.474  -4.401
   19    HE2  PHE   2           HE2      PHE   2   4.526  11.373  -4.620
   20    HZ   PHE   2           HZ       PHE   2   2.467  12.211  -5.717
   21    H    GLU   3           HN       GLU   3   4.623  10.754   1.653
   22    HA   GLU   3           HA       GLU   3   3.786  11.824   4.228
   23    HB2  GLU   3           HB2      GLU   3   5.696   9.625   3.458
   24    HB3  GLU   3           HB1      GLU   3   5.497  10.178   5.121
   25    HG2  GLU   3           HG2      GLU   3   3.154   9.319   3.417
   26    HG3  GLU   3           HG1      GLU   3   4.065   8.175   4.401
   27    HA   PRO   4           HA       PRO   4   7.040  14.803   4.332
   28    HB2  PRO   4           HB2      PRO   4   7.414  15.006   7.038
   29    HB3  PRO   4           HB1      PRO   4   6.024  15.704   6.187
   30    HG2  PRO   4           HG2      PRO   4   6.212  13.188   7.766
   31    HG3  PRO   4           HG1      PRO   4   4.897  14.373   7.678
   32    HD2  PRO   4           HD2      PRO   4   4.847  11.993   6.335
   33    HD3  PRO   4           HD1      PRO   4   4.013  13.453   5.759
   34    H    PHE   5           HN       PHE   5   7.447  11.654   5.701
   35    HA   PHE   5           HA       PHE   5  10.064  11.763   6.667
   36    HB2  PHE   5           HB2      PHE   5   9.859   9.518   6.887
   37    HB3  PHE   5           HB1      PHE   5   8.182   9.804   6.420
   38    HD1  PHE   5           HD1      PHE   5  11.366   8.367   5.442
   39    HD2  PHE   5           HD2      PHE   5   7.519   9.601   3.999
   40    HE1  PHE   5           HE1      PHE   5  11.707   7.026   3.384
   41    HE2  PHE   5           HE2      PHE   5   7.856   8.258   1.941
   42    HZ   PHE   5           HZ       PHE   5   9.952   6.970   1.634
   43    H    GLN   6           HN       GLN   6   8.878  12.003   3.446
   44    HA   GLN   6           HA       GLN   6  11.163  11.035   2.054
   45    HB2  GLN   6           HB2      GLN   6   8.779  12.695   1.382
   46    HB3  GLN   6           HB1      GLN   6  10.154  12.734   0.275
   47    HG2  GLN   6           HG2      GLN   6  10.102  10.170   0.382
   48    HG3  GLN   6           HG1      GLN   6   8.517  10.349   1.129
   49   HE21  GLN   6          HE21      GLN   6   8.258   9.059  -1.178
   50   HE22  GLN   6          HE22      GLN   6   7.768  10.068  -2.452
   51    H    ILE   7           HN       ILE   7  10.351  14.093   3.542
   52    HA   ILE   7           HA       ILE   7  12.302  15.695   2.250
   53    HB   ILE   7           HB       ILE   7  11.060  16.008   4.997
   54   HG12  ILE   7          HG12      ILE   7  10.287  17.340   2.387
   55   HG13  ILE   7          HG11      ILE   7   9.503  15.875   2.978
   56   HG21  ILE   7          HG21      ILE   7  11.669  18.391   4.698
   57   HG22  ILE   7          HG22      ILE   7  12.468  17.988   3.178
   58   HG23  ILE   7          HG23      ILE   7  13.099  17.360   4.699
   59   HD11  ILE   7          HD11      ILE   7   9.126  17.183   5.176
   60   HD12  ILE   7          HD12      ILE   7   8.136  17.625   3.787
   61   HD13  ILE   7          HD13      ILE   7   9.522  18.619   4.229
   62    H    LEU   8           HN       LEU   8  12.327  13.870   5.291
   63    HA   LEU   8           HA       LEU   8  14.985  14.631   6.006
   64    HB2  LEU   8           HB2      LEU   8  13.384  13.895   7.700
   65    HB3  LEU   8           HB1      LEU   8  13.301  12.302   6.949
   66    HG   LEU   8           HG       LEU   8  16.054  13.119   7.481
   67   HD11  LEU   8          HD11      LEU   8  15.945  12.969   9.918
   68   HD12  LEU   8          HD12      LEU   8  14.194  12.759   9.852
   69   HD13  LEU   8          HD13      LEU   8  14.919  14.292   9.369
   70   HD21  LEU   8          HD21      LEU   8  14.282  10.777   8.246
   71   HD22  LEU   8          HD22      LEU   8  16.002  10.863   8.632
   72   HD23  LEU   8          HD23      LEU   8  15.477  10.831   6.949
   73    H    SER   9           HN       SER   9  13.596  12.074   4.092
   74    HA   SER   9           HA       SER   9  15.890  10.376   4.077
   75    HB2  SER   9           HB2      SER   9  14.760   9.199   2.274
   76    HB3  SER   9           HB1      SER   9  13.589   9.603   3.526
   77    HG   SER   9           HG       SER   9  13.669  10.355   0.938
   78    H    ILE  10           HN       ILE  10  14.636  12.822   1.823
   79    HA   ILE  10           HA       ILE  10  16.790  12.498  -0.041
   80    HB   ILE  10           HB       ILE  10  14.380  13.472  -0.393
   81   HG12  ILE  10          HG12      ILE  10  16.633  14.997  -1.701
   82   HG13  ILE  10          HG11      ILE  10  16.411  13.274  -2.011
   83   HG21  ILE  10          HG21      ILE  10  14.197  15.846  -0.186
   84   HG22  ILE  10          HG22      ILE  10  15.919  16.023   0.150
   85   HG23  ILE  10          HG23      ILE  10  14.858  15.285   1.343
   86   HD11  ILE  10          HD11      ILE  10  14.254  13.609  -2.946
   87   HD12  ILE  10          HD12      ILE  10  15.240  14.904  -3.625
   88   HD13  ILE  10          HD13      ILE  10  14.134  15.244  -2.295
   89    H    CYS  11           HN       CYS  11  16.215  14.453   2.793
   90    HA   CYS  11           HA       CYS  11  18.228  16.405   2.305
   91    HB2  CYS  11           HB2      CYS  11  16.439  16.817   3.910
   92    HB3  CYS  11           HB1      CYS  11  16.978  15.458   4.895
   93    HG   CYS  11           HG       CYS  11  19.359  17.030   4.849
   94    H    SER  12           HN       SER  12  18.168  13.528   4.419
   95    HA   SER  12           HA       SER  12  20.912  13.699   5.132
   96    HB2  SER  12           HB2      SER  12  18.939  11.417   5.245
   97    HB3  SER  12           HB1      SER  12  20.578  11.321   5.887
   98    HG   SER  12           HG       SER  12  18.354  12.643   6.841
   99    H    PHE  13           HN       PHE  13  19.162  12.017   2.578
  100    HA   PHE  13           HA       PHE  13  21.221  10.352   1.659
  101    HB2  PHE  13           HB2      PHE  13  19.047   9.951   0.808
  102    HB3  PHE  13           HB1      PHE  13  18.859  11.623   0.278
  103    HD1  PHE  13           HD1      PHE  13  21.008   8.601  -0.265
  104    HD2  PHE  13           HD2      PHE  13  19.390  12.217  -1.926
  105    HE1  PHE  13           HE1      PHE  13  21.959   8.011  -2.478
  106    HE2  PHE  13           HE2      PHE  13  20.341  11.628  -4.138
  107    HZ   PHE  13           HZ       PHE  13  21.626   9.524  -4.415
  108    H    ILE  14           HN       ILE  14  20.325  13.658   0.683
  109    HA   ILE  14           HA       ILE  14  22.322  13.964  -1.286
  110    HB   ILE  14           HB       ILE  14  20.818  15.965   0.400
  111   HG12  ILE  14          HG12      ILE  14  20.633  15.382  -2.561
  112   HG13  ILE  14          HG11      ILE  14  19.658  14.521  -1.372
  113   HG21  ILE  14          HG21      ILE  14  22.834  16.381  -1.819
  114   HG22  ILE  14          HG22      ILE  14  22.861  17.066  -0.194
  115   HG23  ILE  14          HG23      ILE  14  21.654  17.609  -1.357
  116   HD11  ILE  14          HD11      ILE  14  19.733  17.540  -1.628
  117   HD12  ILE  14          HD12      ILE  14  18.645  16.589  -0.618
  118   HD13  ILE  14          HD13      ILE  14  18.502  16.520  -2.375
  119    H    LEU  15           HN       LEU  15  22.263  14.828   2.159
  120    HA   LEU  15           HA       LEU  15  24.808  16.038   2.266
  121    HB2  LEU  15           HB2      LEU  15  22.805  15.108   4.154
  122    HB3  LEU  15           HB1      LEU  15  24.441  14.818   4.745
  123    HG   LEU  15           HG       LEU  15  24.921  17.252   3.999
  124   HD11  LEU  15          HD11      LEU  15  22.824  17.512   2.704
  125   HD12  LEU  15          HD12      LEU  15  22.948  18.717   3.985
  126   HD13  LEU  15          HD13      LEU  15  21.894  17.317   4.189
  127   HD21  LEU  15          HD21      LEU  15  24.832  16.588   6.345
  128   HD22  LEU  15          HD22      LEU  15  23.068  16.619   6.317
  129   HD23  LEU  15          HD23      LEU  15  23.979  18.120   6.150
  130    H    SER  16           HN       SER  16  23.904  12.741   3.298
  131    HA   SER  16           HA       SER  16  26.386  11.715   3.838
  132    HB2  SER  16           HB2      SER  16  24.360  10.424   4.218
  133    HB3  SER  16           HB1      SER  16  24.058  10.327   2.485
  134    HG   SER  16           HG       SER  16  25.718   8.959   2.259
  135    H    ALA  17           HN       ALA  17  24.849  12.148   0.681
  136    HA   ALA  17           HA       ALA  17  26.786  10.763  -0.853
  137    HB1  ALA  17           HB1      ALA  17  24.717  12.848  -1.452
  138    HB2  ALA  17           HB2      ALA  17  24.810  11.180  -2.010
  139    HB3  ALA  17           HB3      ALA  17  25.892  12.397  -2.686
  140    H    LEU  18           HN       LEU  18  26.460  14.182   0.044
  141    HA   LEU  18           HA       LEU  18  28.793  15.051  -1.355
  142    HB2  LEU  18           HB2      LEU  18  27.271  16.284   0.960
  143    HB3  LEU  18           HB1      LEU  18  28.560  17.091   0.066
  144    HG   LEU  18           HG       LEU  18  26.170  15.924  -1.352
  145   HD11  LEU  18          HD11      LEU  18  25.264  18.278  -1.331
  146   HD12  LEU  18          HD12      LEU  18  26.484  18.677  -0.120
  147   HD13  LEU  18          HD13      LEU  18  25.237  17.485   0.242
  148   HD21  LEU  18          HD21      LEU  18  28.129  16.492  -2.716
  149   HD22  LEU  18          HD22      LEU  18  28.176  18.107  -2.009
  150   HD23  LEU  18          HD23      LEU  18  26.826  17.634  -3.040
  151    H    HIS  19           HN       HIS  19  28.235  13.544   1.730
  152    HA   HIS  19           HA       HIS  19  30.620  14.369   3.029
  153    HB2  HIS  19           HB2      HIS  19  28.718  13.476   4.281
  154    HB3  HIS  19           HB1      HIS  19  28.900  11.921   3.469
  155    HD2  HIS  19           HD2      HIS  19  30.472  10.196   4.930
  156    HE1  HIS  19           HE1      HIS  19  32.694  13.067   7.084
  157    HE2  HIS  19           HE2      HIS  19  32.307  10.581   6.749
  158    H    PHE  20           HN       PHE  20  29.737  11.433   1.215
  159    HA   PHE  20           HA       PHE  20  32.339  10.249   1.455
  160    HB2  PHE  20           HB2      PHE  20  29.774   9.556   0.304
  161    HB3  PHE  20           HB1      PHE  20  31.094   9.146  -0.791
  162    HD1  PHE  20           HD1      PHE  20  29.981   8.812   2.763
  163    HD2  PHE  20           HD2      PHE  20  32.443   7.256  -0.394
  164    HE1  PHE  20           HE1      PHE  20  30.544   6.850   4.170
  165    HE2  PHE  20           HE2      PHE  20  33.005   5.293   1.014
  166    HZ   PHE  20           HZ       PHE  20  32.065   5.088   3.305
  167    H    MET  21           HN       MET  21  30.806  12.457  -0.780
  168    HA   MET  21           HA       MET  21  32.563  12.179  -2.975
  169    HB2  MET  21           HB2      MET  21  30.405  13.447  -2.994
  170    HB3  MET  21           HB1      MET  21  31.179  14.709  -2.033
  171    HG2  MET  21           HG2      MET  21  31.419  15.464  -4.264
  172    HG3  MET  21           HG1      MET  21  32.982  14.742  -3.900
  173    HE1  MET  21           HE1      MET  21  29.409  12.857  -5.811
  174    HE2  MET  21           HE2      MET  21  29.912  14.273  -6.725
  175    HE3  MET  21           HE3      MET  21  29.577  14.419  -5.005
  176    H    ALA  22           HN       ALA  22  32.590  14.608  -0.345
  177    HA   ALA  22           HA       ALA  22  35.078  15.759  -1.042
  178    HB1  ALA  22           HB1      ALA  22  33.829  15.610   1.710
  179    HB2  ALA  22           HB2      ALA  22  33.402  16.801   0.480
  180    HB3  ALA  22           HB3      ALA  22  35.031  16.778   1.158
  181    H    TRP  23           HN       TRP  23  34.219  13.087   1.120
  182    HA   TRP  23           HA       TRP  23  36.747  12.684   2.288
  183    HB2  TRP  23           HB2      TRP  23  34.225  11.370   2.263
  184    HB3  TRP  23           HB1      TRP  23  35.458  10.166   1.893
  185    HD1  TRP  23           HD1      TRP  23  34.264  12.501   4.636
  186    HE1  TRP  23           HE1      TRP  23  35.514  11.942   6.821
  187    HE3  TRP  23           HE3      TRP  23  37.726   9.195   2.855
  188    HZ2  TRP  23           HZ2      TRP  23  37.693  10.310   7.697
  189    HZ3  TRP  23           HZ3      TRP  23  39.374   8.149   4.379
  190    HH2  TRP  23           HH2      TRP  23  39.363   8.706   6.801
  191    H    THR  24           HN       THR  24  35.297  11.209  -0.613
  192    HA   THR  24           HA       THR  24  37.364   9.501  -1.319
  193    HB   THR  24           HB       THR  24  35.519  11.093  -3.118
  194    HG1  THR  24           HG1      THR  24  34.207   9.764  -2.129
  195   HG21  THR  24          HG21      THR  24  37.370   8.765  -3.656
  196   HG22  THR  24          HG22      THR  24  37.344  10.333  -4.463
  197   HG23  THR  24          HG23      THR  24  36.028   9.186  -4.720
  198    H    ILE  25           HN       ILE  25  36.883  12.910  -2.259
  199    HA   ILE  25           HA       ILE  25  39.278  13.111  -3.779
  200    HB   ILE  25           HB       ILE  25  37.373  15.060  -2.550
  201   HG12  ILE  25          HG12      ILE  25  37.997  15.659  -5.225
  202   HG13  ILE  25          HG11      ILE  25  37.949  13.899  -5.150
  203   HG21  ILE  25          HG21      ILE  25  40.130  15.667  -3.633
  204   HG22  ILE  25          HG22      ILE  25  39.433  16.176  -2.094
  205   HG23  ILE  25          HG23      ILE  25  38.841  16.871  -3.601
  206   HD11  ILE  25          HD11      ILE  25  35.721  13.870  -4.378
  207   HD12  ILE  25          HD12      ILE  25  35.725  15.139  -5.602
  208   HD13  ILE  25          HD13      ILE  25  35.769  15.566  -3.893
  209    H    GLY  26           HN       GLY  26  38.539  13.653  -0.389
  210    HA2  GLY  26           HA2      GLY  26  40.957  14.883   0.385
  211    HA3  GLY  26           HA1      GLY  26  39.897  13.969   1.455
  212    H    HIS  27           HN       HIS  27  39.992  11.450   0.447
  213    HA   HIS  27           HA       HIS  27  42.423  10.437   1.438
  214    HB2  HIS  27           HB2      HIS  27  40.242   9.191   1.320
  215    HB3  HIS  27           HB1      HIS  27  40.510   9.008  -0.415
  216    HD2  HIS  27           HD2      HIS  27  42.393   7.939   2.927
  217    HE1  HIS  27           HE1      HIS  27  43.497   5.312  -0.188
  218    HE2  HIS  27           HE2      HIS  27  43.745   5.797   2.292
  219    H    LEU  28           HN       LEU  28  41.305  11.133  -1.835
  220    HA   LEU  28           HA       LEU  28  43.608   9.984  -3.111
  221    HB2  LEU  28           HB2      LEU  28  41.204  11.511  -3.956
  222    HB3  LEU  28           HB1      LEU  28  42.616  11.615  -5.009
  223    HG   LEU  28           HG       LEU  28  41.015   9.713  -5.537
  224   HD11  LEU  28          HD11      LEU  28  43.760   8.724  -4.734
  225   HD12  LEU  28          HD12      LEU  28  43.529   9.826  -6.091
  226   HD13  LEU  28          HD13      LEU  28  42.782   8.231  -6.111
  227   HD21  LEU  28          HD21      LEU  28  42.236   8.416  -3.086
  228   HD22  LEU  28          HD22      LEU  28  40.911   7.828  -4.080
  229   HD23  LEU  28          HD23      LEU  28  40.672   9.223  -3.035
  230    H    ASN  29           HN       ASN  29  43.019  12.888  -1.451
  231    HA   ASN  29           HA       ASN  29  44.234  14.801  -1.156
  232    HB2  ASN  29           HB2      ASN  29  46.439  13.045  -2.258
  233    HB3  ASN  29           HB1      ASN  29  46.683  14.594  -1.451
  234   HD21  ASN  29          HD21      ASN  29  47.152  11.512  -0.744
  235   HD22  ASN  29          HD22      ASN  29  46.628  11.445   0.870
  236    H    GLN  30           HN       GLN  30  42.786  14.471  -3.629
  237    HA   GLN  30           HA       GLN  30  44.306  15.269  -5.879
  238    HB2  GLN  30           HB2      GLN  30  41.955  14.356  -5.911
  239    HB3  GLN  30           HB1      GLN  30  41.404  15.935  -5.348
  240    HG2  GLN  30           HG2      GLN  30  41.228  15.832  -7.784
  241    HG3  GLN  30           HG1      GLN  30  42.480  16.986  -7.330
  242   HE21  GLN  30          HE21      GLN  30  44.042  16.779  -8.964
  243   HE22  GLN  30          HE22      GLN  30  44.729  15.304  -9.448
  244    H    ILE  31           HN       ILE  31  42.669  17.107  -3.347
  245    HA   ILE  31           HA       ILE  31  43.257  19.658  -4.578
  246    HB   ILE  31           HB       ILE  31  41.248  19.160  -3.093
  247   HG12  ILE  31          HG12      ILE  31  42.969  21.454  -2.122
  248   HG13  ILE  31          HG11      ILE  31  42.182  21.463  -3.701
  249   HG21  ILE  31          HG21      ILE  31  41.529  19.064  -0.743
  250   HG22  ILE  31          HG22      ILE  31  43.203  19.613  -0.831
  251   HG23  ILE  31          HG23      ILE  31  42.777  17.988  -1.367
  252   HD11  ILE  31          HD11      ILE  31  40.740  22.602  -2.105
  253   HD12  ILE  31          HD12      ILE  31  40.819  21.228  -1.004
  254   HD13  ILE  31          HD13      ILE  31  39.992  21.069  -2.553
  255    H    LYS  32           HN       LYS  32  44.741  17.524  -2.269
  256    HA   LYS  32           HA       LYS  32  46.616  19.578  -1.369
  257    HB2  LYS  32           HB2      LYS  32  46.332  16.664  -0.602
  258    HB3  LYS  32           HB1      LYS  32  47.462  17.802   0.131
  259    HG2  LYS  32           HG2      LYS  32  45.370  19.268   0.581
  260    HG3  LYS  32           HG1      LYS  32  44.450  17.797   0.263
  261    HD2  LYS  32           HD2      LYS  32  44.797  17.789   2.612
  262    HD3  LYS  32           HD1      LYS  32  46.000  16.664   1.979
  263    HE2  LYS  32           HE2      LYS  32  47.749  18.292   2.152
  264    HE3  LYS  32           HE1      LYS  32  46.597  19.590   2.468
  265    HZ1  LYS  32           HZ1      LYS  32  47.153  17.267   4.234
  266    HZ2  LYS  32           HZ2      LYS  32  45.980  18.459   4.530
  267    HZ3  LYS  32           HZ3      LYS  32  47.628  18.872   4.509
  268    H    ARG  33           HN       ARG  33  46.368  17.607  -4.001
  269    HA   ARG  33           HA       ARG  33  49.169  17.888  -4.619
  270    HB2  ARG  33           HB2      ARG  33  48.583  15.599  -3.309
  271    HB3  ARG  33           HB1      ARG  33  48.231  15.096  -4.961
  272    HG2  ARG  33           HG2      ARG  33  50.621  16.524  -5.185
  273    HG3  ARG  33           HG1      ARG  33  50.810  15.599  -3.695
  274    HD2  ARG  33           HD2      ARG  33  50.566  13.548  -4.786
  275    HD3  ARG  33           HD1      ARG  33  49.723  14.265  -6.156
  276    HE   ARG  33           HE       ARG  33  52.305  15.339  -6.121
  277   HH11  ARG  33          HH11      ARG  33  50.721  12.266  -6.481
  278   HH12  ARG  33          HH12      ARG  33  51.945  11.612  -7.501
  279   HH21  ARG  33          HH21      ARG  33  53.911  14.467  -7.467
  280   HH22  ARG  33          HH22      ARG  33  53.749  12.847  -8.063
  281    H1   MET   1           HT1      MET   1  -0.152  -3.049   7.233
  282    H2   MET   1           HT2      MET   1   0.759  -2.480   5.916
  283    H3   MET   1           HT3      MET   1   1.270  -2.166   7.507
  284    HA   MET   1           HA       MET   1   1.302  -4.728   7.727
  285    HB2  MET   1           HB2      MET   1   0.406  -4.522   5.137
  286    HB3  MET   1           HB1      MET   1   2.141  -4.745   4.899
  287    HG2  MET   1           HG2      MET   1   2.149  -6.846   5.875
  288    HG3  MET   1           HG1      MET   1   0.732  -6.513   6.869
  289    HE1  MET   1           HE1      MET   1   0.839  -6.088   2.623
  290    HE2  MET   1           HE2      MET   1   1.240  -7.803   2.631
  291    HE3  MET   1           HE3      MET   1   2.214  -6.677   3.566
  292    H    PHE   2           HN       PHE   2   3.033  -2.846   5.229
  293    HA   PHE   2           HA       PHE   2   5.477  -3.095   6.879
  294    HB2  PHE   2           HB2      PHE   2   5.204  -3.078   3.866
  295    HB3  PHE   2           HB1      PHE   2   6.741  -3.011   4.731
  296    HD1  PHE   2           HD1      PHE   2   3.930  -5.121   3.725
  297    HD2  PHE   2           HD2      PHE   2   7.484  -4.924   6.129
  298    HE1  PHE   2           HE1      PHE   2   3.912  -7.590   3.954
  299    HE2  PHE   2           HE2      PHE   2   7.467  -7.392   6.358
  300    HZ   PHE   2           HZ       PHE   2   5.681  -8.726   5.271
  301    H    GLU   3           HN       GLU   3   6.520  -1.256   7.387
  302    HA   GLU   3           HA       GLU   3   5.365   1.239   6.425
  303    HB2  GLU   3           HB2      GLU   3   7.196   0.595   8.728
  304    HB3  GLU   3           HB1      GLU   3   6.780   2.249   8.272
  305    HG2  GLU   3           HG2      GLU   3   4.675   0.148   8.802
  306    HG3  GLU   3           HG1      GLU   3   5.329   1.163  10.087
  307    HA   PRO   4           HA       PRO   4   8.781   2.074   3.762
  308    HB2  PRO   4           HB2      PRO   4   8.742   4.811   3.764
  309    HB3  PRO   4           HB1      PRO   4   7.549   3.818   2.905
  310    HG2  PRO   4           HG2      PRO   4   7.320   5.199   5.533
  311    HG3  PRO   4           HG1      PRO   4   6.121   5.027   4.237
  312    HD2  PRO   4           HD2      PRO   4   6.089   3.490   6.496
  313    HD3  PRO   4           HD1      PRO   4   5.475   2.920   4.927
  314    H    PHE   5           HN       PHE   5   8.723   3.244   7.016
  315    HA   PHE   5           HA       PHE   5  11.157   4.598   7.203
  316    HB2  PHE   5           HB2      PHE   5  10.749   4.604   9.431
  317    HB3  PHE   5           HB1      PHE   5   9.194   3.913   8.968
  318    HD1  PHE   5           HD1      PHE   5  12.376   3.313  10.604
  319    HD2  PHE   5           HD2      PHE   5   8.902   1.413   8.955
  320    HE1  PHE   5           HE1      PHE   5  12.935   1.233  11.830
  321    HE2  PHE   5           HE2      PHE   5   9.455  -0.672  10.181
  322    HZ   PHE   5           HZ       PHE   5  11.474  -0.763  11.622
  323    H    GLN   6           HN       GLN   6  10.513   1.259   6.657
  324    HA   GLN   6           HA       GLN   6  12.909   0.159   7.726
  325    HB2  GLN   6           HB2      GLN   6  10.793  -0.733   5.822
  326    HB3  GLN   6           HB1      GLN   6  12.325  -1.611   5.825
  327    HG2  GLN   6           HG2      GLN   6  12.065  -1.719   8.378
  328    HG3  GLN   6           HG1      GLN   6  10.399  -1.214   8.111
  329   HE21  GLN   6          HE21      GLN   6  10.400  -3.624   9.213
  330   HE22  GLN   6          HE22      GLN   6  10.206  -4.875   8.082
  331    H    ILE   7           HN       ILE   7  12.111   1.752   4.714
  332    HA   ILE   7           HA       ILE   7  14.353   0.896   3.205
  333    HB   ILE   7           HB       ILE   7  12.721   3.438   2.970
  334   HG12  ILE   7          HG12      ILE   7  12.479   0.855   1.402
  335   HG13  ILE   7          HG11      ILE   7  11.501   1.197   2.827
  336   HG21  ILE   7          HG21      ILE   7  13.552   3.429   0.636
  337   HG22  ILE   7          HG22      ILE   7  14.549   2.022   1.003
  338   HG23  ILE   7          HG23      ILE   7  14.880   3.566   1.787
  339   HD11  ILE   7          HD11      ILE   7  10.889   3.415   1.636
  340   HD12  ILE   7          HD12      ILE   7  10.156   1.931   1.031
  341   HD13  ILE   7          HD13      ILE   7  11.525   2.645   0.182
  342    H    LEU   8           HN       LEU   8  13.765   3.765   5.214
  343    HA   LEU   8           HA       LEU   8  16.328   4.925   4.737
  344    HB2  LEU   8           HB2      LEU   8  14.429   6.292   5.447
  345    HB3  LEU   8           HB1      LEU   8  14.348   5.412   6.973
  346    HG   LEU   8           HG       LEU   8  17.034   6.417   6.432
  347   HD11  LEU   8          HD11      LEU   8  16.534   8.790   6.734
  348   HD12  LEU   8          HD12      LEU   8  14.805   8.444   6.788
  349   HD13  LEU   8          HD13      LEU   8  15.708   8.198   5.293
  350   HD21  LEU   8          HD21      LEU   8  14.997   6.713   8.659
  351   HD22  LEU   8          HD22      LEU   8  16.632   7.370   8.746
  352   HD23  LEU   8          HD23      LEU   8  16.387   5.627   8.621
  353    H    SER   9           HN       SER   9  15.064   2.625   7.032
  354    HA   SER   9           HA       SER   9  17.198   2.816   8.916
  355    HB2  SER   9           HB2      SER   9  16.281   0.770   9.860
  356    HB3  SER   9           HB1      SER   9  14.963   1.862   9.448
  357    HG   SER   9           HG       SER   9  15.508  -0.611   8.517
  358    H    ILE  10           HN       ILE  10  16.503   0.599   6.227
  359    HA   ILE  10           HA       ILE  10  18.892  -0.938   6.613
  360    HB   ILE  10           HB       ILE  10  16.649  -1.569   5.407
  361   HG12  ILE  10          HG12      ILE  10  19.185  -2.396   3.995
  362   HG13  ILE  10          HG11      ILE  10  18.894  -2.870   5.669
  363   HG21  ILE  10          HG21      ILE  10  16.612  -1.194   3.048
  364   HG22  ILE  10          HG22      ILE  10  18.272  -0.601   3.042
  365   HG23  ILE  10          HG23      ILE  10  16.993   0.364   3.766
  366   HD11  ILE  10          HD11      ILE  10  16.943  -4.094   5.099
  367   HD12  ILE  10          HD12      ILE  10  18.110  -4.509   3.842
  368   HD13  ILE  10          HD13      ILE  10  16.833  -3.340   3.507
  369    H    CYS  11           HN       CYS  11  18.034   1.929   4.812
  370    HA   CYS  11           HA       CYS  11  20.244   1.900   3.014
  371    HB2  CYS  11           HB2      CYS  11  18.260   3.239   2.548
  372    HB3  CYS  11           HB1      CYS  11  18.530   4.190   4.009
  373    HG   CYS  11           HG       CYS  11  21.004   4.618   2.645
  374    H    SER  12           HN       SER  12  19.629   3.749   6.011
  375    HA   SER  12           HA       SER  12  22.230   4.882   6.126
  376    HB2  SER  12           HB2      SER  12  20.102   4.503   8.235
  377    HB3  SER  12           HB1      SER  12  21.601   5.385   8.509
  378    HG   SER  12           HG       SER  12  19.351   6.085   7.086
  379    H    PHE  13           HN       PHE  13  20.782   1.965   7.473
  380    HA   PHE  13           HA       PHE  13  22.828   1.234   9.244
  381    HB2  PHE  13           HB2      PHE  13  20.791   0.034   9.393
  382    HB3  PHE  13           HB1      PHE  13  20.818  -0.381   7.679
  383    HD1  PHE  13           HD1      PHE  13  22.788  -0.835  10.835
  384    HD2  PHE  13           HD2      PHE  13  21.734  -2.423   6.985
  385    HE1  PHE  13           HE1      PHE  13  24.029  -2.917  11.353
  386    HE2  PHE  13           HE2      PHE  13  22.975  -4.506   7.504
  387    HZ   PHE  13           HZ       PHE  13  24.123  -4.753   9.690
  388    H    ILE  14           HN       ILE  14  22.349   0.405   5.810
  389    HA   ILE  14           HA       ILE  14  24.646  -1.212   5.547
  390    HB   ILE  14           HB       ILE  14  23.053   0.388   3.542
  391   HG12  ILE  14          HG12      ILE  14  23.284  -2.607   3.914
  392   HG13  ILE  14          HG11      ILE  14  22.071  -1.645   4.754
  393   HG21  ILE  14          HG21      ILE  14  25.413  -1.465   3.157
  394   HG22  ILE  14          HG22      ILE  14  25.238   0.194   2.584
  395   HG23  ILE  14          HG23      ILE  14  24.272  -1.096   1.865
  396   HD11  ILE  14          HD11      ILE  14  22.427  -1.662   1.744
  397   HD12  ILE  14          HD12      ILE  14  21.126  -0.894   2.651
  398   HD13  ILE  14          HD13      ILE  14  21.246  -2.651   2.603
  399    H    LEU  15           HN       LEU  15  24.113   2.246   4.910
  400    HA   LEU  15           HA       LEU  15  26.694   2.833   3.941
  401    HB2  LEU  15           HB2      LEU  15  24.354   4.314   4.826
  402    HB3  LEU  15           HB1      LEU  15  25.852   5.117   5.299
  403    HG   LEU  15           HG       LEU  15  26.624   4.665   2.871
  404   HD11  LEU  15          HD11      LEU  15  24.790   3.085   2.335
  405   HD12  LEU  15          HD12      LEU  15  24.795   4.466   1.240
  406   HD13  LEU  15          HD13      LEU  15  23.620   4.387   2.552
  407   HD21  LEU  15          HD21      LEU  15  26.111   6.906   3.681
  408   HD22  LEU  15          HD22      LEU  15  24.381   6.607   3.506
  409   HD23  LEU  15          HD23      LEU  15  25.408   6.706   2.075
  410    H    SER  16           HN       SER  16  25.394   3.456   7.209
  411    HA   SER  16           HA       SER  16  27.674   4.274   8.484
  412    HB2  SER  16           HB2      SER  16  25.518   4.236   9.614
  413    HB3  SER  16           HB1      SER  16  25.492   2.475   9.570
  414    HG   SER  16           HG       SER  16  27.049   2.403  11.066
  415    H    ALA  17           HN       ALA  17  26.687   0.964   7.715
  416    HA   ALA  17           HA       ALA  17  28.735  -0.363   9.154
  417    HB1  ALA  17           HB1      ALA  17  26.945  -1.100   6.865
  418    HB2  ALA  17           HB2      ALA  17  27.006  -1.772   8.494
  419    HB3  ALA  17           HB3      ALA  17  28.266  -2.172   7.326
  420    H    LEU  18           HN       LEU  18  28.526   0.756   5.790
  421    HA   LEU  18           HA       LEU  18  31.107  -0.205   5.030
  422    HB2  LEU  18           HB2      LEU  18  29.332   1.939   3.828
  423    HB3  LEU  18           HB1      LEU  18  30.804   1.322   3.075
  424    HG   LEU  18           HG       LEU  18  28.585  -0.533   3.938
  425   HD11  LEU  18          HD11      LEU  18  27.879  -0.471   1.516
  426   HD12  LEU  18          HD12      LEU  18  28.914   0.941   1.309
  427   HD13  LEU  18          HD13      LEU  18  27.534   1.012   2.404
  428   HD21  LEU  18          HD21      LEU  18  30.767  -1.544   3.462
  429   HD22  LEU  18          HD22      LEU  18  30.841  -0.705   1.913
  430   HD23  LEU  18          HD23      LEU  18  29.633  -1.961   2.180
  431    H    HIS  19           HN       HIS  19  29.963   2.629   6.688
  432    HA   HIS  19           HA       HIS  19  32.169   4.336   6.155
  433    HB2  HIS  19           HB2      HIS  19  30.033   5.215   6.955
  434    HB3  HIS  19           HB1      HIS  19  30.216   4.323   8.465
  435    HD2  HIS  19           HD2      HIS  19  31.408   5.862  10.413
  436    HE1  HIS  19           HE1      HIS  19  33.480   8.543   7.895
  437    HE2  HIS  19           HE2      HIS  19  32.959   7.960  10.311
  438    H    PHE  20           HN       PHE  20  31.362   2.181   8.871
  439    HA   PHE  20           HA       PHE  20  33.795   2.713  10.294
  440    HB2  PHE  20           HB2      PHE  20  31.400   1.128  10.674
  441    HB3  PHE  20           HB1      PHE  20  32.843   0.222  11.126
  442    HD1  PHE  20           HD1      PHE  20  31.149   3.522  11.596
  443    HD2  PHE  20           HD2      PHE  20  33.955   0.668  13.155
  444    HE1  PHE  20           HE1      PHE  20  31.321   4.835  13.693
  445    HE2  PHE  20           HE2      PHE  20  34.127   1.981  15.251
  446    HZ   PHE  20           HZ       PHE  20  32.801   4.063  15.522
  447    H    MET  21           HN       MET  21  32.805   0.455   7.814
  448    HA   MET  21           HA       MET  21  34.859  -1.462   8.099
  449    HB2  MET  21           HB2      MET  21  32.834  -1.713   6.651
  450    HB3  MET  21           HB1      MET  21  33.536  -0.545   5.529
  451    HG2  MET  21           HG2      MET  21  34.182  -2.643   4.645
  452    HG3  MET  21           HG1      MET  21  35.610  -2.104   5.520
  453    HE1  MET  21           HE1      MET  21  32.267  -4.710   6.942
  454    HE2  MET  21           HE2      MET  21  33.027  -5.399   5.512
  455    HE3  MET  21           HE3      MET  21  32.416  -3.750   5.467
  456    H    ALA  22           HN       ALA  22  34.657   1.338   5.875
  457    HA   ALA  22           HA       ALA  22  37.304   1.109   4.897
  458    HB1  ALA  22           HB1      ALA  22  35.631   3.620   5.113
  459    HB2  ALA  22           HB2      ALA  22  35.494   2.436   3.812
  460    HB3  ALA  22           HB3      ALA  22  36.989   3.348   4.021
  461    H    TRP  23           HN       TRP  23  35.914   2.896   7.622
  462    HA   TRP  23           HA       TRP  23  38.188   4.399   8.317
  463    HB2  TRP  23           HB2      TRP  23  35.610   3.886   9.402
  464    HB3  TRP  23           HB1      TRP  23  36.791   3.618  10.683
  465    HD1  TRP  23           HD1      TRP  23  35.359   6.320   8.440
  466    HE1  TRP  23           HE1      TRP  23  36.201   8.619   9.249
  467    HE3  TRP  23           HE3      TRP  23  38.798   4.831  11.910
  468    HZ2  TRP  23           HZ2      TRP  23  38.085   9.685  11.119
  469    HZ3  TRP  23           HZ3      TRP  23  40.101   6.507  13.189
  470    HH2  TRP  23           HH2      TRP  23  39.749   8.931  12.798
  471    H    THR  24           HN       THR  24  37.106   1.206   9.472
  472    HA   THR  24           HA       THR  24  39.123   0.687  11.301
  473    HB   THR  24           HB       THR  24  37.709  -1.236   9.434
  474    HG1  THR  24           HG1      THR  24  36.171  -0.535  10.712
  475   HG21  THR  24          HG21      THR  24  39.442  -1.677  11.872
  476   HG22  THR  24          HG22      THR  24  39.664  -2.345  10.256
  477   HG23  THR  24          HG23      THR  24  38.323  -2.895  11.259
  478    H    ILE  25           HN       ILE  25  39.056  -0.049   7.806
  479    HA   ILE  25           HA       ILE  25  41.670  -1.162   7.713
  480    HB   ILE  25           HB       ILE  25  39.744  -0.086   5.694
  481   HG12  ILE  25          HG12      ILE  25  40.833  -2.574   4.968
  482   HG13  ILE  25          HG11      ILE  25  40.642  -2.652   6.717
  483   HG21  ILE  25          HG21      ILE  25  42.676  -0.683   5.252
  484   HG22  ILE  25          HG22      ILE  25  41.786   0.774   4.800
  485   HG23  ILE  25          HG23      ILE  25  41.490  -0.740   3.948
  486   HD11  ILE  25          HD11      ILE  25  38.325  -2.248   6.610
  487   HD12  ILE  25          HD12      ILE  25  38.619  -3.337   5.255
  488   HD13  ILE  25          HD13      ILE  25  38.416  -1.609   4.968
  489    H    GLY  26           HN       GLY  26  40.445   2.112   7.331
  490    HA2  GLY  26           HA2      GLY  26  42.793   3.338   6.373
  491    HA3  GLY  26           HA1      GLY  26  41.514   4.157   7.264
  492    H    HIS  27           HN       HIS  27  41.581   2.984   9.709
  493    HA   HIS  27           HA       HIS  27  43.743   4.246  10.991
  494    HB2  HIS  27           HB2      HIS  27  41.522   3.688  12.032
  495    HB3  HIS  27           HB1      HIS  27  42.053   2.009  12.119
  496    HD2  HIS  27           HD2      HIS  27  43.303   5.504  13.562
  497    HE1  HIS  27           HE1      HIS  27  44.672   2.398  16.071
  498    HE2  HIS  27           HE2      HIS  27  44.571   4.917  15.767
  499    H    LEU  28           HN       LEU  28  43.209   0.902   9.989
  500    HA   LEU  28           HA       LEU  28  45.593  -0.095  11.239
  501    HB2  LEU  28           HB2      LEU  28  43.472  -1.171   9.456
  502    HB3  LEU  28           HB1      LEU  28  45.038  -1.984   9.402
  503    HG   LEU  28           HG       LEU  28  43.405  -2.903  11.119
  504   HD11  LEU  28          HD11      LEU  28  45.903  -1.773  12.397
  505   HD12  LEU  28          HD12      LEU  28  45.978  -3.051  11.187
  506   HD13  LEU  28          HD13      LEU  28  45.124  -3.321  12.704
  507   HD21  LEU  28          HD21      LEU  28  44.118  -0.405  12.679
  508   HD22  LEU  28          HD22      LEU  28  42.930  -1.636  13.084
  509   HD23  LEU  28          HD23      LEU  28  42.629  -0.532  11.747
  510    H    ASN  29           HN       ASN  29  44.971   1.685   8.417
  511    HA   ASN  29           HA       ASN  29  46.265   2.314   6.639
  512    HB2  ASN  29           HB2      ASN  29  48.480   1.420   8.499
  513    HB3  ASN  29           HB1      ASN  29  48.706   2.381   7.039
  514   HD21  ASN  29          HD21      ASN  29  48.840   2.901  10.185
  515   HD22  ASN  29          HD22      ASN  29  48.058   4.402  10.321
  516    H    GLN  30           HN       GLN  30  45.206  -0.373   6.679
  517    HA   GLN  30           HA       GLN  30  47.115  -2.295   5.865
  518    HB2  GLN  30           HB2      GLN  30  44.736  -2.757   6.560
  519    HB3  GLN  30           HB1      GLN  30  44.225  -2.151   4.985
  520    HG2  GLN  30           HG2      GLN  30  44.423  -4.585   4.895
  521    HG3  GLN  30           HG1      GLN  30  45.676  -3.853   3.893
  522   HE21  GLN  30          HE21      GLN  30  47.454  -5.245   4.121
  523   HE22  GLN  30          HE22      GLN  30  48.089  -5.747   5.614
  524    H    ILE  31           HN       ILE  31  45.241   0.095   4.061
  525    HA   ILE  31           HA       ILE  31  46.213  -0.822   1.498
  526    HB   ILE  31           HB       ILE  31  43.963   0.297   1.915
  527   HG12  ILE  31          HG12      ILE  31  45.682   1.695  -0.149
  528   HG13  ILE  31          HG11      ILE  31  45.153   0.021  -0.333
  529   HG21  ILE  31          HG21      ILE  31  43.864   2.650   2.188
  530   HG22  ILE  31          HG22      ILE  31  45.570   2.857   1.789
  531   HG23  ILE  31          HG23      ILE  31  45.104   2.136   3.330
  532   HD11  ILE  31          HD11      ILE  31  43.572   1.465  -1.485
  533   HD12  ILE  31          HD12      ILE  31  43.373   2.460  -0.042
  534   HD13  ILE  31          HD13      ILE  31  42.787   0.797  -0.054
  535    H    LYS  32           HN       LYS  32  47.142   1.513   3.903
  536    HA   LYS  32           HA       LYS  32  49.007   2.844   2.086
  537    HB2  LYS  32           HB2      LYS  32  48.382   3.327   5.007
  538    HB3  LYS  32           HB1      LYS  32  49.465   4.312   4.026
  539    HG2  LYS  32           HG2      LYS  32  47.447   4.550   2.413
  540    HG3  LYS  32           HG1      LYS  32  46.478   3.984   3.773
  541    HD2  LYS  32           HD2      LYS  32  46.449   6.348   3.968
  542    HD3  LYS  32           HD1      LYS  32  47.650   5.820   5.147
  543    HE2  LYS  32           HE2      LYS  32  49.465   6.384   3.687
  544    HE3  LYS  32           HE1      LYS  32  48.376   6.624   2.322
  545    HZ1  LYS  32           HZ1      LYS  32  48.465   8.262   4.798
  546    HZ2  LYS  32           HZ2      LYS  32  47.362   8.474   3.523
  547    HZ3  LYS  32           HZ3      LYS  32  49.021   8.734   3.266
  548    H    ARG  33           HN       ARG  33  49.029   0.052   3.831
  549    HA   ARG  33           HA       ARG  33  51.903  -0.110   3.762
  550    HB2  ARG  33           HB2      ARG  33  50.950   0.913   6.074
  551    HB3  ARG  33           HB1      ARG  33  50.824  -0.808   6.433
  552    HG2  ARG  33           HG2      ARG  33  53.319  -0.560   5.207
  553    HG3  ARG  33           HG1      ARG  33  53.204   0.867   6.237
  554    HD2  ARG  33           HD2      ARG  33  52.978  -0.401   8.186
  555    HD3  ARG  33           HD1      ARG  33  52.418  -1.824   7.313
  556    HE   ARG  33           HE       ARG  33  55.037  -1.312   6.473
  557   HH11  ARG  33          HH11      ARG  33  53.297  -2.152   9.361
  558   HH12  ARG  33          HH12      ARG  33  54.613  -3.028  10.053
  559   HH21  ARG  33          HH21      ARG  33  56.763  -2.467   7.392
  560   HH22  ARG  33          HH22      ARG  33  56.572  -3.209   8.946
  561    H1   MET   1           HT1      MET   1  -0.585   2.717  21.044
  562    H2   MET   1           HT2      MET   1   0.567   1.542  20.618
  563    H3   MET   1           HT3      MET   1   0.853   3.181  20.272
  564    HA   MET   1           HA       MET   1   0.614   3.487  22.817
  565    HB2  MET   1           HB2      MET   1   0.169   0.783  22.655
  566    HB3  MET   1           HB1      MET   1   1.894   0.838  23.026
  567    HG2  MET   1           HG2      MET   1   1.563   1.866  25.077
  568    HG3  MET   1           HG1      MET   1   0.038   2.602  24.586
  569    HE1  MET   1           HE1      MET   1   0.862  -1.576  24.350
  570    HE2  MET   1           HE2      MET   1   1.109  -1.461  26.090
  571    HE3  MET   1           HE3      MET   1   2.014  -0.408  25.010
  572    H    PHE   2           HN       PHE   2   2.882   1.262  21.179
  573    HA   PHE   2           HA       PHE   2   4.995   3.298  21.564
  574    HB2  PHE   2           HB2      PHE   2   5.221   0.282  21.649
  575    HB3  PHE   2           HB1      PHE   2   6.595   1.389  21.674
  576    HD1  PHE   2           HD1      PHE   2   3.812  -0.015  23.583
  577    HD2  PHE   2           HD2      PHE   2   6.927   2.942  23.583
  578    HE1  PHE   2           HE1      PHE   2   3.537   0.275  26.032
  579    HE2  PHE   2           HE2      PHE   2   6.654   3.231  26.031
  580    HZ   PHE   2           HZ       PHE   2   4.959   1.896  27.256
  581    H    GLU   3           HN       GLU   3   6.078   3.935  19.792
  582    HA   GLU   3           HA       GLU   3   5.325   2.720  17.256
  583    HB2  GLU   3           HB2      GLU   3   6.692   5.313  17.946
  584    HB3  GLU   3           HB1      GLU   3   6.500   4.747  16.286
  585    HG2  GLU   3           HG2      GLU   3   4.166   4.985  18.192
  586    HG3  GLU   3           HG1      GLU   3   4.683   6.325  17.171
  587    HA   PRO   4           HA       PRO   4   9.185   0.632  16.819
  588    HB2  PRO   4           HB2      PRO   4   9.383   0.554  14.088
  589    HB3  PRO   4           HB1      PRO   4   8.272  -0.468  15.017
  590    HG2  PRO   4           HG2      PRO   4   7.725   2.037  13.505
  591    HG3  PRO   4           HG1      PRO   4   6.747   0.566  13.651
  592    HD2  PRO   4           HD2      PRO   4   6.226   2.844  15.069
  593    HD3  PRO   4           HD1      PRO   4   5.819   1.218  15.660
  594    H    PHE   5           HN       PHE   5   8.710   3.799  15.514
  595    HA   PHE   5           HA       PHE   5  11.192   4.342  14.358
  596    HB2  PHE   5           HB2      PHE   5  10.438   6.473  14.225
  597    HB3  PHE   5           HB1      PHE   5   8.921   5.780  14.800
  598    HD1  PHE   5           HD1      PHE   5  11.730   7.932  15.597
  599    HD2  PHE   5           HD2      PHE   5   8.410   5.787  17.266
  600    HE1  PHE   5           HE1      PHE   5  11.894   9.289  17.667
  601    HE2  PHE   5           HE2      PHE   5   8.570   7.142  19.337
  602    HZ   PHE   5           HZ       PHE   5  10.313   8.894  19.537
  603    H    GLN   6           HN       GLN   6  10.352   3.791  17.652
  604    HA   GLN   6           HA       GLN   6  12.442   5.263  18.900
  605    HB2  GLN   6           HB2      GLN   6  10.589   3.064  19.692
  606    HB3  GLN   6           HB1      GLN   6  12.016   3.341  20.693
  607    HG2  GLN   6           HG2      GLN   6  11.342   5.820  20.673
  608    HG3  GLN   6           HG1      GLN   6   9.790   5.271  20.043
  609   HE21  GLN   6          HE21      GLN   6   9.399   6.422  22.396
  610   HE22  GLN   6          HE22      GLN   6   9.282   5.310  23.673
  611    H    ILE   7           HN       ILE   7  12.278   2.125  17.365
  612    HA   ILE   7           HA       ILE   7  14.651   1.023  18.461
  613    HB   ILE   7           HB       ILE   7  13.304   0.455  15.807
  614   HG12  ILE   7          HG12      ILE   7  13.094  -1.063  18.423
  615   HG13  ILE   7          HG11      ILE   7  11.934   0.178  17.947
  616   HG21  ILE   7          HG21      ILE   7  14.495  -1.707  15.972
  617   HG22  ILE   7          HG22      ILE   7  15.287  -1.156  17.448
  618   HG23  ILE   7          HG23      ILE   7  15.632  -0.361  15.911
  619   HD11  ILE   7          HD11      ILE   7  11.705  -1.150  15.737
  620   HD12  ILE   7          HD12      ILE   7  10.963  -1.836  17.182
  621   HD13  ILE   7          HD13      ILE   7  12.506  -2.462  16.605
  622    H    LEU   8           HN       LEU   8  14.001   2.829  15.472
  623    HA   LEU   8           HA       LEU   8  16.696   2.746  14.546
  624    HB2  LEU   8           HB2      LEU   8  14.832   3.106  13.003
  625    HB3  LEU   8           HB1      LEU   8  14.434   4.620  13.815
  626    HG   LEU   8           HG       LEU   8  17.249   4.494  13.051
  627   HD11  LEU   8          HD11      LEU   8  16.907   4.664  10.635
  628   HD12  LEU   8          HD12      LEU   8  15.170   4.437  10.842
  629   HD13  LEU   8          HD13      LEU   8  16.282   3.118  11.211
  630   HD21  LEU   8          HD21      LEU   8  14.920   6.359  12.507
  631   HD22  LEU   8          HD22      LEU   8  16.572   6.693  11.991
  632   HD23  LEU   8          HD23      LEU   8  16.193   6.564  13.709
  633    H    SER   9           HN       SER   9  14.886   4.868  16.640
  634    HA   SER   9           HA       SER   9  16.700   7.067  16.551
  635    HB2  SER   9           HB2      SER   9  15.467   7.907  18.468
  636    HB3  SER   9           HB1      SER   9  14.330   7.242  17.299
  637    HG   SER   9           HG       SER   9  14.792   6.510  19.846
  638    H    ILE  10           HN       ILE  10  16.252   4.364  18.817
  639    HA   ILE  10           HA       ILE  10  18.409   5.174  20.522
  640    HB   ILE  10           HB       ILE  10  16.341   3.643  21.023
  641   HG12  ILE  10          HG12      ILE  10  18.990   2.681  22.104
  642   HG13  ILE  10          HG11      ILE  10  18.397   4.298  22.484
  643   HG21  ILE  10          HG21      ILE  10  16.712   1.299  20.747
  644   HG22  ILE  10          HG22      ILE  10  18.393   1.544  20.279
  645   HG23  ILE  10          HG23      ILE  10  17.096   2.025  19.193
  646   HD11  ILE  10          HD11      ILE  10  16.461   3.452  23.569
  647   HD12  ILE  10          HD12      ILE  10  17.777   2.422  24.133
  648   HD13  ILE  10          HD13      ILE  10  16.678   1.842  22.881
  649    H    CYS  11           HN       CYS  11  18.101   3.188  17.668
  650    HA   CYS  11           HA       CYS  11  20.556   1.769  17.948
  651    HB2  CYS  11           HB2      CYS  11  18.801   0.954  16.469
  652    HB3  CYS  11           HB1      CYS  11  18.908   2.419  15.492
  653    HG   CYS  11           HG       CYS  11  21.592   1.497  15.284
  654    H    SER  12           HN       SER  12  19.639   4.576  15.932
  655    HA   SER  12           HA       SER  12  22.278   5.085  15.019
  656    HB2  SER  12           HB2      SER  12  19.819   6.833  15.138
  657    HB3  SER  12           HB1      SER  12  21.327   7.317  14.366
  658    HG   SER  12           HG       SER  12  19.389   5.551  13.543
  659    H    PHE  13           HN       PHE  13  20.375   6.266  17.742
  660    HA   PHE  13           HA       PHE  13  22.039   8.364  18.570
  661    HB2  PHE  13           HB2      PHE  13  19.906   8.205  19.590
  662    HB3  PHE  13           HB1      PHE  13  20.175   6.530  20.077
  663    HD1  PHE  13           HD1      PHE  13  21.570   9.977  20.557
  664    HD2  PHE  13           HD2      PHE  13  20.996   6.055  22.217
  665    HE1  PHE  13           HE1      PHE  13  22.522  10.749  22.712
  666    HE2  PHE  13           HE2      PHE  13  21.948   6.829  24.372
  667    HZ   PHE  13           HZ       PHE  13  22.711   9.177  24.620
  668    H    ILE  14           HN       ILE  14  22.046   4.923  19.503
  669    HA   ILE  14           HA       ILE  14  24.208   5.084  21.309
  670    HB   ILE  14           HB       ILE  14  23.108   2.803  19.666
  671   HG12  ILE  14          HG12      ILE  14  23.014   3.287  22.651
  672   HG13  ILE  14          HG11      ILE  14  21.768   3.885  21.560
  673   HG21  ILE  14          HG21      ILE  14  25.337   2.865  21.710
  674   HG22  ILE  14          HG22      ILE  14  25.389   2.215  20.071
  675   HG23  ILE  14          HG23      ILE  14  24.450   1.391  21.317
  676   HD11  ILE  14          HD11      ILE  14  22.613   0.979  21.739
  677   HD12  ILE  14          HD12      ILE  14  21.258   1.629  20.816
  678   HD13  ILE  14          HD13      ILE  14  21.217   1.655  22.579
  679    H    LEU  15           HN       LEU  15  24.093   4.272  17.849
  680    HA   LEU  15           HA       LEU  15  26.837   3.726  17.519
  681    HB2  LEU  15           HB2      LEU  15  24.528   4.169  15.813
  682    HB3  LEU  15           HB1      LEU  15  25.995   4.856  15.116
  683    HG   LEU  15           HG       LEU  15  27.103   2.601  15.740
  684   HD11  LEU  15          HD11      LEU  15  25.244   1.818  17.179
  685   HD12  LEU  15          HD12      LEU  15  25.547   0.699  15.849
  686   HD13  LEU  15          HD13      LEU  15  24.175   1.807  15.776
  687   HD21  LEU  15          HD21      LEU  15  26.665   3.260  13.430
  688   HD22  LEU  15          HD22      LEU  15  24.972   2.793  13.589
  689   HD23  LEU  15          HD23      LEU  15  26.235   1.562  13.637
  690    H    SER  16           HN       SER  16  25.091   6.716  16.656
  691    HA   SER  16           HA       SER  16  27.201   8.322  15.975
  692    HB2  SER  16           HB2      SER  16  24.904   9.091  15.782
  693    HB3  SER  16           HB1      SER  16  24.720   9.084  17.535
  694    HG   SER  16           HG       SER  16  26.020  10.806  17.689
  695    H    ALA  17           HN       ALA  17  26.059   7.499  19.220
  696    HA   ALA  17           HA       ALA  17  27.728   9.284  20.654
  697    HB1  ALA  17           HB1      ALA  17  26.274   6.750  21.332
  698    HB2  ALA  17           HB2      ALA  17  26.007   8.381  21.939
  699    HB3  ALA  17           HB3      ALA  17  27.402   7.453  22.489
  700    H    LEU  18           HN       LEU  18  28.158   5.904  19.658
  701    HA   LEU  18           HA       LEU  18  30.735   5.601  20.851
  702    HB2  LEU  18           HB2      LEU  18  29.369   4.067  18.622
  703    HB3  LEU  18           HB1      LEU  18  30.883   3.581  19.388
  704    HG   LEU  18           HG       LEU  18  28.398   4.119  21.013
  705   HD11  LEU  18          HD11      LEU  18  28.104   1.612  20.999
  706   HD12  LEU  18          HD12      LEU  18  29.282   1.539  19.689
  707   HD13  LEU  18          HD13      LEU  18  27.755   2.387  19.453
  708   HD21  LEU  18          HD21      LEU  18  30.529   4.043  22.224
  709   HD22  LEU  18          HD22      LEU  18  30.928   2.503  21.464
  710   HD23  LEU  18          HD23      LEU  18  29.584   2.604  22.601
  711    H    HIS  19           HN       HIS  19  29.590   6.980  17.875
  712    HA   HIS  19           HA       HIS  19  31.993   6.765  16.375
  713    HB2  HIS  19           HB2      HIS  19  29.843   7.176  15.289
  714    HB3  HIS  19           HB1      HIS  19  29.697   8.719  16.132
  715    HD2  HIS  19           HD2      HIS  19  30.681  10.797  14.617
  716    HE1  HIS  19           HE1      HIS  19  33.371   8.593  12.226
  717    HE2  HIS  19           HE2      HIS  19  32.408  10.900  12.663
  718    H    PHE  20           HN       PHE  20  30.573   9.371  18.340
  719    HA   PHE  20           HA       PHE  20  32.780  11.162  17.951
  720    HB2  PHE  20           HB2      PHE  20  30.230  11.180  19.323
  721    HB3  PHE  20           HB1      PHE  20  31.498  11.889  20.323
  722    HD1  PHE  20           HD1      PHE  20  30.041  11.985  16.879
  723    HD2  PHE  20           HD2      PHE  20  32.294  14.062  19.890
  724    HE1  PHE  20           HE1      PHE  20  29.984  14.047  15.502
  725    HE2  PHE  20           HE2      PHE  20  32.236  16.123  18.513
  726    HZ   PHE  20           HZ       PHE  20  31.079  16.108  16.309
  727    H    MET  21           HN       MET  21  32.010   8.614  20.223
  728    HA   MET  21           HA       MET  21  33.814   9.280  22.290
  729    HB2  MET  21           HB2      MET  21  32.040   7.521  22.422
  730    HB3  MET  21           HB1      MET  21  33.020   6.503  21.365
  731    HG2  MET  21           HG2      MET  21  33.606   5.797  23.548
  732    HG3  MET  21           HG1      MET  21  34.917   6.880  23.093
  733    HE1  MET  21           HE1      MET  21  31.168   7.806  25.347
  734    HE2  MET  21           HE2      MET  21  32.083   6.540  26.158
  735    HE3  MET  21           HE3      MET  21  31.638   6.350  24.467
  736    H    ALA  22           HN       ALA  22  34.228   6.972  19.586
  737    HA   ALA  22           HA       ALA  22  36.972   6.461  20.069
  738    HB1  ALA  22           HB1      ALA  22  35.522   6.324  17.421
  739    HB2  ALA  22           HB2      ALA  22  35.487   5.054  18.645
  740    HB3  ALA  22           HB3      ALA  22  37.006   5.480  17.856
  741    H    TRP  23           HN       TRP  23  35.318   8.863  18.057
  742    HA   TRP  23           HA       TRP  23  37.570   9.886  16.717
  743    HB2  TRP  23           HB2      TRP  23  34.816  10.542  16.973
  744    HB3  TRP  23           HB1      TRP  23  35.743  12.008  17.289
  745    HD1  TRP  23           HD1      TRP  23  34.934   9.491  14.569
  746    HE1  TRP  23           HE1      TRP  23  35.831  10.367  12.316
  747    HE3  TRP  23           HE3      TRP  23  37.627  13.515  16.195
  748    HZ2  TRP  23           HZ2      TRP  23  37.473  12.492  11.334
  749    HZ3  TRP  23           HZ3      TRP  23  38.846  14.949  14.586
  750    HH2  TRP  23           HH2      TRP  23  38.773  14.441  12.154
  751    H    THR  24           HN       THR  24  36.037  10.937  19.759
  752    HA   THR  24           HA       THR  24  37.681  13.084  20.369
  753    HB   THR  24           HB       THR  24  36.423  11.062  22.242
  754    HG1  THR  24           HG1      THR  24  34.769  12.051  21.363
  755   HG21  THR  24          HG21      THR  24  37.695  13.762  22.725
  756   HG22  THR  24          HG22      THR  24  38.116  12.221  23.475
  757   HG23  THR  24          HG23      THR  24  36.588  13.006  23.871
  758    H    ILE  25           HN       ILE  25  38.111   9.649  21.241
  759    HA   ILE  25           HA       ILE  25  40.601  10.012  22.564
  760    HB   ILE  25           HB       ILE  25  39.130   7.676  21.412
  761   HG12  ILE  25          HG12      ILE  25  40.090   7.204  24.011
  762   HG13  ILE  25          HG11      ILE  25  39.614   8.900  24.001
  763   HG21  ILE  25          HG21      ILE  25  42.029   7.742  22.270
  764   HG22  ILE  25          HG22      ILE  25  41.356   7.105  20.768
  765   HG23  ILE  25          HG23      ILE  25  41.072   6.261  22.288
  766   HD11  ILE  25          HD11      ILE  25  37.390   8.402  23.399
  767   HD12  ILE  25          HD12      ILE  25  37.797   7.149  24.570
  768   HD13  ILE  25          HD13      ILE  25  37.805   6.778  22.847
  769    H    GLY  26           HN       GLY  26  39.744   9.341  19.220
  770    HA2  GLY  26           HA2      GLY  26  42.314   8.750  18.231
  771    HA3  GLY  26           HA1      GLY  26  40.983   9.392  17.272
  772    H    HIS  27           HN       HIS  27  40.553  11.846  18.352
  773    HA   HIS  27           HA       HIS  27  42.578  13.433  17.214
  774    HB2  HIS  27           HB2      HIS  27  40.177  14.111  17.550
  775    HB3  HIS  27           HB1      HIS  27  40.543  14.329  19.261
  776    HD2  HIS  27           HD2      HIS  27  41.837  15.860  15.820
  777    HE1  HIS  27           HE1      HIS  27  42.510  18.646  18.919
  778    HE2  HIS  27           HE2      HIS  27  42.677  18.260  16.415
  779    H    LEU  28           HN       LEU  28  41.923  12.455  20.544
  780    HA   LEU  28           HA       LEU  28  43.981  14.103  21.677
  781    HB2  LEU  28           HB2      LEU  28  42.091  12.027  22.652
  782    HB3  LEU  28           HB1      LEU  28  43.567  12.258  23.591
  783    HG   LEU  28           HG       LEU  28  41.601  13.707  24.296
  784   HD11  LEU  28          HD11      LEU  28  43.955  15.339  23.325
  785   HD12  LEU  28          HD12      LEU  28  44.102  14.201  24.663
  786   HD13  LEU  28          HD13      LEU  28  42.995  15.569  24.783
  787   HD21  LEU  28          HD21      LEU  28  42.274  15.292  21.804
  788   HD22  LEU  28          HD22      LEU  28  40.930  15.530  22.911
  789   HD23  LEU  28          HD23      LEU  28  40.951  14.131  21.845
  790    H    ASN  29           HN       ASN  29  43.982  11.173  19.966
  791    HA   ASN  29           HA       ASN  29  45.592   9.614  19.519
  792    HB2  ASN  29           HB2      ASN  29  47.389  11.841  20.513
  793    HB3  ASN  29           HB1      ASN  29  47.936  10.408  19.643
  794   HD21  ASN  29          HD21      ASN  29  47.589  13.519  18.996
  795   HD22  ASN  29          HD22      ASN  29  46.938  13.474  17.428
  796    H    GLN  30           HN       GLN  30  44.310   9.543  22.101
  797    HA   GLN  30           HA       GLN  30  46.152   9.110  24.208
  798    HB2  GLN  30           HB2      GLN  30  43.665   9.424  24.449
  799    HB3  GLN  30           HB1      GLN  30  43.461   7.772  23.867
  800    HG2  GLN  30           HG2      GLN  30  43.464   7.770  26.308
  801    HG3  GLN  30           HG1      GLN  30  44.921   6.974  25.722
  802   HE21  GLN  30          HE21      GLN  30  46.509   7.528  27.248
  803   HE22  GLN  30          HE22      GLN  30  46.845   9.117  27.742
  804    H    ILE  31           HN       ILE  31  44.816   6.964  21.743
  805    HA   ILE  31           HA       ILE  31  46.100   4.618  22.846
  806    HB   ILE  31           HB       ILE  31  43.918   4.627  21.534
  807   HG12  ILE  31          HG12      ILE  31  46.061   2.838  20.365
  808   HG13  ILE  31          HG11      ILE  31  45.428   2.615  21.995
  809   HG21  ILE  31          HG21      ILE  31  43.979   4.808  19.170
  810   HG22  ILE  31          HG22      ILE  31  45.739   4.704  19.121
  811   HG23  ILE  31          HG23      ILE  31  44.959   6.161  19.737
  812   HD11  ILE  31          HD11      ILE  31  44.183   1.179  20.480
  813   HD12  ILE  31          HD12      ILE  31  43.844   2.540  19.411
  814   HD13  ILE  31          HD13      ILE  31  43.122   2.480  21.019
  815    H    LYS  32           HN       LYS  32  46.833   7.081  20.505
  816    HA   LYS  32           HA       LYS  32  49.071   5.558  19.399
  817    HB2  LYS  32           HB2      LYS  32  48.024   8.322  18.750
  818    HB3  LYS  32           HB1      LYS  32  49.337   7.509  17.898
  819    HG2  LYS  32           HG2      LYS  32  47.639   5.578  17.558
  820    HG3  LYS  32           HG1      LYS  32  46.414   6.771  17.988
  821    HD2  LYS  32           HD2      LYS  32  46.560   6.901  15.625
  822    HD3  LYS  32           HD1      LYS  32  47.505   8.273  16.201
  823    HE2  LYS  32           HE2      LYS  32  49.573   7.116  15.843
  824    HE3  LYS  32           HE1      LYS  32  48.740   5.584  15.572
  825    HZ1  LYS  32           HZ1      LYS  32  48.579   7.996  13.847
  826    HZ2  LYS  32           HZ2      LYS  32  47.707   6.559  13.600
  827    HZ3  LYS  32           HZ3      LYS  32  49.402   6.557  13.483
  828    H    ARG  33           HN       ARG  33  48.573   7.350  22.114
  829    HA   ARG  33           HA       ARG  33  51.396   7.762  22.507
  830    HB2  ARG  33           HB2      ARG  33  50.177   9.855  21.316
  831    HB3  ARG  33           HB1      ARG  33  49.840  10.237  23.003
  832    HG2  ARG  33           HG2      ARG  33  52.514   9.431  23.015
  833    HG3  ARG  33           HG1      ARG  33  52.359  10.395  21.546
  834    HD2  ARG  33           HD2      ARG  33  51.703  12.307  22.717
  835    HD3  ARG  33           HD1      ARG  33  51.177  11.386  24.122
  836    HE   ARG  33           HE       ARG  33  53.930  10.984  23.857
  837   HH11  ARG  33          HH11      ARG  33  51.679  13.568  24.431
  838   HH12  ARG  33          HH12      ARG  33  52.785  14.492  25.376
  839   HH21  ARG  33          HH21      ARG  33  55.379  12.211  25.104
  840   HH22  ARG  33          HH22      ARG  33  54.875  13.731  25.760
  841    H1   MET   1           HT1      MET   1  -2.506  16.215  14.476
  842    H2   MET   1           HT2      MET   1  -1.413  15.885  15.734
  843    H3   MET   1           HT3      MET   1  -0.932  15.695  14.115
  844    HA   MET   1           HA       MET   1  -1.528  18.193  13.923
  845    HB2  MET   1           HB2      MET   1  -2.187  17.786  16.556
  846    HB3  MET   1           HB1      MET   1  -0.541  18.407  16.694
  847    HG2  MET   1           HG2      MET   1  -1.085  20.454  15.746
  848    HG3  MET   1           HG1      MET   1  -2.447  19.795  14.839
  849    HE1  MET   1           HE1      MET   1  -1.969  19.397  19.058
  850    HE2  MET   1           HE2      MET   1  -1.981  21.159  19.066
  851    HE3  MET   1           HE3      MET   1  -0.833  20.300  18.046
  852    H    PHE   2           HN       PHE   2   0.751  16.735  16.259
  853    HA   PHE   2           HA       PHE   2   2.958  17.575  14.473
  854    HB2  PHE   2           HB2      PHE   2   2.893  17.489  17.496
  855    HB3  PHE   2           HB1      PHE   2   4.341  17.787  16.536
  856    HD1  PHE   2           HD1      PHE   2   1.189  19.174  17.758
  857    HD2  PHE   2           HD2      PHE   2   4.516  19.822  15.120
  858    HE1  PHE   2           HE1      PHE   2   0.576  21.570  17.572
  859    HE2  PHE   2           HE2      PHE   2   3.903  22.218  14.934
  860    HZ   PHE   2           HZ       PHE   2   1.933  23.092  16.161
  861    H    GLU   3           HN       GLU   3   4.342  16.026  13.845
  862    HA   GLU   3           HA       GLU   3   3.884  13.331  14.845
  863    HB2  GLU   3           HB2      GLU   3   5.358  14.386  12.442
  864    HB3  GLU   3           HB1      GLU   3   5.368  12.683  12.896
  865    HG2  GLU   3           HG2      GLU   3   2.807  14.246  12.526
  866    HG3  GLU   3           HG1      GLU   3   3.589  13.394  11.195
  867    HA   PRO   4           HA       PRO   4   7.571  13.328  17.271
  868    HB2  PRO   4           HB2      PRO   4   8.175  10.658  17.228
  869    HB3  PRO   4           HB1      PRO   4   6.847  11.344  18.183
  870    HG2  PRO   4           HG2      PRO   4   6.763   9.941  15.560
  871    HG3  PRO   4           HG1      PRO   4   5.650   9.837  16.934
  872    HD2  PRO   4           HD2      PRO   4   5.114  11.314  14.698
  873    HD3  PRO   4           HD1      PRO   4   4.485  11.728  16.308
  874    H    PHE   5           HN       PHE   5   7.572  12.182  14.010
  875    HA   PHE   5           HA       PHE   5  10.240  11.440  13.641
  876    HB2  PHE   5           HB2      PHE   5   9.693  11.341  11.445
  877    HB3  PHE   5           HB1      PHE   5   8.054  11.647  12.020
  878    HD1  PHE   5           HD1      PHE   5  10.892  12.979  10.192
  879    HD2  PHE   5           HD2      PHE   5   7.186  14.008  12.093
  880    HE1  PHE   5           HE1      PHE   5  10.864  15.135   8.967
  881    HE2  PHE   5           HE2      PHE   5   7.153  16.166  10.869
  882    HZ   PHE   5           HZ       PHE   5   8.995  16.729   9.300
  883    H    GLN   6           HN       GLN   6   8.864  14.529  14.297
  884    HA   GLN   6           HA       GLN   6  10.855  16.169  13.092
  885    HB2  GLN   6           HB2      GLN   6   8.717  16.530  15.139
  886    HB3  GLN   6           HB1      GLN   6   9.993  17.745  15.058
  887    HG2  GLN   6           HG2      GLN   6   9.554  17.795  12.527
  888    HG3  GLN   6           HG1      GLN   6   8.072  16.910  12.887
  889   HE21  GLN   6          HE21      GLN   6   7.431  19.252  11.832
  890   HE22  GLN   6          HE22      GLN   6   7.022  20.420  12.994
  891    H    ILE   7           HN       ILE   7  10.658  14.421  16.115
  892    HA   ILE   7           HA       ILE   7  12.732  15.782  17.492
  893    HB   ILE   7           HB       ILE   7  11.761  12.928  17.791
  894   HG12  ILE   7          HG12      ILE   7  11.025  15.384  19.410
  895   HG13  ILE   7          HG11      ILE   7  10.059  14.813  18.050
  896   HG21  ILE   7          HG21      ILE   7  12.724  13.120  20.061
  897   HG22  ILE   7          HG22      ILE   7  13.325  14.731  19.668
  898   HG23  ILE   7          HG23      ILE   7  13.967  13.320  18.828
  899   HD11  ILE   7          HD11      ILE   7  10.064  12.522  19.247
  900   HD12  ILE   7          HD12      ILE   7   9.057  13.795  19.934
  901   HD13  ILE   7          HD13      ILE   7  10.615  13.416  20.665
  902    H    LEU   8           HN       LEU   8  12.698  12.864  15.476
  903    HA   LEU   8           HA       LEU   8  15.489  12.337  15.762
  904    HB2  LEU   8           HB2      LEU   8  13.919  10.561  15.148
  905    HB3  LEU   8           HB1      LEU   8  13.531  11.406  13.648
  906    HG   LEU   8           HG       LEU   8  16.409  11.061  13.990
  907   HD11  LEU   8          HD11      LEU   8  16.463   8.639  13.678
  908   HD12  LEU   8          HD12      LEU   8  14.702   8.564  13.755
  909   HD13  LEU   8          HD13      LEU   8  15.629   9.016  15.185
  910   HD21  LEU   8          HD21      LEU   8  14.352  10.287  11.900
  911   HD22  LEU   8          HD22      LEU   8  16.086  10.045  11.693
  912   HD23  LEU   8          HD23      LEU   8  15.437  11.677  11.864
  913    H    SER   9           HN       SER   9  13.565  14.282  13.600
  914    HA   SER   9           HA       SER   9  15.550  14.604  11.576
  915    HB2  SER   9           HB2      SER   9  14.112  16.363  10.720
  916    HB3  SER   9           HB1      SER   9  13.116  15.000  11.221
  917    HG   SER   9           HG       SER   9  13.149  17.542  12.133
  918    H    ILE  10           HN       ILE  10  14.543  16.584  14.348
  919    HA   ILE  10           HA       ILE  10  16.471  18.643  13.828
  920    HB   ILE  10           HB       ILE  10  14.228  18.732  15.184
  921   HG12  ILE  10          HG12      ILE  10  16.593  20.127  16.437
  922   HG13  ILE  10          HG11      ILE  10  16.075  20.524  14.798
  923   HG21  ILE  10          HG21      ILE  10  14.439  18.363  17.535
  924   HG22  ILE  10          HG22      ILE  10  16.187  18.164  17.424
  925   HG23  ILE  10          HG23      ILE  10  15.116  16.932  16.769
  926   HD11  ILE  10          HD11      ILE  10  13.939  21.252  15.529
  927   HD12  ILE  10          HD12      ILE  10  15.066  21.929  16.704
  928   HD13  ILE  10          HD13      ILE  10  14.128  20.492  17.110
  929    H    CYS  11           HN       CYS  11  16.431  15.654  15.628
  930    HA   CYS  11           HA       CYS  11  18.686  16.196  17.283
  931    HB2  CYS  11           HB2      CYS  11  17.115  14.424  17.850
  932    HB3  CYS  11           HB1      CYS  11  17.494  13.572  16.353
  933    HG   CYS  11           HG       CYS  11  20.090  13.709  17.518
  934    H    SER  12           HN       SER  12  18.333  14.258  14.305
  935    HA   SER  12           HA       SER  12  21.117  13.778  14.002
  936    HB2  SER  12           HB2      SER  12  18.823  13.629  12.048
  937    HB3  SER  12           HB1      SER  12  20.469  13.142  11.655
  938    HG   SER  12           HG       SER  12  18.564  11.912  13.217
  939    H    PHE  13           HN       PHE  13  18.931  16.265  12.802
  940    HA   PHE  13           HA       PHE  13  20.620  17.460  10.907
  941    HB2  PHE  13           HB2      PHE  13  18.352  18.140  10.914
  942    HB3  PHE  13           HB1      PHE  13  18.397  18.553  12.628
  943    HD1  PHE  13           HD1      PHE  13  19.992  19.455   9.358
  944    HD2  PHE  13           HD2      PHE  13  18.838  20.755  13.286
  945    HE1  PHE  13           HE1      PHE  13  20.665  21.774   8.789
  946    HE2  PHE  13           HE2      PHE  13  19.511  23.073  12.718
  947    HZ   PHE  13           HZ       PHE  13  20.424  23.583  10.469
  948    H    ILE  14           HN       ILE  14  20.196  18.148  14.380
  949    HA   ILE  14           HA       ILE  14  22.059  20.264  14.512
  950    HB   ILE  14           HB       ILE  14  21.028  18.336  16.594
  951   HG12  ILE  14          HG12      ILE  14  20.524  21.299  16.261
  952   HG13  ILE  14          HG11      ILE  14  19.519  20.083  15.481
  953   HG21  ILE  14          HG21      ILE  14  22.908  20.693  16.853
  954   HG22  ILE  14          HG22      ILE  14  23.166  19.040  17.409
  955   HG23  ILE  14          HG23      ILE  14  21.975  20.063  18.212
  956   HD11  ILE  14          HD11      ILE  14  20.056  20.169  18.461
  957   HD12  ILE  14          HD12      ILE  14  18.913  19.121  17.621
  958   HD13  ILE  14          HD13      ILE  14  18.623  20.860  17.698
  959    H    LEU  15           HN       LEU  15  22.401  16.772  15.117
  960    HA   LEU  15           HA       LEU  15  25.109  16.831  15.917
  961    HB2  LEU  15           HB2      LEU  15  23.133  14.829  15.163
  962    HB3  LEU  15           HB1      LEU  15  24.748  14.400  14.596
  963    HG   LEU  15           HG       LEU  15  25.532  15.042  16.979
  964   HD11  LEU  15          HD11      LEU  15  23.407  16.132  17.637
  965   HD12  LEU  15          HD12      LEU  15  23.806  14.793  18.714
  966   HD13  LEU  15          HD13      LEU  15  22.573  14.586  17.471
  967   HD21  LEU  15          HD21      LEU  15  25.518  12.740  16.162
  968   HD22  LEU  15          HD22      LEU  15  23.788  12.612  16.476
  969   HD23  LEU  15          HD23      LEU  15  24.918  12.774  17.821
  970    H    SER  16           HN       SER  16  23.770  15.920  12.729
  971    HA   SER  16           HA       SER  16  26.095  15.659  11.301
  972    HB2  SER  16           HB2      SER  16  23.924  15.178  10.313
  973    HB3  SER  16           HB1      SER  16  23.481  16.881  10.381
  974    HG   SER  16           HG       SER  16  24.876  17.319   8.790
  975    H    ALA  17           HN       ALA  17  24.407  18.634  12.193
  976    HA   ALA  17           HA       ALA  17  25.975  20.415  10.640
  977    HB1  ALA  17           HB1      ALA  17  24.225  20.703  13.057
  978    HB2  ALA  17           HB2      ALA  17  24.006  21.365  11.438
  979    HB3  ALA  17           HB3      ALA  17  25.213  22.060  12.520
  980    H    LEU  18           HN       LEU  18  26.272  19.268  13.985
  981    HA   LEU  18           HA       LEU  18  28.601  20.814  14.588
  982    HB2  LEU  18           HB2      LEU  18  27.474  18.306  15.868
  983    HB3  LEU  18           HB1      LEU  18  28.804  19.258  16.531
  984    HG   LEU  18           HG       LEU  18  26.152  20.526  15.853
  985   HD11  LEU  18          HD11      LEU  18  25.645  20.292  18.310
  986   HD12  LEU  18          HD12      LEU  18  27.005  19.177  18.430
  987   HD13  LEU  18          HD13      LEU  18  25.616  18.767  17.426
  988   HD21  LEU  18          HD21      LEU  18  28.073  22.021  16.202
  989   HD22  LEU  18          HD22      LEU  18  28.423  21.234  17.741
  990   HD23  LEU  18          HD23      LEU  18  26.941  22.172  17.545
  991    H    HIS  19           HN       HIS  19  28.041  17.786  12.968
  992    HA   HIS  19           HA       HIS  19  30.615  16.644  13.318
  993    HB2  HIS  19           HB2      HIS  19  28.691  15.296  12.638
  994    HB3  HIS  19           HB1      HIS  19  28.562  16.212  11.137
  995    HD2  HIS  19           HD2      HIS  19  29.937  14.990   9.090
  996    HE1  HIS  19           HE1      HIS  19  32.752  12.873  11.416
  997    HE2  HIS  19           HE2      HIS  19  31.942  13.316   9.052
  998    H    PHE  20           HN       PHE  20  29.145  18.555  10.696
  999    HA   PHE  20           HA       PHE  20  31.535  18.613   9.111
 1000    HB2  PHE  20           HB2      PHE  20  28.816  19.589   8.912
 1001    HB3  PHE  20           HB1      PHE  20  29.972  20.814   8.388
 1002    HD1  PHE  20           HD1      PHE  20  29.089  17.204   7.965
 1003    HD2  PHE  20           HD2      PHE  20  31.011  20.657   6.281
 1004    HE1  PHE  20           HE1      PHE  20  29.430  15.977   5.837
 1005    HE2  PHE  20           HE2      PHE  20  31.351  19.430   4.153
 1006    HZ   PHE  20           HZ       PHE  20  30.563  17.088   3.922
 1007    H    MET  21           HN       MET  21  30.214  20.569  11.691
 1008    HA   MET  21           HA       MET  21  31.731  22.920  11.303
 1009    HB2  MET  21           HB2      MET  21  29.810  22.684  12.883
 1010    HB3  MET  21           HB1      MET  21  30.841  21.716  13.938
 1011    HG2  MET  21           HG2      MET  21  31.031  23.906  14.812
 1012    HG3  MET  21           HG1      MET  21  32.483  23.721  13.834
 1013    HE1  MET  21           HE1      MET  21  28.528  25.457  12.665
 1014    HE2  MET  21           HE2      MET  21  29.187  26.290  14.070
 1015    HE3  MET  21           HE3      MET  21  28.992  24.543  14.103
 1016    H    ALA  22           HN       ALA  22  32.351  20.159  13.499
 1017    HA   ALA  22           HA       ALA  22  34.929  21.011  14.296
 1018    HB1  ALA  22           HB1      ALA  22  33.892  18.176  14.158
 1019    HB2  ALA  22           HB2      ALA  22  33.565  19.296  15.480
 1020    HB3  ALA  22           HB3      ALA  22  35.216  18.766  15.160
 1021    H    TRP  23           HN       TRP  23  33.817  18.940  11.646
 1022    HA   TRP  23           HA       TRP  23  36.327  18.016  10.774
 1023    HB2  TRP  23           HB2      TRP  23  33.632  17.908   9.873
 1024    HB3  TRP  23           HB1      TRP  23  34.626  18.450   8.521
 1025    HD1  TRP  23           HD1      TRP  23  34.023  15.480  10.803
 1026    HE1  TRP  23           HE1      TRP  23  35.328  13.448   9.899
 1027    HE3  TRP  23           HE3      TRP  23  36.777  17.748   7.147
 1028    HZ2  TRP  23           HZ2      TRP  23  37.279  12.860   7.893
 1029    HZ3  TRP  23           HZ3      TRP  23  38.349  16.432   5.757
 1030    HH2  TRP  23           HH2      TRP  23  38.603  13.991   6.123
 1031    H    THR  24           HN       THR  24  34.447  20.866   9.753
 1032    HA   THR  24           HA       THR  24  36.156  21.847   7.800
 1033    HB   THR  24           HB       THR  24  34.459  23.382   9.786
 1034    HG1  THR  24           HG1      THR  24  33.045  22.340   8.607
 1035   HG21  THR  24          HG21      THR  24  35.869  24.217   7.246
 1036   HG22  THR  24          HG22      THR  24  36.034  24.923   8.854
 1037   HG23  THR  24          HG23      THR  24  34.536  25.135   7.947
 1038    H    ILE  25           HN       ILE  25  36.159  22.528  11.305
 1039    HA   ILE  25           HA       ILE  25  38.433  24.236  11.244
 1040    HB   ILE  25           HB       ILE  25  36.958  22.737  13.369
 1041   HG12  ILE  25          HG12      ILE  25  37.473  25.414  14.054
 1042   HG13  ILE  25          HG11      ILE  25  37.145  25.439  12.323
 1043   HG21  ILE  25          HG21      ILE  25  39.692  24.002  13.618
 1044   HG22  ILE  25          HG22      ILE  25  39.191  22.387  14.124
 1045   HG23  ILE  25          HG23      ILE  25  38.616  23.803  15.002
 1046   HD11  ILE  25          HD11      ILE  25  35.004  24.492  12.589
 1047   HD12  ILE  25          HD12      ILE  25  35.127  25.627  13.933
 1048   HD13  ILE  25          HD13      ILE  25  35.363  23.902  14.214
 1049    H    GLY  26           HN       GLY  26  38.047  20.766  11.653
 1050    HA2  GLY  26           HA2      GLY  26  40.679  20.136  12.435
 1051    HA3  GLY  26           HA1      GLY  26  39.572  19.032  11.624
 1052    H    HIS  27           HN       HIS  27  39.187  20.196   9.198
 1053    HA   HIS  27           HA       HIS  27  41.491  19.476   7.752
 1054    HB2  HIS  27           HB2      HIS  27  39.138  19.483   6.870
 1055    HB3  HIS  27           HB1      HIS  27  39.241  21.241   6.776
 1056    HD2  HIS  27           HD2      HIS  27  41.177  18.146   5.186
 1057    HE1  HIS  27           HE1      HIS  27  41.606  21.498   2.656
 1058    HE2  HIS  27           HE2      HIS  27  42.117  19.025   2.913
 1059    H    LEU  28           HN       LEU  28  40.259  22.597   8.847
 1060    HA   LEU  28           HA       LEU  28  42.249  24.126   7.452
 1061    HB2  LEU  28           HB2      LEU  28  40.061  24.675   9.386
 1062    HB3  LEU  28           HB1      LEU  28  41.390  25.834   9.348
 1063    HG   LEU  28           HG       LEU  28  39.475  26.339   7.756
 1064   HD11  LEU  28          HD11      LEU  28  42.081  25.830   6.309
 1065   HD12  LEU  28          HD12      LEU  28  41.925  27.097   7.522
 1066   HD13  LEU  28          HD13      LEU  28  40.937  27.144   6.063
 1067   HD21  LEU  28          HD21      LEU  28  40.652  24.080   6.116
 1068   HD22  LEU  28          HD22      LEU  28  39.181  24.995   5.807
 1069   HD23  LEU  28          HD23      LEU  28  39.242  23.852   7.144
 1070    H    ASN  29           HN       ASN  29  42.259  22.250  10.279
 1071    HA   ASN  29           HA       ASN  29  43.779  21.946  11.958
 1072    HB2  ASN  29           HB2      ASN  29  45.589  23.337   9.968
 1073    HB3  ASN  29           HB1      ASN  29  46.136  22.461  11.397
 1074   HD21  ASN  29          HD21      ASN  29  46.159  21.986   8.236
 1075   HD22  ASN  29          HD22      ASN  29  45.754  20.340   8.134
 1076    H    GLN  30           HN       GLN  30  42.115  24.299  12.040
 1077    HA   GLN  30           HA       GLN  30  43.569  26.620  12.756
 1078    HB2  GLN  30           HB2      GLN  30  41.113  26.513  12.213
 1079    HB3  GLN  30           HB1      GLN  30  40.856  25.804  13.808
 1080    HG2  GLN  30           HG2      GLN  30  40.487  28.217  13.925
 1081    HG3  GLN  30           HG1      GLN  30  41.937  27.798  14.835
 1082   HE21  GLN  30          HE21      GLN  30  43.320  29.571  14.517
 1083   HE22  GLN  30          HE22      GLN  30  43.724  30.206  12.995
 1084    H    ILE  31           HN       ILE  31  42.444  23.849  14.629
 1085    HA   ILE  31           HA       ILE  31  43.333  24.971  17.145
 1086    HB   ILE  31           HB       ILE  31  41.387  23.353  16.854
 1087   HG12  ILE  31          HG12      ILE  31  43.520  22.396  18.780
 1088   HG13  ILE  31          HG11      ILE  31  42.627  23.898  19.026
 1089   HG21  ILE  31          HG21      ILE  31  41.824  21.044  16.546
 1090   HG22  ILE  31          HG22      ILE  31  43.553  21.243  16.835
 1091   HG23  ILE  31          HG23      ILE  31  42.833  21.838  15.339
 1092   HD11  ILE  31          HD11      ILE  31  41.512  22.115  20.252
 1093   HD12  ILE  31          HD12      ILE  31  41.449  21.112  18.802
 1094   HD13  ILE  31          HD13      ILE  31  40.495  22.592  18.892
 1095    H    LYS  32           HN       LYS  32  44.629  22.935  14.642
 1096    HA   LYS  32           HA       LYS  32  46.869  22.076  16.312
 1097    HB2  LYS  32           HB2      LYS  32  46.179  21.457  13.431
 1098    HB3  LYS  32           HB1      LYS  32  47.527  20.757  14.326
 1099    HG2  LYS  32           HG2      LYS  32  45.734  20.048  16.063
 1100    HG3  LYS  32           HG1      LYS  32  44.570  20.375  14.778
 1101    HD2  LYS  32           HD2      LYS  32  45.082  18.067  14.550
 1102    HD3  LYS  32           HD1      LYS  32  46.038  18.864  13.298
 1103    HE2  LYS  32           HE2      LYS  32  48.035  18.741  14.618
 1104    HE3  LYS  32           HE1      LYS  32  47.133  18.254  16.053
 1105    HZ1  LYS  32           HZ1      LYS  32  47.429  16.680  13.552
 1106    HZ2  LYS  32           HZ2      LYS  32  46.494  16.217  14.893
 1107    HZ3  LYS  32           HZ3      LYS  32  48.183  16.353  15.036
 1108    H    ARG  33           HN       ARG  33  46.118  24.796  14.618
 1109    HA   ARG  33           HA       ARG  33  48.872  25.626  14.497
 1110    HB2  ARG  33           HB2      ARG  33  48.030  24.411  12.238
 1111    HB3  ARG  33           HB1      ARG  33  47.476  26.054  11.917
 1112    HG2  ARG  33           HG2      ARG  33  50.042  26.395  12.971
 1113    HG3  ARG  33           HG1      ARG  33  50.191  24.988  11.919
 1114    HD2  ARG  33           HD2      ARG  33  49.538  26.181  10.020
 1115    HD3  ARG  33           HD1      ARG  33  48.721  27.426  10.960
 1116    HE   ARG  33           HE       ARG  33  51.434  27.549  11.616
 1117   HH11  ARG  33          HH11      ARG  33  49.364  27.949   8.854
 1118   HH12  ARG  33          HH12      ARG  33  50.389  29.108   8.094
 1119   HH21  ARG  33          HH21      ARG  33  52.778  29.076  10.606
 1120   HH22  ARG  33          HH22      ARG  33  52.317  29.750   9.078
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1   0.678  13.883  -0.463
    2    H2   MET   1           HT2      MET   1   1.392  14.434   0.976
    3    H3   MET   1           HT3      MET   1   2.074  13.125   0.135
    4    HA   MET   1           HA       MET   1   2.794  14.480  -1.630
    5    HB2  MET   1           HB2      MET   1   2.246  17.023  -1.381
    6    HB3  MET   1           HB1      MET   1   1.011  15.950  -2.040
    7    HG2  MET   1           HG2      MET   1  -0.069  15.789   0.153
    8    HG3  MET   1           HG1      MET   1   1.207  16.770   0.876
    9    HE1  MET   1           HE1      MET   1   0.641  20.273  -0.087
   10    HE2  MET   1           HE2      MET   1   1.832  19.197  -0.813
   11    HE3  MET   1           HE3      MET   1   1.446  19.046   0.899
   12    H    PHE   2           HN       PHE   2   4.862  14.299  -0.972
   13    HA   PHE   2           HA       PHE   2   6.833  14.727   0.125
   14    HB2  PHE   2           HB2      PHE   2   5.422  17.331   0.757
   15    HB3  PHE   2           HB1      PHE   2   7.143  17.028   0.991
   16    HD1  PHE   2           HD1      PHE   2   4.546  17.863  -1.395
   17    HD2  PHE   2           HD2      PHE   2   8.575  16.428  -1.001
   18    HE1  PHE   2           HE1      PHE   2   4.976  18.419  -3.774
   19    HE2  PHE   2           HE2      PHE   2   9.006  16.984  -3.379
   20    HZ   PHE   2           HZ       PHE   2   7.206  17.979  -4.765
   21    H    GLU   3           HN       GLU   3   5.977  12.955   1.556
   22    HA   GLU   3           HA       GLU   3   4.829  13.608   4.073
   23    HB2  GLU   3           HB2      GLU   3   6.305  11.148   3.116
   24    HB3  GLU   3           HB1      GLU   3   5.530  11.274   4.695
   25    HG2  GLU   3           HG2      GLU   3   3.938  11.985   2.265
   26    HG3  GLU   3           HG1      GLU   3   4.213  10.281   2.620
   27    HA   PRO   4           HA       PRO   4   8.162  14.969   6.621
   28    HB2  PRO   4           HB2      PRO   4   7.563  12.688   8.453
   29    HB3  PRO   4           HB1      PRO   4   7.665  14.422   8.809
   30    HG2  PRO   4           HG2      PRO   4   5.324  13.175   8.662
   31    HG3  PRO   4           HG1      PRO   4   5.528  14.835   8.074
   32    HD2  PRO   4           HD2      PRO   4   5.251  12.304   6.512
   33    HD3  PRO   4           HD1      PRO   4   4.724  13.952   6.104
   34    H    PHE   5           HN       PHE   5   7.975  11.417   6.337
   35    HA   PHE   5           HA       PHE   5  10.730  10.953   6.877
   36    HB2  PHE   5           HB2      PHE   5   9.811   8.912   7.043
   37    HB3  PHE   5           HB1      PHE   5   8.401   9.395   6.101
   38    HD1  PHE   5           HD1      PHE   5  11.821   8.009   5.933
   39    HD2  PHE   5           HD2      PHE   5   8.321   9.087   3.685
   40    HE1  PHE   5           HE1      PHE   5  12.696   6.764   3.975
   41    HE2  PHE   5           HE2      PHE   5   9.197   7.842   1.725
   42    HZ   PHE   5           HZ       PHE   5  11.387   6.678   1.868
   43    H    GLN   6           HN       GLN   6   8.915  11.672   3.969
   44    HA   GLN   6           HA       GLN   6  10.835  10.900   2.049
   45    HB2  GLN   6           HB2      GLN   6   8.450  11.469   1.561
   46    HB3  GLN   6           HB1      GLN   6   8.841  13.167   1.843
   47    HG2  GLN   6           HG2      GLN   6   8.962  12.741  -0.543
   48    HG3  GLN   6           HG1      GLN   6  10.598  12.999   0.062
   49   HE21  GLN   6          HE21      GLN   6  11.683  11.662  -1.499
   50   HE22  GLN   6          HE22      GLN   6  11.453   9.983  -1.576
   51    H    ILE   7           HN       ILE   7  10.236  14.006   3.641
   52    HA   ILE   7           HA       ILE   7  12.354  15.369   2.271
   53    HB   ILE   7           HB       ILE   7  11.726  17.254   3.444
   54   HG12  ILE   7          HG12      ILE   7  11.224  15.378   5.761
   55   HG13  ILE   7          HG11      ILE   7  12.439  16.643   5.640
   56   HG21  ILE   7          HG21      ILE   7   9.682  15.972   2.456
   57   HG22  ILE   7          HG22      ILE   7   9.369  17.309   3.562
   58   HG23  ILE   7          HG23      ILE   7   9.265  15.645   4.138
   59   HD11  ILE   7          HD11      ILE   7   9.456  16.940   5.997
   60   HD12  ILE   7          HD12      ILE   7  10.452  18.275   5.420
   61   HD13  ILE   7          HD13      ILE   7  10.747  17.578   7.012
   62    H    LEU   8           HN       LEU   8  12.134  13.476   5.181
   63    HA   LEU   8           HA       LEU   8  14.595  14.322   6.347
   64    HB2  LEU   8           HB2      LEU   8  12.750  13.226   7.615
   65    HB3  LEU   8           HB1      LEU   8  13.097  11.722   6.762
   66    HG   LEU   8           HG       LEU   8  15.544  12.825   7.813
   67   HD11  LEU   8          HD11      LEU   8  13.445  12.223   9.914
   68   HD12  LEU   8          HD12      LEU   8  13.889  13.863   9.441
   69   HD13  LEU   8          HD13      LEU   8  15.092  12.800  10.173
   70   HD21  LEU   8          HD21      LEU   8  15.508  10.586   9.013
   71   HD22  LEU   8          HD22      LEU   8  15.312  10.493   7.263
   72   HD23  LEU   8          HD23      LEU   8  13.909  10.324   8.317
   73    H    SER   9           HN       SER   9  13.663  11.807   4.067
   74    HA   SER   9           HA       SER   9  16.238  10.509   4.109
   75    HB2  SER   9           HB2      SER   9  15.342   9.142   2.316
   76    HB3  SER   9           HB1      SER   9  14.122   9.307   3.574
   77    HG   SER   9           HG       SER   9  13.334   9.667   1.415
   78    H    ILE  10           HN       ILE  10  14.599  12.951   2.172
   79    HA   ILE  10           HA       ILE  10  16.447  13.005   0.018
   80    HB   ILE  10           HB       ILE  10  14.530  15.071   1.103
   81   HG12  ILE  10          HG12      ILE  10  14.464  13.516  -1.494
   82   HG13  ILE  10          HG11      ILE  10  13.714  12.917  -0.019
   83   HG21  ILE  10          HG21      ILE  10  16.387  15.163  -1.284
   84   HG22  ILE  10          HG22      ILE  10  16.245  16.340   0.023
   85   HG23  ILE  10          HG23      ILE  10  14.949  16.176  -1.161
   86   HD11  ILE  10          HD11      ILE  10  12.078  14.134  -1.420
   87   HD12  ILE  10          HD12      ILE  10  13.097  15.571  -1.349
   88   HD13  ILE  10          HD13      ILE  10  12.335  14.957   0.119
   89    H    CYS  11           HN       CYS  11  16.232  14.859   3.058
   90    HA   CYS  11           HA       CYS  11  18.473  16.517   2.527
   91    HB2  CYS  11           HB2      CYS  11  16.765  17.057   4.219
   92    HB3  CYS  11           HB1      CYS  11  17.284  15.671   5.179
   93    HG   CYS  11           HG       CYS  11  18.949  17.216   6.162
   94    H    SER  12           HN       SER  12  18.135  13.608   4.606
   95    HA   SER  12           HA       SER  12  20.827  13.422   5.334
   96    HB2  SER  12           HB2      SER  12  19.005  12.131   6.396
   97    HB3  SER  12           HB1      SER  12  18.852  11.167   4.930
   98    HG   SER  12           HG       SER  12  21.159  11.420   6.573
   99    H    PHE  13           HN       PHE  13  19.102  12.108   2.535
  100    HA   PHE  13           HA       PHE  13  21.131  10.505   1.477
  101    HB2  PHE  13           HB2      PHE  13  18.866  10.422   0.605
  102    HB3  PHE  13           HB1      PHE  13  18.983  12.095   0.060
  103    HD1  PHE  13           HD1      PHE  13  20.798   8.827  -0.274
  104    HD2  PHE  13           HD2      PHE  13  19.626  12.513  -2.145
  105    HE1  PHE  13           HE1      PHE  13  21.800   8.063  -2.408
  106    HE2  PHE  13           HE2      PHE  13  20.629  11.748  -4.281
  107    HZ   PHE  13           HZ       PHE  13  21.718   9.523  -4.412
  108    H    ILE  14           HN       ILE  14  20.398  13.945   0.875
  109    HA   ILE  14           HA       ILE  14  22.437  14.420  -0.998
  110    HB   ILE  14           HB       ILE  14  21.103  16.236   1.017
  111   HG12  ILE  14          HG12      ILE  14  20.819  16.114  -1.995
  112   HG13  ILE  14          HG11      ILE  14  19.795  15.178  -0.906
  113   HG21  ILE  14          HG21      ILE  14  23.180  17.304   0.563
  114   HG22  ILE  14          HG22      ILE  14  22.030  18.059  -0.539
  115   HG23  ILE  14          HG23      ILE  14  23.144  16.829  -1.135
  116   HD11  ILE  14          HD11      ILE  14  18.584  17.186  -1.330
  117   HD12  ILE  14          HD12      ILE  14  20.022  18.184  -1.120
  118   HD13  ILE  14          HD13      ILE  14  19.284  17.397   0.275
  119    H    LEU  15           HN       LEU  15  22.440  14.649   2.551
  120    HA   LEU  15           HA       LEU  15  25.062  15.652   2.818
  121    HB2  LEU  15           HB2      LEU  15  23.129  14.266   4.602
  122    HB3  LEU  15           HB1      LEU  15  24.818  14.311   5.107
  123    HG   LEU  15           HG       LEU  15  23.391  16.798   4.169
  124   HD11  LEU  15          HD11      LEU  15  23.608  15.771   7.016
  125   HD12  LEU  15          HD12      LEU  15  22.124  15.791   6.063
  126   HD13  LEU  15          HD13      LEU  15  22.902  17.307   6.514
  127   HD21  LEU  15          HD21      LEU  15  25.807  16.961   4.271
  128   HD22  LEU  15          HD22      LEU  15  25.835  16.213   5.868
  129   HD23  LEU  15          HD23      LEU  15  25.155  17.827   5.661
  130    H    SER  16           HN       SER  16  23.915  12.300   3.265
  131    HA   SER  16           HA       SER  16  26.302  11.012   3.631
  132    HB2  SER  16           HB2      SER  16  25.236   9.011   2.691
  133    HB3  SER  16           HB1      SER  16  24.093   9.903   3.692
  134    HG   SER  16           HG       SER  16  23.583   9.160   1.353
  135    H    ALA  17           HN       ALA  17  24.854  11.972   0.540
  136    HA   ALA  17           HA       ALA  17  26.753  10.777  -1.162
  137    HB1  ALA  17           HB1      ALA  17  25.135  13.306  -1.592
  138    HB2  ALA  17           HB2      ALA  17  24.593  11.667  -1.956
  139    HB3  ALA  17           HB3      ALA  17  25.938  12.373  -2.853
  140    H    LEU  18           HN       LEU  18  26.583  14.074   0.199
  141    HA   LEU  18           HA       LEU  18  29.049  14.923  -0.957
  142    HB2  LEU  18           HB2      LEU  18  27.102  15.998   1.007
  143    HB3  LEU  18           HB1      LEU  18  28.746  16.627   1.106
  144    HG   LEU  18           HG       LEU  18  27.172  17.903  -0.438
  145   HD11  LEU  18          HD11      LEU  18  29.729  17.866  -0.537
  146   HD12  LEU  18          HD12      LEU  18  28.900  18.354  -2.016
  147   HD13  LEU  18          HD13      LEU  18  29.561  16.726  -1.872
  148   HD21  LEU  18          HD21      LEU  18  27.636  15.588  -2.332
  149   HD22  LEU  18          HD22      LEU  18  26.544  16.957  -2.530
  150   HD23  LEU  18          HD23      LEU  18  26.179  15.703  -1.346
  151    H    HIS  19           HN       HIS  19  28.262  13.011   1.776
  152    HA   HIS  19           HA       HIS  19  30.525  13.560   3.399
  153    HB2  HIS  19           HB2      HIS  19  28.336  12.379   4.049
  154    HB3  HIS  19           HB1      HIS  19  29.037  10.939   3.309
  155    HD2  HIS  19           HD2      HIS  19  31.771  10.389   4.497
  156    HE1  HIS  19           HE1      HIS  19  30.586  12.004   8.214
  157    HE2  HIS  19           HE2      HIS  19  32.338  10.591   7.038
  158    H    PHE  20           HN       PHE  20  29.786  10.707   1.345
  159    HA   PHE  20           HA       PHE  20  32.450   9.724   1.480
  160    HB2  PHE  20           HB2      PHE  20  29.952   9.012   0.077
  161    HB3  PHE  20           HB1      PHE  20  31.432   8.563  -0.770
  162    HD1  PHE  20           HD1      PHE  20  29.275   7.875   2.087
  163    HD2  PHE  20           HD2      PHE  20  33.154   7.146   0.394
  164    HE1  PHE  20           HE1      PHE  20  29.591   5.959   3.640
  165    HE2  PHE  20           HE2      PHE  20  33.476   5.233   1.942
  166    HZ   PHE  20           HZ       PHE  20  31.702   4.630   3.576
  167    H    MET  21           HN       MET  21  30.831  12.052  -0.547
  168    HA   MET  21           HA       MET  21  32.564  12.010  -2.770
  169    HB2  MET  21           HB2      MET  21  30.437  13.202  -2.815
  170    HB3  MET  21           HB1      MET  21  30.990  14.295  -1.546
  171    HG2  MET  21           HG2      MET  21  32.655  15.251  -2.974
  172    HG3  MET  21           HG1      MET  21  32.419  13.999  -4.195
  173    HE1  MET  21           HE1      MET  21  31.192  16.946  -6.144
  174    HE2  MET  21           HE2      MET  21  32.565  15.977  -5.617
  175    HE3  MET  21           HE3      MET  21  32.128  17.431  -4.723
  176    H    ALA  22           HN       ALA  22  32.604  14.041   0.157
  177    HA   ALA  22           HA       ALA  22  35.001  15.401  -0.436
  178    HB1  ALA  22           HB1      ALA  22  33.562  14.825   2.155
  179    HB2  ALA  22           HB2      ALA  22  33.659  16.347   1.271
  180    HB3  ALA  22           HB3      ALA  22  35.078  15.726   2.111
  181    H    TRP  23           HN       TRP  23  34.318  12.356   1.196
  182    HA   TRP  23           HA       TRP  23  36.917  11.837   2.166
  183    HB2  TRP  23           HB2      TRP  23  34.531  10.165   1.500
  184    HB3  TRP  23           HB1      TRP  23  36.068   9.358   1.797
  185    HD1  TRP  23           HD1      TRP  23  35.635  12.528   3.731
  186    HE1  TRP  23           HE1      TRP  23  35.175  11.977   6.204
  187    HE3  TRP  23           HE3      TRP  23  34.749   7.507   3.374
  188    HZ2  TRP  23           HZ2      TRP  23  34.500   9.724   7.813
  189    HZ3  TRP  23           HZ3      TRP  23  34.195   6.188   5.396
  190    HH2  TRP  23           HH2      TRP  23  34.070   7.290   7.612
  191    H    THR  24           HN       THR  24  35.391  10.993  -0.926
  192    HA   THR  24           HA       THR  24  37.492   9.497  -1.997
  193    HB   THR  24           HB       THR  24  35.554  11.341  -3.415
  194    HG1  THR  24           HG1      THR  24  34.259   9.857  -2.688
  195   HG21  THR  24          HG21      THR  24  37.422   9.181  -4.397
  196   HG22  THR  24          HG22      THR  24  37.310  10.852  -4.948
  197   HG23  THR  24          HG23      THR  24  36.021   9.711  -5.325
  198    H    ILE  25           HN       ILE  25  36.897  13.010  -2.099
  199    HA   ILE  25           HA       ILE  25  39.198  13.606  -3.673
  200    HB   ILE  25           HB       ILE  25  37.690  15.378  -1.731
  201   HG12  ILE  25          HG12      ILE  25  36.149  14.488  -3.375
  202   HG13  ILE  25          HG11      ILE  25  36.518  16.151  -3.825
  203   HG21  ILE  25          HG21      ILE  25  38.586  17.217  -3.099
  204   HG22  ILE  25          HG22      ILE  25  39.474  16.057  -4.085
  205   HG23  ILE  25          HG23      ILE  25  39.890  16.272  -2.384
  206   HD11  ILE  25          HD11      ILE  25  36.684  14.940  -5.859
  207   HD12  ILE  25          HD12      ILE  25  37.533  13.600  -5.086
  208   HD13  ILE  25          HD13      ILE  25  38.355  15.140  -5.336
  209    H    GLY  26           HN       GLY  26  38.601  13.442  -0.224
  210    HA2  GLY  26           HA2      GLY  26  41.053  14.502   0.673
  211    HA3  GLY  26           HA1      GLY  26  40.052  13.374   1.582
  212    H    HIS  27           HN       HIS  27  40.095  11.142   0.009
  213    HA   HIS  27           HA       HIS  27  42.558   9.933   0.661
  214    HB2  HIS  27           HB2      HIS  27  40.478   8.653   0.407
  215    HB3  HIS  27           HB1      HIS  27  40.456   9.020  -1.319
  216    HD2  HIS  27           HD2      HIS  27  43.845   8.001   0.404
  217    HE1  HIS  27           HE1      HIS  27  42.660   4.852  -2.146
  218    HE2  HIS  27           HE2      HIS  27  44.531   5.718  -0.663
  219    H    LEU  28           HN       LEU  28  41.329  11.340  -2.338
  220    HA   LEU  28           HA       LEU  28  43.652  10.554  -3.875
  221    HB2  LEU  28           HB2      LEU  28  41.259  12.302  -4.432
  222    HB3  LEU  28           HB1      LEU  28  42.590  12.134  -5.576
  223    HG   LEU  28           HG       LEU  28  41.193   9.721  -4.416
  224   HD11  LEU  28          HD11      LEU  28  40.528  11.160  -7.004
  225   HD12  LEU  28          HD12      LEU  28  39.526  11.192  -5.552
  226   HD13  LEU  28          HD13      LEU  28  39.783   9.673  -6.412
  227   HD21  LEU  28          HD21      LEU  28  42.943  10.286  -6.825
  228   HD22  LEU  28          HD22      LEU  28  42.051   8.778  -6.625
  229   HD23  LEU  28          HD23      LEU  28  43.300   9.225  -5.463
  230    H    ASN  29           HN       ASN  29  42.985  12.995  -1.623
  231    HA   ASN  29           HA       ASN  29  44.111  14.884  -0.976
  232    HB2  ASN  29           HB2      ASN  29  46.035  13.176  -1.325
  233    HB3  ASN  29           HB1      ASN  29  46.363  14.085  -2.800
  234   HD21  ASN  29          HD21      ASN  29  48.229  15.265  -2.205
  235   HD22  ASN  29          HD22      ASN  29  48.295  16.310  -0.870
  236    H    GLN  30           HN       GLN  30  42.330  15.068  -3.191
  237    HA   GLN  30           HA       GLN  30  41.698  16.555  -4.822
  238    HB2  GLN  30           HB2      GLN  30  44.046  18.183  -3.825
  239    HB3  GLN  30           HB1      GLN  30  42.674  18.777  -4.759
  240    HG2  GLN  30           HG2      GLN  30  41.150  18.105  -2.927
  241    HG3  GLN  30           HG1      GLN  30  42.540  17.562  -1.986
  242   HE21  GLN  30          HE21      GLN  30  44.367  19.459  -1.955
  243   HE22  GLN  30          HE22      GLN  30  43.753  20.989  -1.549
  244    H    ILE  31           HN       ILE  31  43.999  14.527  -5.210
  245    HA   ILE  31           HA       ILE  31  45.330  13.835  -6.936
  246    HB   ILE  31           HB       ILE  31  43.892  15.983  -8.518
  247   HG12  ILE  31          HG12      ILE  31  43.170  13.047  -8.211
  248   HG13  ILE  31          HG11      ILE  31  42.385  14.339  -7.304
  249   HG21  ILE  31          HG21      ILE  31  45.514  13.530  -9.244
  250   HG22  ILE  31          HG22      ILE  31  45.753  15.194  -9.778
  251   HG23  ILE  31          HG23      ILE  31  44.381  14.265 -10.378
  252   HD11  ILE  31          HD11      ILE  31  41.005  13.938  -9.218
  253   HD12  ILE  31          HD12      ILE  31  42.398  13.935 -10.301
  254   HD13  ILE  31          HD13      ILE  31  41.876  15.438  -9.541
  255    H    LYS  32           HN       LYS  32  47.181  14.444  -8.239
  256    HA   LYS  32           HA       LYS  32  49.117  15.604  -8.631
  257    HB2  LYS  32           HB2      LYS  32  47.165  17.421  -9.094
  258    HB3  LYS  32           HB1      LYS  32  48.010  18.213  -7.765
  259    HG2  LYS  32           HG2      LYS  32  49.689  18.821  -9.132
  260    HG3  LYS  32           HG1      LYS  32  49.931  17.154  -9.651
  261    HD2  LYS  32           HD2      LYS  32  49.351  18.264 -11.646
  262    HD3  LYS  32           HD1      LYS  32  47.829  17.537 -11.126
  263    HE2  LYS  32           HE2      LYS  32  47.086  19.688 -11.490
  264    HE3  LYS  32           HE1      LYS  32  47.615  19.863  -9.817
  265    HZ1  LYS  32           HZ1      LYS  32  49.555  20.284 -11.980
  266    HZ2  LYS  32           HZ2      LYS  32  49.506  20.970 -10.426
  267    HZ3  LYS  32           HZ3      LYS  32  48.437  21.513 -11.631
  268    H    ARG  33           HN       ARG  33  50.653  17.268  -7.495
  269    HA   ARG  33           HA       ARG  33  51.125  16.259  -4.868
  270    HB2  ARG  33           HB2      ARG  33  52.641  17.534  -6.812
  271    HB3  ARG  33           HB1      ARG  33  52.550  18.717  -5.507
  272    HG2  ARG  33           HG2      ARG  33  53.483  17.208  -3.925
  273    HG3  ARG  33           HG1      ARG  33  53.226  15.819  -4.982
  274    HD2  ARG  33           HD2      ARG  33  55.530  16.278  -5.191
  275    HD3  ARG  33           HD1      ARG  33  54.826  17.012  -6.626
  276    HE   ARG  33           HE       ARG  33  55.933  18.409  -4.303
  277   HH11  ARG  33          HH11      ARG  33  54.167  18.609  -7.322
  278   HH12  ARG  33          HH12      ARG  33  54.461  20.302  -7.506
  279   HH21  ARG  33          HH21      ARG  33  56.276  20.621  -4.589
  280   HH22  ARG  33          HH22      ARG  33  55.636  21.429  -5.981
  281    H1   MET   1           HT1      MET   1   3.439  -5.199   3.455
  282    H2   MET   1           HT2      MET   1   3.957  -3.688   2.873
  283    H3   MET   1           HT3      MET   1   4.622  -4.325   4.301
  284    HA   MET   1           HA       MET   1   5.772  -6.009   3.155
  285    HB2  MET   1           HB2      MET   1   5.477  -5.990   0.557
  286    HB3  MET   1           HB1      MET   1   4.260  -6.799   1.543
  287    HG2  MET   1           HG2      MET   1   2.814  -4.824   1.443
  288    HG3  MET   1           HG1      MET   1   4.050  -3.939   0.548
  289    HE1  MET   1           HE1      MET   1   4.044  -5.162  -2.919
  290    HE2  MET   1           HE2      MET   1   5.215  -5.619  -1.685
  291    HE3  MET   1           HE3      MET   1   4.535  -3.993  -1.686
  292    H    PHE   2           HN       PHE   2   7.669  -4.997   3.491
  293    HA   PHE   2           HA       PHE   2   9.465  -3.599   3.189
  294    HB2  PHE   2           HB2      PHE   2   8.265  -3.355   0.418
  295    HB3  PHE   2           HB1      PHE   2   9.879  -2.812   0.875
  296    HD1  PHE   2           HD1      PHE   2   7.823  -5.650  -0.047
  297    HD2  PHE   2           HD2      PHE   2  11.547  -4.493   1.753
  298    HE1  PHE   2           HE1      PHE   2   8.701  -7.943  -0.391
  299    HE2  PHE   2           HE2      PHE   2  12.426  -6.786   1.410
  300    HZ   PHE   2           HZ       PHE   2  11.002  -8.512   0.337
  301    H    GLU   3           HN       GLU   3   8.194  -2.246   4.761
  302    HA   GLU   3           HA       GLU   3   6.720  -0.004   3.826
  303    HB2  GLU   3           HB2      GLU   3   8.057  -0.564   6.480
  304    HB3  GLU   3           HB1      GLU   3   7.049   0.850   6.167
  305    HG2  GLU   3           HG2      GLU   3   5.971  -1.853   5.473
  306    HG3  GLU   3           HG1      GLU   3   5.995  -1.368   7.167
  307    HA   PRO   4           HA       PRO   4   9.709   3.006   2.633
  308    HB2  PRO   4           HB2      PRO   4   8.568   4.824   4.710
  309    HB3  PRO   4           HB1      PRO   4   8.801   5.102   2.974
  310    HG2  PRO   4           HG2      PRO   4   6.393   4.618   3.987
  311    HG3  PRO   4           HG1      PRO   4   6.875   3.990   2.401
  312    HD2  PRO   4           HD2      PRO   4   6.584   2.537   4.996
  313    HD3  PRO   4           HD1      PRO   4   6.315   1.960   3.335
  314    H    PHE   5           HN       PHE   5   9.182   2.878   6.159
  315    HA   PHE   5           HA       PHE   5  11.741   3.911   6.856
  316    HB2  PHE   5           HB2      PHE   5  10.590   4.016   8.780
  317    HB3  PHE   5           HB1      PHE   5   9.419   2.822   8.224
  318    HD1  PHE   5           HD1      PHE   5  12.644   3.317   9.953
  319    HD2  PHE   5           HD2      PHE   5   9.707   0.449   8.685
  320    HE1  PHE   5           HE1      PHE   5  13.689   1.601  11.408
  321    HE2  PHE   5           HE2      PHE   5  10.752  -1.265  10.139
  322    HZ   PHE   5           HZ       PHE   5  12.742  -0.689  11.502
  323    H    GLN   6           HN       GLN   6  10.526   0.695   6.172
  324    HA   GLN   6           HA       GLN   6  12.644  -0.818   7.254
  325    HB2  GLN   6           HB2      GLN   6  10.451  -1.739   6.483
  326    HB3  GLN   6           HB1      GLN   6  10.976  -1.481   4.819
  327    HG2  GLN   6           HG2      GLN   6  11.442  -3.785   5.420
  328    HG3  GLN   6           HG1      GLN   6  12.973  -2.920   5.283
  329   HE21  GLN   6          HE21      GLN   6  14.155  -4.194   6.828
  330   HE22  GLN   6          HE22      GLN   6  13.756  -4.224   8.478
  331    H    ILE   7           HN       ILE   7  12.136   0.490   4.002
  332    HA   ILE   7           HA       ILE   7  14.588  -0.562   2.955
  333    HB   ILE   7           HB       ILE   7  13.983   0.386   0.940
  334   HG12  ILE   7          HG12      ILE   7  12.905   2.674   2.593
  335   HG13  ILE   7          HG11      ILE   7  14.252   2.700   1.464
  336   HG21  ILE   7          HG21      ILE   7  12.000  -0.868   2.077
  337   HG22  ILE   7          HG22      ILE   7  11.661   0.098   0.642
  338   HG23  ILE   7          HG23      ILE   7  11.280   0.734   2.242
  339   HD11  ILE   7          HD11      ILE   7  11.301   2.526   0.853
  340   HD12  ILE   7          HD12      ILE   7  12.517   2.057  -0.336
  341   HD13  ILE   7          HD13      ILE   7  12.471   3.710   0.277
  342    H    LEU   8           HN       LEU   8  13.686   2.353   4.630
  343    HA   LEU   8           HA       LEU   8  15.991   3.882   3.932
  344    HB2  LEU   8           HB2      LEU   8  13.853   4.868   4.753
  345    HB3  LEU   8           HB1      LEU   8  14.172   4.166   6.339
  346    HG   LEU   8           HG       LEU   8  16.514   5.567   5.415
  347   HD11  LEU   8          HD11      LEU   8  14.039   7.297   5.656
  348   HD12  LEU   8          HD12      LEU   8  14.737   6.829   4.106
  349   HD13  LEU   8          HD13      LEU   8  15.673   7.812   5.234
  350   HD21  LEU   8          HD21      LEU   8  16.031   6.855   7.550
  351   HD22  LEU   8          HD22      LEU   8  16.125   5.105   7.744
  352   HD23  LEU   8          HD23      LEU   8  14.554   5.904   7.699
  353    H    SER   9           HN       SER   9  15.176   1.624   6.508
  354    HA   SER   9           HA       SER   9  17.554   2.158   8.041
  355    HB2  SER   9           HB2      SER   9  16.826   0.308   9.429
  356    HB3  SER   9           HB1      SER   9  15.440   1.330   9.062
  357    HG   SER   9           HG       SER   9  15.063  -0.946   8.770
  358    H    ILE  10           HN       ILE  10  16.535  -0.157   5.593
  359    HA   ILE  10           HA       ILE  10  18.711  -1.955   5.868
  360    HB   ILE  10           HB       ILE  10  16.879  -1.323   3.551
  361   HG12  ILE  10          HG12      ILE  10  17.079  -3.809   5.266
  362   HG13  ILE  10          HG11      ILE  10  16.030  -2.460   5.683
  363   HG21  ILE  10          HG21      ILE  10  19.105  -3.356   3.805
  364   HG22  ILE  10          HG22      ILE  10  18.882  -2.150   2.539
  365   HG23  ILE  10          HG23      ILE  10  17.788  -3.529   2.645
  366   HD11  ILE  10          HD11      ILE  10  14.799  -4.187   4.407
  367   HD12  ILE  10          HD12      ILE  10  15.943  -4.009   3.076
  368   HD13  ILE  10          HD13      ILE  10  14.881  -2.669   3.511
  369    H    CYS  11           HN       CYS  11  18.203   0.913   3.796
  370    HA   CYS  11           HA       CYS  11  20.670   0.681   2.412
  371    HB2  CYS  11           HB2      CYS  11  18.776   2.027   1.587
  372    HB3  CYS  11           HB1      CYS  11  18.973   3.130   2.949
  373    HG   CYS  11           HG       CYS  11  20.606   4.306   1.508
  374    H    SER  12           HN       SER  12  19.674   2.830   5.116
  375    HA   SER  12           HA       SER  12  22.167   4.010   5.522
  376    HB2  SER  12           HB2      SER  12  20.062   4.802   6.552
  377    HB3  SER  12           HB1      SER  12  20.055   3.383   7.594
  378    HG   SER  12           HG       SER  12  22.072   5.382   7.455
  379    H    PHE  13           HN       PHE  13  20.794   1.029   6.864
  380    HA   PHE  13           HA       PHE  13  22.787   0.420   8.718
  381    HB2  PHE  13           HB2      PHE  13  20.703  -0.827   8.632
  382    HB3  PHE  13           HB1      PHE  13  21.093  -1.428   7.020
  383    HD1  PHE  13           HD1      PHE  13  22.565  -1.277  10.469
  384    HD2  PHE  13           HD2      PHE  13  22.136  -3.506   6.822
  385    HE1  PHE  13           HE1      PHE  13  23.820  -3.165  11.475
  386    HE2  PHE  13           HE2      PHE  13  23.389  -5.395   7.828
  387    HZ   PHE  13           HZ       PHE  13  24.233  -5.223  10.153
  388    H    ILE  14           HN       ILE  14  22.544  -0.483   5.277
  389    HA   ILE  14           HA       ILE  14  24.907  -1.993   5.133
  390    HB   ILE  14           HB       ILE  14  23.467  -0.334   3.058
  391   HG12  ILE  14          HG12      ILE  14  23.676  -3.340   3.358
  392   HG13  ILE  14          HG11      ILE  14  22.388  -2.398   4.109
  393   HG21  ILE  14          HG21      ILE  14  25.697  -0.476   2.238
  394   HG22  ILE  14          HG22      ILE  14  24.836  -1.795   1.449
  395   HG23  ILE  14          HG23      ILE  14  25.892  -2.128   2.822
  396   HD11  ILE  14          HD11      ILE  14  21.493  -3.124   2.025
  397   HD12  ILE  14          HD12      ILE  14  22.979  -2.722   1.162
  398   HD13  ILE  14          HD13      ILE  14  21.937  -1.436   1.774
  399    H    LEU  15           HN       LEU  15  24.348   1.491   4.654
  400    HA   LEU  15           HA       LEU  15  26.983   2.152   3.907
  401    HB2  LEU  15           HB2      LEU  15  24.636   3.641   4.969
  402    HB3  LEU  15           HB1      LEU  15  26.214   4.428   5.058
  403    HG   LEU  15           HG       LEU  15  25.243   3.135   2.510
  404   HD11  LEU  15          HD11      LEU  15  24.870   6.023   3.362
  405   HD12  LEU  15          HD12      LEU  15  23.577   4.830   3.254
  406   HD13  LEU  15          HD13      LEU  15  24.433   5.336   1.798
  407   HD21  LEU  15          HD21      LEU  15  27.612   3.642   2.582
  408   HD22  LEU  15          HD22      LEU  15  27.294   5.255   3.220
  409   HD23  LEU  15          HD23      LEU  15  26.837   4.856   1.564
  410    H    SER  16           HN       SER  16  25.416   2.572   7.088
  411    HA   SER  16           HA       SER  16  27.549   3.407   8.581
  412    HB2  SER  16           HB2      SER  16  26.441   2.399  10.525
  413    HB3  SER  16           HB1      SER  16  25.251   3.135   9.456
  414    HG   SER  16           HG       SER  16  25.071   0.783  10.308
  415    H    ALA  17           HN       ALA  17  26.744   0.063   7.713
  416    HA   ALA  17           HA       ALA  17  28.764  -1.219   9.190
  417    HB1  ALA  17           HB1      ALA  17  27.528  -2.049   6.548
  418    HB2  ALA  17           HB2      ALA  17  26.879  -2.419   8.147
  419    HB3  ALA  17           HB3      ALA  17  28.424  -3.104   7.642
  420    H    LEU  18           HN       LEU  18  28.732  -0.083   5.812
  421    HA   LEU  18           HA       LEU  18  31.437  -0.833   5.291
  422    HB2  LEU  18           HB2      LEU  18  29.317   0.704   3.892
  423    HB3  LEU  18           HB1      LEU  18  30.980   1.055   3.425
  424    HG   LEU  18           HG       LEU  18  29.839  -0.802   2.111
  425   HD11  LEU  18          HD11      LEU  18  32.356  -0.453   2.411
  426   HD12  LEU  18          HD12      LEU  18  31.847  -2.075   1.944
  427   HD13  LEU  18          HD13      LEU  18  32.289  -1.738   3.617
  428   HD21  LEU  18          HD21      LEU  18  30.356  -2.466   4.585
  429   HD22  LEU  18          HD22      LEU  18  29.467  -2.920   3.133
  430   HD23  LEU  18          HD23      LEU  18  28.776  -1.752   4.261
  431    H    HIS  19           HN       HIS  19  30.002   1.810   6.933
  432    HA   HIS  19           HA       HIS  19  32.006   3.777   6.490
  433    HB2  HIS  19           HB2      HIS  19  29.623   4.097   7.399
  434    HB3  HIS  19           HB1      HIS  19  30.272   3.562   8.950
  435    HD2  HIS  19           HD2      HIS  19  32.688   5.231   9.694
  436    HE1  HIS  19           HE1      HIS  19  31.095   8.601   7.712
  437    HE2  HIS  19           HE2      HIS  19  32.847   7.819   9.377
  438    H    PHE  20           HN       PHE  20  31.312   1.770   9.386
  439    HA   PHE  20           HA       PHE  20  33.787   2.417  10.624
  440    HB2  PHE  20           HB2      PHE  20  31.500   0.635  11.173
  441    HB3  PHE  20           HB1      PHE  20  33.044   0.084  11.827
  442    HD1  PHE  20           HD1      PHE  20  30.373   2.552  12.083
  443    HD2  PHE  20           HD2      PHE  20  34.371   1.597  13.330
  444    HE1  PHE  20           HE1      PHE  20  30.205   4.225  13.905
  445    HE2  PHE  20           HE2      PHE  20  34.202   3.270  15.154
  446    HZ   PHE  20           HZ       PHE  20  32.116   4.589  15.437
  447    H    MET  21           HN       MET  21  32.796   0.026   8.294
  448    HA   MET  21           HA       MET  21  34.856  -1.859   8.649
  449    HB2  MET  21           HB2      MET  21  32.908  -2.313   7.252
  450    HB3  MET  21           HB1      MET  21  33.372  -1.027   6.138
  451    HG2  MET  21           HG2      MET  21  35.344  -2.207   5.461
  452    HG3  MET  21           HG1      MET  21  35.170  -3.378   6.767
  453    HE1  MET  21           HE1      MET  21  34.621  -5.665   3.853
  454    HE2  MET  21           HE2      MET  21  35.771  -4.868   4.925
  455    HE3  MET  21           HE3      MET  21  35.365  -4.133   3.374
  456    H    ALA  22           HN       ALA  22  34.638   0.928   6.442
  457    HA   ALA  22           HA       ALA  22  37.234   0.686   5.374
  458    HB1  ALA  22           HB1      ALA  22  35.330   3.016   5.624
  459    HB2  ALA  22           HB2      ALA  22  35.739   2.086   4.184
  460    HB3  ALA  22           HB3      ALA  22  36.923   3.188   4.885
  461    H    TRP  23           HN       TRP  23  35.957   2.334   8.220
  462    HA   TRP  23           HA       TRP  23  38.287   3.756   8.928
  463    HB2  TRP  23           HB2      TRP  23  35.875   2.775  10.396
  464    HB3  TRP  23           HB1      TRP  23  37.244   3.365  11.331
  465    HD1  TRP  23           HD1      TRP  23  36.853   5.039   8.014
  466    HE1  TRP  23           HE1      TRP  23  35.955   7.423   8.355
  467    HE3  TRP  23           HE3      TRP  23  35.482   4.789  12.928
  468    HZ2  TRP  23           HZ2      TRP  23  34.766   9.007  10.401
  469    HZ3  TRP  23           HZ3      TRP  23  34.459   6.751  14.047
  470    HH2  TRP  23           HH2      TRP  23  34.100   8.861  12.788
  471    H    THR  24           HN       THR  24  37.207   0.498   9.844
  472    HA   THR  24           HA       THR  24  39.282  -0.119  11.596
  473    HB   THR  24           HB       THR  24  37.825  -1.943   9.668
  474    HG1  THR  24           HG1      THR  24  36.271  -1.376  10.964
  475   HG21  THR  24          HG21      THR  24  39.579  -2.479  12.067
  476   HG22  THR  24          HG22      THR  24  39.749  -3.120  10.434
  477   HG23  THR  24          HG23      THR  24  38.420  -3.661  11.459
  478    H    ILE  25           HN       ILE  25  39.102  -0.511   8.064
  479    HA   ILE  25           HA       ILE  25  41.685  -1.686   7.804
  480    HB   ILE  25           HB       ILE  25  40.082  -0.126   5.760
  481   HG12  ILE  25          HG12      ILE  25  38.748  -1.963   6.603
  482   HG13  ILE  25          HG11      ILE  25  39.367  -2.424   5.020
  483   HG21  ILE  25          HG21      ILE  25  41.392  -1.408   4.119
  484   HG22  ILE  25          HG22      ILE  25  42.298  -2.167   5.428
  485   HG23  ILE  25          HG23      ILE  25  42.447  -0.432   5.141
  486   HD11  ILE  25          HD11      ILE  25  39.735  -4.336   6.376
  487   HD12  ILE  25          HD12      ILE  25  40.289  -3.363   7.739
  488   HD13  ILE  25          HD13      ILE  25  41.307  -3.544   6.311
  489    H    GLY  26           HN       GLY  26  40.511   1.620   7.672
  490    HA2  GLY  26           HA2      GLY  26  42.882   2.864   6.798
  491    HA3  GLY  26           HA1      GLY  26  41.627   3.644   7.756
  492    H    HIS  27           HN       HIS  27  41.681   2.224  10.085
  493    HA   HIS  27           HA       HIS  27  43.854   3.347  11.484
  494    HB2  HIS  27           HB2      HIS  27  41.718   2.801  12.565
  495    HB3  HIS  27           HB1      HIS  27  42.026   1.081  12.317
  496    HD2  HIS  27           HD2      HIS  27  44.948   3.413  13.546
  497    HE1  HIS  27           HE1      HIS  27  43.862   0.866  16.733
  498    HE2  HIS  27           HE2      HIS  27  45.546   2.601  15.954
  499    H    LEU  28           HN       LEU  28  43.298   0.107  10.192
  500    HA   LEU  28           HA       LEU  28  45.751  -0.957  11.293
  501    HB2  LEU  28           HB2      LEU  28  43.691  -2.010   9.356
  502    HB3  LEU  28           HB1      LEU  28  45.168  -2.896   9.737
  503    HG   LEU  28           HG       LEU  28  43.337  -1.873  11.909
  504   HD11  LEU  28          HD11      LEU  28  43.276  -4.608  10.597
  505   HD12  LEU  28          HD12      LEU  28  42.059  -3.356  10.355
  506   HD13  LEU  28          HD13      LEU  28  42.279  -4.076  11.950
  507   HD21  LEU  28          HD21      LEU  28  45.513  -3.970  11.692
  508   HD22  LEU  28          HD22      LEU  28  44.439  -3.848  13.085
  509   HD23  LEU  28          HD23      LEU  28  45.520  -2.513  12.686
  510    H    ASN  29           HN       ASN  29  44.991   1.019   8.649
  511    HA   ASN  29           HA       ASN  29  46.193   1.754   6.842
  512    HB2  ASN  29           HB2      ASN  29  47.947   1.830   8.753
  513    HB3  ASN  29           HB1      ASN  29  48.616   0.391   7.987
  514   HD21  ASN  29          HD21      ASN  29  50.473   1.231   6.956
  515   HD22  ASN  29          HD22      ASN  29  50.432   2.505   5.834
  516    H    GLN  30           HN       GLN  30  44.839  -0.744   6.635
  517    HA   GLN  30           HA       GLN  30  44.655  -2.530   5.207
  518    HB2  GLN  30           HB2      GLN  30  46.970  -1.226   3.758
  519    HB3  GLN  30           HB1      GLN  30  45.849  -2.414   3.094
  520    HG2  GLN  30           HG2      GLN  30  43.974  -0.843   3.481
  521    HG3  GLN  30           HG1      GLN  30  45.116   0.351   4.095
  522   HE21  GLN  30          HE21      GLN  30  47.113   0.600   2.394
  523   HE22  GLN  30          HE22      GLN  30  46.614   0.816   0.786
  524    H    ILE  31           HN       ILE  31  46.749  -2.413   7.479
  525    HA   ILE  31           HA       ILE  31  48.265  -3.845   8.415
  526    HB   ILE  31           HB       ILE  31  47.356  -5.760   6.250
  527   HG12  ILE  31          HG12      ILE  31  46.271  -5.431   9.069
  528   HG13  ILE  31          HG11      ILE  31  45.494  -4.744   7.643
  529   HG21  ILE  31          HG21      ILE  31  48.794  -6.068   8.896
  530   HG22  ILE  31          HG22      ILE  31  49.302  -6.639   7.308
  531   HG23  ILE  31          HG23      ILE  31  47.954  -7.417   8.133
  532   HD11  ILE  31          HD11      ILE  31  44.417  -6.843   8.038
  533   HD12  ILE  31          HD12      ILE  31  45.963  -7.666   8.259
  534   HD13  ILE  31          HD13      ILE  31  45.491  -7.088   6.660
  535    H    LYS  32           HN       LYS  32  50.364  -4.840   8.087
  536    HA   LYS  32           HA       LYS  32  52.453  -4.949   7.156
  537    HB2  LYS  32           HB2      LYS  32  50.816  -5.835   5.189
  538    HB3  LYS  32           HB1      LYS  32  51.511  -4.423   4.397
  539    HG2  LYS  32           HG2      LYS  32  53.452  -5.509   4.056
  540    HG3  LYS  32           HG1      LYS  32  53.590  -5.894   5.771
  541    HD2  LYS  32           HD2      LYS  32  53.476  -8.011   4.747
  542    HD3  LYS  32           HD1      LYS  32  51.817  -7.727   5.279
  543    HE2  LYS  32           HE2      LYS  32  51.389  -8.321   3.093
  544    HE3  LYS  32           HE1      LYS  32  51.650  -6.592   2.858
  545    HZ1  LYS  32           HZ1      LYS  32  53.955  -8.408   2.783
  546    HZ2  LYS  32           HZ2      LYS  32  53.724  -6.921   1.993
  547    HZ3  LYS  32           HZ3      LYS  32  52.938  -8.318   1.428
  548    H    ARG  33           HN       ARG  33  53.953  -3.652   5.582
  549    HA   ARG  33           HA       ARG  33  53.866  -0.935   6.448
  550    HB2  ARG  33           HB2      ARG  33  55.817  -2.650   5.468
  551    HB3  ARG  33           HB1      ARG  33  55.641  -1.442   4.194
  552    HG2  ARG  33           HG2      ARG  33  56.124   0.353   5.679
  553    HG3  ARG  33           HG1      ARG  33  55.896  -0.661   7.104
  554    HD2  ARG  33           HD2      ARG  33  58.238  -0.489   6.893
  555    HD3  ARG  33           HD1      ARG  33  57.869  -2.060   6.193
  556    HE   ARG  33           HE       ARG  33  58.719   0.344   4.754
  557   HH11  ARG  33          HH11      ARG  33  57.518  -2.942   4.590
  558   HH12  ARG  33          HH12      ARG  33  58.023  -3.161   2.954
  559   HH21  ARG  33          HH21      ARG  33  59.347   0.009   2.614
  560   HH22  ARG  33          HH22      ARG  33  59.043  -1.514   1.844
  561    H1   MET   1           HT1      MET   1   3.134  -0.151  22.248
  562    H2   MET   1           HT2      MET   1   3.844  -0.532  20.753
  563    H3   MET   1           HT3      MET   1   4.244   0.918  21.542
  564    HA   MET   1           HA       MET   1   5.415  -0.189  23.239
  565    HB2  MET   1           HB2      MET   1   5.504  -2.793  23.011
  566    HB3  MET   1           HB1      MET   1   4.098  -2.056  23.777
  567    HG2  MET   1           HG2      MET   1   2.839  -2.195  21.683
  568    HG3  MET   1           HG1      MET   1   4.256  -2.830  20.847
  569    HE1  MET   1           HE1      MET   1   4.671  -6.353  21.817
  570    HE2  MET   1           HE2      MET   1   5.607  -5.007  22.463
  571    HE3  MET   1           HE3      MET   1   5.065  -4.970  20.787
  572    H    PHE   2           HN       PHE   2   7.312   0.496  22.420
  573    HA   PHE   2           HA       PHE   2   9.236   0.561  21.170
  574    HB2  PHE   2           HB2      PHE   2   8.479  -2.321  20.628
  575    HB3  PHE   2           HB1      PHE   2  10.046  -1.599  20.265
  576    HD1  PHE   2           HD1      PHE   2   7.929  -3.025  22.840
  577    HD2  PHE   2           HD2      PHE   2  11.432  -0.641  22.144
  578    HE1  PHE   2           HE1      PHE   2   8.666  -3.426  25.173
  579    HE2  PHE   2           HE2      PHE   2  12.170  -1.041  24.477
  580    HZ   PHE   2           HZ       PHE   2  10.787  -2.436  25.991
  581    H    GLU   3           HN       GLU   3   7.863   2.045  19.820
  582    HA   GLU   3           HA       GLU   3   6.720   1.095  17.397
  583    HB2  GLU   3           HB2      GLU   3   7.605   3.858  18.255
  584    HB3  GLU   3           HB1      GLU   3   6.766   3.522  16.739
  585    HG2  GLU   3           HG2      GLU   3   5.593   2.464  19.278
  586    HG3  GLU   3           HG1      GLU   3   5.406   4.180  18.919
  587    HA   PRO   4           HA       PRO   4  10.079   0.577  14.587
  588    HB2  PRO   4           HB2      PRO   4   8.792   2.614  12.823
  589    HB3  PRO   4           HB1      PRO   4   9.295   0.956  12.447
  590    HG2  PRO   4           HG2      PRO   4   6.736   1.580  12.786
  591    HG3  PRO   4           HG1      PRO   4   7.392   0.032  13.344
  592    HD2  PRO   4           HD2      PRO   4   6.614   2.435  14.941
  593    HD3  PRO   4           HD1      PRO   4   6.547   0.712  15.376
  594    H    PHE   5           HN       PHE   5   9.035   3.972  14.911
  595    HA   PHE   5           HA       PHE   5  11.537   5.102  14.163
  596    HB2  PHE   5           HB2      PHE   5  10.131   6.850  14.088
  597    HB3  PHE   5           HB1      PHE   5   8.962   6.040  15.133
  598    HD1  PHE   5           HD1      PHE   5  11.933   8.234  15.045
  599    HD2  PHE   5           HD2      PHE   5   8.994   6.344  17.548
  600    HE1  PHE   5           HE1      PHE   5  12.621   9.674  16.944
  601    HE2  PHE   5           HE2      PHE   5   9.685   7.784  19.445
  602    HZ   PHE   5           HZ       PHE   5  11.499   9.448  19.145
  603    H    GLN   6           HN       GLN   6  10.186   3.995  17.201
  604    HA   GLN   6           HA       GLN   6  12.000   5.237  18.970
  605    HB2  GLN   6           HB2      GLN   6   9.876   4.094  19.635
  606    HB3  GLN   6           HB1      GLN   6  10.658   2.547  19.312
  607    HG2  GLN   6           HG2      GLN   6  10.848   3.022  21.685
  608    HG3  GLN   6           HG1      GLN   6  12.446   3.169  20.953
  609   HE21  GLN   6          HE21      GLN   6  13.286   4.759  22.426
  610   HE22  GLN   6          HE22      GLN   6  12.649   6.328  22.533
  611    H    ILE   7           HN       ILE   7  12.074   2.061  17.402
  612    HA   ILE   7           HA       ILE   7  14.562   1.283  18.595
  613    HB   ILE   7           HB       ILE   7  14.332  -0.712  17.460
  614   HG12  ILE   7          HG12      ILE   7  13.206   0.953  15.202
  615   HG13  ILE   7          HG11      ILE   7  14.703   0.032  15.221
  616   HG21  ILE   7          HG21      ILE   7  12.114   0.035  18.612
  617   HG22  ILE   7          HG22      ILE   7  12.062  -1.353  17.526
  618   HG23  ILE   7          HG23      ILE   7  11.505   0.225  16.969
  619   HD11  ILE   7          HD11      ILE   7  11.871  -1.005  15.094
  620   HD12  ILE   7          HD12      ILE   7  13.212  -2.043  15.578
  621   HD13  ILE   7          HD13      ILE   7  13.198  -1.307  13.975
  622    H    LEU   8           HN       LEU   8  13.658   3.042  15.730
  623    HA   LEU   8           HA       LEU   8  16.154   2.804  14.370
  624    HB2  LEU   8           HB2      LEU   8  14.003   3.394  13.256
  625    HB3  LEU   8           HB1      LEU   8  14.030   4.947  14.090
  626    HG   LEU   8           HG       LEU   8  16.585   4.473  12.843
  627   HD11  LEU   8          HD11      LEU   8  14.246   4.507  10.921
  628   HD12  LEU   8          HD12      LEU   8  15.124   3.038  11.341
  629   HD13  LEU   8          HD13      LEU   8  15.958   4.360  10.526
  630   HD21  LEU   8          HD21      LEU   8  15.902   6.617  11.667
  631   HD22  LEU   8          HD22      LEU   8  15.828   6.682  13.428
  632   HD23  LEU   8          HD23      LEU   8  14.347   6.484  12.490
  633    H    SER   9           HN       SER   9  14.799   5.049  16.721
  634    HA   SER   9           HA       SER   9  16.963   6.938  16.500
  635    HB2  SER   9           HB2      SER   9  15.898   8.061  18.367
  636    HB3  SER   9           HB1      SER   9  14.664   7.587  17.204
  637    HG   SER   9           HG       SER   9  14.152   7.064  19.410
  638    H    ILE  10           HN       ILE  10  16.132   4.194  18.542
  639    HA   ILE  10           HA       ILE  10  18.097   4.624  20.543
  640    HB   ILE  10           HB       ILE  10  16.675   2.134  19.591
  641   HG12  ILE  10          HG12      ILE  10  16.430   3.653  22.198
  642   HG13  ILE  10          HG11      ILE  10  15.438   4.027  20.794
  643   HG21  ILE  10          HG21      ILE  10  18.677   2.527  21.826
  644   HG22  ILE  10          HG22      ILE  10  18.732   1.343  20.521
  645   HG23  ILE  10          HG23      ILE  10  17.531   1.188  21.802
  646   HD11  ILE  10          HD11      ILE  10  14.278   2.457  22.314
  647   HD12  ILE  10          HD12      ILE  10  15.613   1.316  22.144
  648   HD13  ILE  10          HD13      ILE  10  14.603   1.706  20.750
  649    H    CYS  11           HN       CYS  11  18.123   2.739  17.509
  650    HA   CYS  11           HA       CYS  11  20.740   1.701  17.861
  651    HB2  CYS  11           HB2      CYS  11  19.103   0.729  16.299
  652    HB3  CYS  11           HB1      CYS  11  19.178   2.190  15.316
  653    HG   CYS  11           HG       CYS  11  21.086   1.085  14.189
  654    H    SER  12           HN       SER  12  19.531   4.404  15.826
  655    HA   SER  12           HA       SER  12  22.025   5.245  14.899
  656    HB2  SER  12           HB2      SER  12  19.860   6.032  13.995
  657    HB3  SER  12           HB1      SER  12  19.591   6.946  15.474
  658    HG   SER  12           HG       SER  12  21.750   7.250  13.650
  659    H    PHE  13           HN       PHE  13  20.242   6.138  17.828
  660    HA   PHE  13           HA       PHE  13  21.887   8.200  18.737
  661    HB2  PHE  13           HB2      PHE  13  19.747   7.727  19.785
  662    HB3  PHE  13           HB1      PHE  13  20.317   6.141  20.306
  663    HD1  PHE  13           HD1      PHE  13  21.279   9.762  20.526
  664    HD2  PHE  13           HD2      PHE  13  21.214   5.923  22.450
  665    HE1  PHE  13           HE1      PHE  13  22.221  10.779  22.583
  666    HE2  PHE  13           HE2      PHE  13  22.157   6.938  24.508
  667    HZ   PHE  13           HZ       PHE  13  22.660   9.366  24.573
  668    H    ILE  14           HN       ILE  14  22.078   4.695  19.379
  669    HA   ILE  14           HA       ILE  14  24.311   4.764  21.079
  670    HB   ILE  14           HB       ILE  14  23.322   2.648  19.160
  671   HG12  ILE  14          HG12      ILE  14  23.250   2.732  22.185
  672   HG13  ILE  14          HG11      ILE  14  21.942   3.368  21.186
  673   HG21  ILE  14          HG21      ILE  14  25.630   2.140  19.444
  674   HG22  ILE  14          HG22      ILE  14  24.792   1.131  20.621
  675   HG23  ILE  14          HG23      ILE  14  25.604   2.606  21.145
  676   HD11  ILE  14          HD11      ILE  14  21.311   1.126  21.688
  677   HD12  ILE  14          HD12      ILE  14  22.933   0.517  21.360
  678   HD13  ILE  14          HD13      ILE  14  21.917   1.076  20.032
  679    H    LEU  15           HN       LEU  15  24.101   4.497  17.536
  680    HA   LEU  15           HA       LEU  15  26.862   4.177  17.063
  681    HB2  LEU  15           HB2      LEU  15  24.513   5.016  15.445
  682    HB3  LEU  15           HB1      LEU  15  26.116   5.386  14.810
  683    HG   LEU  15           HG       LEU  15  25.429   2.633  15.838
  684   HD11  LEU  15          HD11      LEU  15  25.164   3.647  12.990
  685   HD12  LEU  15          HD12      LEU  15  23.809   3.272  14.054
  686   HD13  LEU  15          HD13      LEU  15  24.902   1.990  13.534
  687   HD21  LEU  15          HD21      LEU  15  27.793   3.074  15.549
  688   HD22  LEU  15          HD22      LEU  15  27.513   3.788  13.960
  689   HD23  LEU  15          HD23      LEU  15  27.271   2.058  14.205
  690    H    SER  16           HN       SER  16  24.884   7.131  16.726
  691    HA   SER  16           HA       SER  16  26.838   8.969  16.185
  692    HB2  SER  16           HB2      SER  16  25.382  10.653  17.221
  693    HB3  SER  16           HB1      SER  16  24.423   9.491  16.309
  694    HG   SER  16           HG       SER  16  23.944  10.119  18.693
  695    H    ALA  17           HN       ALA  17  25.910   7.729  19.377
  696    HA   ALA  17           HA       ALA  17  27.586   9.370  20.932
  697    HB1  ALA  17           HB1      ALA  17  26.688   6.523  21.466
  698    HB2  ALA  17           HB2      ALA  17  25.784   7.979  21.884
  699    HB3  ALA  17           HB3      ALA  17  27.328   7.645  22.668
  700    H    LEU  18           HN       LEU  18  28.134   6.120  19.569
  701    HA   LEU  18           HA       LEU  18  30.818   5.923  20.518
  702    HB2  LEU  18           HB2      LEU  18  29.051   4.371  18.708
  703    HB3  LEU  18           HB1      LEU  18  30.786   4.170  18.475
  704    HG   LEU  18           HG       LEU  18  29.707   2.564  20.132
  705   HD11  LEU  18          HD11      LEU  18  32.174   3.237  20.025
  706   HD12  LEU  18          HD12      LEU  18  31.613   2.579  21.561
  707   HD13  LEU  18          HD13      LEU  18  31.834   4.319  21.376
  708   HD21  LEU  18          HD21      LEU  18  29.731   4.948  21.998
  709   HD22  LEU  18          HD22      LEU  18  29.030   3.354  22.272
  710   HD23  LEU  18          HD23      LEU  18  28.274   4.463  21.127
  711    H    HIS  19           HN       HIS  19  29.371   7.553  17.873
  712    HA   HIS  19           HA       HIS  19  31.566   7.556  16.070
  713    HB2  HIS  19           HB2      HIS  19  29.109   8.145  15.600
  714    HB3  HIS  19           HB1      HIS  19  29.480   9.724  16.295
  715    HD2  HIS  19           HD2      HIS  19  31.891  10.928  14.905
  716    HE1  HIS  19           HE1      HIS  19  30.865   9.029  11.278
  717    HE2  HIS  19           HE2      HIS  19  32.295  10.845  12.328
  718    H    PHE  20           HN       PHE  20  30.303  10.153  18.202
  719    HA   PHE  20           HA       PHE  20  32.614  11.775  17.862
  720    HB2  PHE  20           HB2      PHE  20  30.136  11.857  19.465
  721    HB3  PHE  20           HB1      PHE  20  31.520  12.672  20.197
  722    HD1  PHE  20           HD1      PHE  20  29.046  12.759  17.518
  723    HD2  PHE  20           HD2      PHE  20  32.734  14.461  18.919
  724    HE1  PHE  20           HE1      PHE  20  28.758  14.669  15.957
  725    HE2  PHE  20           HE2      PHE  20  32.447  16.369  17.361
  726    HZ   PHE  20           HZ       PHE  20  30.469  16.475  15.870
  727    H    MET  21           HN       MET  21  31.789   9.145  19.997
  728    HA   MET  21           HA       MET  21  33.626   9.642  22.073
  729    HB2  MET  21           HB2      MET  21  31.875   7.957  22.275
  730    HB3  MET  21           HB1      MET  21  32.585   7.022  20.959
  731    HG2  MET  21           HG2      MET  21  34.541   6.530  22.246
  732    HG3  MET  21           HG1      MET  21  34.096   7.698  23.489
  733    HE1  MET  21           HE1      MET  21  33.798   4.567  25.512
  734    HE2  MET  21           HE2      MET  21  34.840   5.841  24.884
  735    HE3  MET  21           HE3      MET  21  34.712   4.311  24.019
  736    H    ALA  22           HN       ALA  22  33.946   7.648  19.137
  737    HA   ALA  22           HA       ALA  22  36.646   6.941  19.533
  738    HB1  ALA  22           HB1      ALA  22  34.915   7.107  17.068
  739    HB2  ALA  22           HB2      ALA  22  35.461   5.669  17.929
  740    HB3  ALA  22           HB3      ALA  22  36.608   6.618  16.987
  741    H    TRP  23           HN       TRP  23  35.097   9.699  17.975
  742    HA   TRP  23           HA       TRP  23  37.403  10.836  16.815
  743    HB2  TRP  23           HB2      TRP  23  34.735  11.873  17.677
  744    HB3  TRP  23           HB1      TRP  23  35.995  13.032  17.271
  745    HD1  TRP  23           HD1      TRP  23  36.215   9.831  15.352
  746    HE1  TRP  23           HE1      TRP  23  35.445  10.220  12.926
  747    HE3  TRP  23           HE3      TRP  23  34.142  14.479  15.809
  748    HZ2  TRP  23           HZ2      TRP  23  34.112  12.213  11.387
  749    HZ3  TRP  23           HZ3      TRP  23  33.124  15.595  13.844
  750    HH2  TRP  23           HH2      TRP  23  33.106  14.468  11.636
  751    H    THR  24           HN       THR  24  35.953  11.327  20.021
  752    HA   THR  24           HA       THR  24  37.694  13.300  20.937
  753    HB   THR  24           HB       THR  24  36.396  11.045  22.487
  754    HG1  THR  24           HG1      THR  24  34.720  12.153  21.866
  755   HG21  THR  24          HG21      THR  24  37.734  13.616  23.341
  756   HG22  THR  24          HG22      THR  24  38.090  11.975  23.879
  757   HG23  THR  24          HG23      THR  24  36.588  12.756  24.370
  758    H    ILE  25           HN       ILE  25  38.001   9.755  21.067
  759    HA   ILE  25           HA       ILE  25  40.495   9.766  22.446
  760    HB   ILE  25           HB       ILE  25  39.331   7.650  20.614
  761   HG12  ILE  25          HG12      ILE  25  37.749   8.151  22.379
  762   HG13  ILE  25          HG11      ILE  25  38.552   6.637  22.785
  763   HG21  ILE  25          HG21      ILE  25  40.760   6.109  21.898
  764   HG22  ILE  25          HG22      ILE  25  41.407   7.470  22.816
  765   HG23  ILE  25          HG23      ILE  25  41.729   7.339  21.087
  766   HD11  ILE  25          HD11      ILE  25  38.567   7.876  24.810
  767   HD12  ILE  25          HD12      ILE  25  39.000   9.373  23.984
  768   HD13  ILE  25          HD13      ILE  25  40.192   8.086  24.159
  769    H    GLY  26           HN       GLY  26  39.612   9.736  19.049
  770    HA2  GLY  26           HA2      GLY  26  42.175   9.306  17.964
  771    HA3  GLY  26           HA1      GLY  26  40.859  10.139  17.142
  772    H    HIS  27           HN       HIS  27  40.464  12.329  18.720
  773    HA   HIS  27           HA       HIS  27  42.488  14.105  17.891
  774    HB2  HIS  27           HB2      HIS  27  40.181  14.827  18.323
  775    HB3  HIS  27           HB1      HIS  27  40.390  14.488  20.041
  776    HD2  HIS  27           HD2      HIS  27  43.271  16.297  18.063
  777    HE1  HIS  27           HE1      HIS  27  41.539  19.086  20.717
  778    HE2  HIS  27           HE2      HIS  27  43.446  18.692  19.088
  779    H    LEU  28           HN       LEU  28  41.880  12.487  20.974
  780    HA   LEU  28           HA       LEU  28  44.052  13.837  22.324
  781    HB2  LEU  28           HB2      LEU  28  42.224  11.552  23.056
  782    HB3  LEU  28           HB1      LEU  28  43.553  12.066  24.093
  783    HG   LEU  28           HG       LEU  28  41.509  14.032  23.060
  784   HD11  LEU  28          HD11      LEU  28  41.428  12.511  25.686
  785   HD12  LEU  28          HD12      LEU  28  40.360  12.203  24.316
  786   HD13  LEU  28          HD13      LEU  28  40.288  13.750  25.159
  787   HD21  LEU  28          HD21      LEU  28  43.525  13.959  25.322
  788   HD22  LEU  28          HD22      LEU  28  42.268  15.191  25.203
  789   HD23  LEU  28          HD23      LEU  28  43.495  15.058  23.942
  790    H    ASN  29           HN       ASN  29  43.839  11.277  20.114
  791    HA   ASN  29           HA       ASN  29  45.347   9.723  19.366
  792    HB2  ASN  29           HB2      ASN  29  46.804  11.861  19.575
  793    HB3  ASN  29           HB1      ASN  29  47.462  11.082  21.014
  794   HD21  ASN  29          HD21      ASN  29  49.513  10.401  20.266
  795   HD22  ASN  29          HD22      ASN  29  49.737   9.386  18.926
  796    H    GLN  30           HN       GLN  30  43.846   9.127  21.711
  797    HA   GLN  30           HA       GLN  30  43.734   7.548  23.374
  798    HB2  GLN  30           HB2      GLN  30  46.330   6.548  22.182
  799    HB3  GLN  30           HB1      GLN  30  45.232   5.641  23.220
  800    HG2  GLN  30           HG2      GLN  30  43.446   5.879  21.522
  801    HG3  GLN  30           HG1      GLN  30  44.571   6.745  20.476
  802   HE21  GLN  30          HE21      GLN  30  46.813   5.372  20.287
  803   HE22  GLN  30          HE22      GLN  30  46.575   3.733  19.918
  804    H    ILE  31           HN       ILE  31  45.477  10.091  23.598
  805    HA   ILE  31           HA       ILE  31  46.722  11.114  25.220
  806    HB   ILE  31           HB       ILE  31  45.995   8.697  26.894
  807   HG12  ILE  31          HG12      ILE  31  44.538  11.351  26.665
  808   HG13  ILE  31          HG11      ILE  31  44.033   9.892  25.815
  809   HG21  ILE  31          HG21      ILE  31  47.002  11.485  27.508
  810   HG22  ILE  31          HG22      ILE  31  47.688   9.942  28.012
  811   HG23  ILE  31          HG23      ILE  31  46.178  10.506  28.722
  812   HD11  ILE  31          HD11      ILE  31  42.752   9.961  27.835
  813   HD12  ILE  31          HD12      ILE  31  44.180  10.325  28.803
  814   HD13  ILE  31          HD13      ILE  31  43.990   8.729  28.075
  815    H    LYS  32           HN       LYS  32  48.762  11.003  26.373
  816    HA   LYS  32           HA       LYS  32  50.949  10.368  26.604
  817    HB2  LYS  32           HB2      LYS  32  49.555   8.127  27.206
  818    HB3  LYS  32           HB1      LYS  32  50.464   7.554  25.809
  819    HG2  LYS  32           HG2      LYS  32  52.345   7.405  27.035
  820    HG3  LYS  32           HG1      LYS  32  52.199   9.084  27.549
  821    HD2  LYS  32           HD2      LYS  32  52.074   7.882  29.571
  822    HD3  LYS  32           HD1      LYS  32  50.384   8.202  29.181
  823    HE2  LYS  32           HE2      LYS  32  50.231   5.938  29.578
  824    HE3  LYS  32           HE1      LYS  32  50.656   5.883  27.866
  825    HZ1  LYS  32           HZ1      LYS  32  52.801   5.981  29.868
  826    HZ2  LYS  32           HZ2      LYS  32  52.800   5.285  28.317
  827    HZ3  LYS  32           HZ3      LYS  32  51.999   4.511  29.601
  828    H    ARG  33           HN       ARG  33  52.760   9.124  25.340
  829    HA   ARG  33           HA       ARG  33  52.761  10.188  22.691
  830    HB2  ARG  33           HB2      ARG  33  54.693   9.358  24.504
  831    HB3  ARG  33           HB1      ARG  33  54.801   8.170  23.205
  832    HG2  ARG  33           HG2      ARG  33  55.201   9.840  21.561
  833    HG3  ARG  33           HG1      ARG  33  54.688  11.137  22.641
  834    HD2  ARG  33           HD2      ARG  33  57.042  11.272  22.668
  835    HD3  ARG  33           HD1      ARG  33  56.658  10.403  24.148
  836    HE   ARG  33           HE       ARG  33  57.897   9.297  21.737
  837   HH11  ARG  33          HH11      ARG  33  56.475   8.700  24.882
  838   HH12  ARG  33          HH12      ARG  33  57.196   7.139  25.032
  839   HH21  ARG  33          HH21      ARG  33  58.804   7.247  21.979
  840   HH22  ARG  33          HH22      ARG  33  58.495   6.321  23.410
  841    H1   MET   1           HT1      MET   1   0.900  18.986  18.163
  842    H2   MET   1           HT2      MET   1   1.798  17.625  18.636
  843    H3   MET   1           HT3      MET   1   2.190  18.446  17.203
  844    HA   MET   1           HA       MET   1   2.995  20.316  18.353
  845    HB2  MET   1           HB2      MET   1   2.901  20.145  20.960
  846    HB3  MET   1           HB1      MET   1   1.459  20.673  20.094
  847    HG2  MET   1           HG2      MET   1   0.529  18.411  20.190
  848    HG3  MET   1           HG1      MET   1   2.000  17.814  20.959
  849    HE1  MET   1           HE1      MET   1   1.972  18.897  24.476
  850    HE2  MET   1           HE2      MET   1   2.905  19.650  23.185
  851    HE3  MET   1           HE3      MET   1   2.626  17.910  23.160
  852    H    PHE   2           HN       PHE   2   5.043  19.782  17.840
  853    HA   PHE   2           HA       PHE   2   7.132  18.840  17.961
  854    HB2  PHE   2           HB2      PHE   2   6.233  18.235  20.791
  855    HB3  PHE   2           HB1      PHE   2   7.890  18.102  20.204
  856    HD1  PHE   2           HD1      PHE   2   5.299  20.348  21.386
  857    HD2  PHE   2           HD2      PHE   2   9.052  20.156  19.305
  858    HE1  PHE   2           HE1      PHE   2   5.643  22.771  21.780
  859    HE2  PHE   2           HE2      PHE   2   9.396  22.579  19.700
  860    HZ   PHE   2           HZ       PHE   2   7.691  23.888  20.937
  861    H    GLU   3           HN       GLU   3   6.105  17.276  16.412
  862    HA   GLU   3           HA       GLU   3   5.266  14.722  17.335
  863    HB2  GLU   3           HB2      GLU   3   6.234  15.661  14.629
  864    HB3  GLU   3           HB1      GLU   3   5.609  14.041  14.939
  865    HG2  GLU   3           HG2      GLU   3   3.985  16.388  15.830
  866    HG3  GLU   3           HG1      GLU   3   3.995  15.978  14.117
  867    HA   PRO   4           HA       PRO   4   8.955  12.467  18.196
  868    HB2  PRO   4           HB2      PRO   4   8.120  10.495  16.114
  869    HB3  PRO   4           HB1      PRO   4   8.536  10.227  17.817
  870    HG2  PRO   4           HG2      PRO   4   6.015  10.161  16.983
  871    HG3  PRO   4           HG1      PRO   4   6.451  10.835  18.563
  872    HD2  PRO   4           HD2      PRO   4   5.640  12.258  16.065
  873    HD3  PRO   4           HD1      PRO   4   5.369  12.704  17.764
  874    H    PHE   5           HN       PHE   5   8.158  12.574  14.720
  875    HA   PHE   5           HA       PHE   5  10.829  12.196  13.816
  876    HB2  PHE   5           HB2      PHE   5   9.599  11.878  11.965
  877    HB3  PHE   5           HB1      PHE   5   8.224  12.747  12.648
  878    HD1  PHE   5           HD1      PHE   5  11.344  13.076  10.700
  879    HD2  PHE   5           HD2      PHE   5   7.918  15.134  12.279
  880    HE1  PHE   5           HE1      PHE   5  11.854  15.032   9.261
  881    HE2  PHE   5           HE2      PHE   5   8.430  17.089  10.842
  882    HZ   PHE   5           HZ       PHE   5  10.397  17.038   9.333
  883    H    GLN   6           HN       GLN   6   8.949  15.010  14.726
  884    HA   GLN   6           HA       GLN   6  10.573  17.014  13.583
  885    HB2  GLN   6           HB2      GLN   6   8.285  17.367  14.531
  886    HB3  GLN   6           HB1      GLN   6   8.975  17.191  16.146
  887    HG2  GLN   6           HG2      GLN   6   8.847  19.556  15.623
  888    HG3  GLN   6           HG1      GLN   6  10.543  19.074  15.622
  889   HE21  GLN   6          HE21      GLN   6  11.275  20.639  14.065
  890   HE22  GLN   6          HE22      GLN   6  10.760  20.623  12.448
  891    H    ILE   7           HN       ILE   7  10.619  15.523  16.796
  892    HA   ILE   7           HA       ILE   7  12.828  17.096  17.733
  893    HB   ILE   7           HB       ILE   7  12.607  15.973  19.737
  894   HG12  ILE   7          HG12      ILE   7  11.972  13.543  18.054
  895   HG13  ILE   7          HG11      ILE   7  13.369  13.803  19.087
  896   HG21  ILE   7          HG21      ILE   7  10.311  16.764  18.785
  897   HG22  ILE   7          HG22      ILE   7  10.307  15.702  20.194
  898   HG23  ILE   7          HG23      ILE   7   9.971  15.045  18.593
  899   HD11  ILE   7          HD11      ILE   7  10.513  13.266  19.905
  900   HD12  ILE   7          HD12      ILE   7  11.680  13.963  21.028
  901   HD13  ILE   7          HD13      ILE   7  11.964  12.365  20.339
  902    H    LEU   8           HN       LEU   8  12.512  14.099  15.989
  903    HA   LEU   8           HA       LEU   8  15.154  13.137  16.464
  904    HB2  LEU   8           HB2      LEU   8  13.251  11.701  15.737
  905    HB3  LEU   8           HB1      LEU   8  13.281  12.506  14.166
  906    HG   LEU   8           HG       LEU   8  15.947  11.670  14.876
  907   HD11  LEU   8          HD11      LEU   8  13.936   9.411  14.711
  908   HD12  LEU   8          HD12      LEU   8  14.613   9.986  16.234
  909   HD13  LEU   8          HD13      LEU   8  15.670   9.287  15.007
  910   HD21  LEU   8          HD21      LEU   8  15.629  10.371  12.717
  911   HD22  LEU   8          HD22      LEU   8  15.291  12.098  12.598
  912   HD23  LEU   8          HD23      LEU   8  13.961  10.944  12.706
  913    H    SER   9           HN       SER   9  13.651  15.218  14.053
  914    HA   SER   9           HA       SER   9  15.971  15.302  12.349
  915    HB2  SER   9           HB2      SER   9  14.734  16.961  11.091
  916    HB3  SER   9           HB1      SER   9  13.650  15.638  11.506
  917    HG   SER   9           HG       SER   9  12.777  17.750  11.919
  918    H    ILE  10           HN       ILE  10  14.621  17.235  14.962
  919    HA   ILE  10           HA       ILE  10  16.292  19.505  14.633
  920    HB   ILE  10           HB       ILE  10  14.830  18.389  17.028
  921   HG12  ILE  10          HG12      ILE  10  14.319  20.904  15.422
  922   HG13  ILE  10          HG11      ILE  10  13.588  19.357  15.009
  923   HG21  ILE  10          HG21      ILE  10  16.499  20.895  16.727
  924   HG22  ILE  10          HG22      ILE  10  16.649  19.636  17.951
  925   HG23  ILE  10          HG23      ILE  10  15.261  20.724  17.971
  926   HD11  ILE  10          HD11      ILE  10  12.082  20.703  16.440
  927   HD12  ILE  10          HD12      ILE  10  13.328  20.759  17.685
  928   HD13  ILE  10          HD13      ILE  10  12.580  19.221  17.255
  929    H    CYS  11           HN       CYS  11  16.619  16.535  16.597
  930    HA   CYS  11           HA       CYS  11  19.056  17.301  17.830
  931    HB2  CYS  11           HB2      CYS  11  17.597  15.525  18.713
  932    HB3  CYS  11           HB1      CYS  11  17.940  14.541  17.290
  933    HG   CYS  11           HG       CYS  11  19.904  13.737  18.566
  934    H    SER  12           HN       SER  12  18.396  15.060  15.097
  935    HA   SER  12           HA       SER  12  21.062  14.517  14.481
  936    HB2  SER  12           HB2      SER  12  19.131  13.278  13.553
  937    HB3  SER  12           HB1      SER  12  18.716  14.685  12.578
  938    HG   SER  12           HG       SER  12  21.141  13.201  12.495
  939    H    PHE  13           HN       PHE  13  18.936  17.126  13.368
  940    HA   PHE  13           HA       PHE  13  20.589  18.243  11.419
  941    HB2  PHE  13           HB2      PHE  13  18.285  18.960  11.692
  942    HB3  PHE  13           HB1      PHE  13  18.640  19.587  13.303
  943    HD1  PHE  13           HD1      PHE  13  19.850  19.891   9.764
  944    HD2  PHE  13           HD2      PHE  13  19.183  21.845  13.530
  945    HE1  PHE  13           HE1      PHE  13  20.552  22.050   8.767
  946    HE2  PHE  13           HE2      PHE  13  19.885  24.006  12.534
  947    HZ   PHE  13           HZ       PHE  13  20.570  24.108  10.152
  948    H    ILE  14           HN       ILE  14  20.394  18.955  14.908
  949    HA   ILE  14           HA       ILE  14  22.345  20.973  14.971
  950    HB   ILE  14           HB       ILE  14  21.483  18.963  17.054
  951   HG12  ILE  14          HG12      ILE  14  20.966  21.940  16.880
  952   HG13  ILE  14          HG11      ILE  14  19.880  20.745  16.171
  953   HG21  ILE  14          HG21      ILE  14  23.673  19.601  17.734
  954   HG22  ILE  14          HG22      ILE  14  22.587  20.654  18.640
  955   HG23  ILE  14          HG23      ILE  14  23.430  21.271  17.219
  956   HD11  ILE  14          HD11      ILE  14  18.998  21.179  18.341
  957   HD12  ILE  14          HD12      ILE  14  20.595  21.113  19.085
  958   HD13  ILE  14          HD13      ILE  14  19.840  19.637  18.485
  959    H    LEU  15           HN       LEU  15  22.651  17.440  15.311
  960    HA   LEU  15           HA       LEU  15  25.420  17.409  15.867
  961    HB2  LEU  15           HB2      LEU  15  23.417  15.438  14.894
  962    HB3  LEU  15           HB1      LEU  15  25.122  15.047  14.671
  963    HG   LEU  15           HG       LEU  15  24.063  16.005  17.330
  964   HD11  LEU  15          HD11      LEU  15  24.310  13.133  16.382
  965   HD12  LEU  15          HD12      LEU  15  22.785  13.987  16.616
  966   HD13  LEU  15          HD13      LEU  15  23.833  13.659  17.996
  967   HD21  LEU  15          HD21      LEU  15  26.471  16.070  17.082
  968   HD22  LEU  15          HD22      LEU  15  26.491  14.445  16.396
  969   HD23  LEU  15          HD23      LEU  15  26.075  14.680  18.093
  970    H    SER  16           HN       SER  16  23.754  16.739  12.782
  971    HA   SER  16           HA       SER  16  25.911  16.463  11.119
  972    HB2  SER  16           HB2      SER  16  24.464  17.242   9.292
  973    HB3  SER  16           HB1      SER  16  23.563  16.206  10.396
  974    HG   SER  16           HG       SER  16  22.769  18.474   9.672
  975    H    ALA  17           HN       ALA  17  24.418  19.496  12.187
  976    HA   ALA  17           HA       ALA  17  25.970  21.261  10.641
  977    HB1  ALA  17           HB1      ALA  17  24.773  21.698  13.393
  978    HB2  ALA  17           HB2      ALA  17  23.938  21.948  11.860
  979    HB3  ALA  17           HB3      ALA  17  25.313  22.965  12.292
  980    H    LEU  18           HN       LEU  18  26.449  20.048  13.960
  981    HA   LEU  18           HA       LEU  18  28.934  21.397  14.344
  982    HB2  LEU  18           HB2      LEU  18  27.339  19.360  15.800
  983    HB3  LEU  18           HB1      LEU  18  29.069  19.400  16.143
  984    HG   LEU  18           HG       LEU  18  27.624  20.895  17.614
  985   HD11  LEU  18          HD11      LEU  18  30.124  21.158  17.143
  986   HD12  LEU  18          HD12      LEU  18  29.285  22.601  17.709
  987   HD13  LEU  18          HD13      LEU  18  29.674  22.422  16.001
  988   HD21  LEU  18          HD21      LEU  18  27.560  22.707  15.190
  989   HD22  LEU  18          HD22      LEU  18  26.698  22.896  16.716
  990   HD23  LEU  18          HD23      LEU  18  26.215  21.635  15.584
  991    H    HIS  19           HN       HIS  19  28.042  18.536  12.681
  992    HA   HIS  19           HA       HIS  19  30.476  17.089  12.899
  993    HB2  HIS  19           HB2      HIS  19  28.175  16.244  12.131
  994    HB3  HIS  19           HB1      HIS  19  28.566  16.961  10.568
  995    HD2  HIS  19           HD2      HIS  19  31.253  15.934   9.604
  996    HE1  HIS  19           HE1      HIS  19  30.624  12.222  11.515
  997    HE2  HIS  19           HE2      HIS  19  32.029  13.449   9.790
  998    H    PHE  20           HN       PHE  20  29.123  18.964  10.155
  999    HA   PHE  20           HA       PHE  20  31.586  18.955   8.729
 1000    HB2  PHE  20           HB2      PHE  20  28.909  20.156   8.405
 1001    HB3  PHE  20           HB1      PHE  20  30.228  21.079   7.683
 1002    HD1  PHE  20           HD1      PHE  20  28.203  18.056   7.473
 1003    HD2  PHE  20           HD2      PHE  20  31.769  19.971   6.037
 1004    HE1  PHE  20           HE1      PHE  20  28.313  16.441   5.591
 1005    HE2  PHE  20           HE2      PHE  20  31.881  18.358   4.155
 1006    HZ   PHE  20           HZ       PHE  20  30.158  16.585   3.934
 1007    H    MET  21           HN       MET  21  30.236  20.978  11.224
 1008    HA   MET  21           HA       MET  21  31.773  23.302  10.816
 1009    HB2  MET  21           HB2      MET  21  29.877  23.263  12.350
 1010    HB3  MET  21           HB1      MET  21  30.696  22.085  13.375
 1011    HG2  MET  21           HG2      MET  21  32.388  23.661  13.987
 1012    HG3  MET  21           HG1      MET  21  31.864  24.804  12.750
 1013    HE1  MET  21           HE1      MET  21  31.008  26.810  15.786
 1014    HE2  MET  21           HE2      MET  21  32.238  26.319  14.625
 1015    HE3  MET  21           HE3      MET  21  32.104  25.472  16.164
 1016    H    ALA  22           HN       ALA  22  32.365  20.479  12.911
 1017    HA   ALA  22           HA       ALA  22  34.904  21.292  13.821
 1018    HB1  ALA  22           HB1      ALA  22  33.579  18.591  13.585
 1019    HB2  ALA  22           HB2      ALA  22  33.868  19.546  15.039
 1020    HB3  ALA  22           HB3      ALA  22  35.219  18.773  14.212
 1021    H    TRP  23           HN       TRP  23  33.842  19.473  10.994
 1022    HA   TRP  23           HA       TRP  23  36.381  18.661  10.074
 1023    HB2  TRP  23           HB2      TRP  23  33.707  19.092   8.809
 1024    HB3  TRP  23           HB1      TRP  23  35.106  18.863   7.764
 1025    HD1  TRP  23           HD1      TRP  23  35.349  17.049  11.023
 1026    HE1  TRP  23           HE1      TRP  23  34.998  14.528  10.635
 1027    HE3  TRP  23           HE3      TRP  23  33.618  17.116   6.216
 1028    HZ2  TRP  23           HZ2      TRP  23  34.079  12.773   8.588
 1029    HZ3  TRP  23           HZ3      TRP  23  33.006  15.005   5.072
 1030    HH2  TRP  23           HH2      TRP  23  33.236  12.831   6.253
 1031    H    THR  24           HN       THR  24  34.511  21.601   9.379
 1032    HA   THR  24           HA       THR  24  36.253  22.741   7.528
 1033    HB   THR  24           HB       THR  24  34.555  24.112   9.626
 1034    HG1  THR  24           HG1      THR  24  33.089  23.226   8.407
 1035   HG21  THR  24          HG21      THR  24  35.959  25.115   7.145
 1036   HG22  THR  24          HG22      THR  24  36.090  25.731   8.792
 1037   HG23  THR  24          HG23      THR  24  34.601  25.972   7.879
 1038    H    ILE  25           HN       ILE  25  36.244  22.968  11.080
 1039    HA   ILE  25           HA       ILE  25  38.495  24.713  11.229
 1040    HB   ILE  25           HB       ILE  25  37.447  22.760  13.296
 1041   HG12  ILE  25          HG12      ILE  25  35.667  24.257  12.621
 1042   HG13  ILE  25          HG11      ILE  25  36.272  24.804  14.181
 1043   HG21  ILE  25          HG21      ILE  25  38.535  24.271  14.907
 1044   HG22  ILE  25          HG22      ILE  25  39.149  25.253  13.578
 1045   HG23  ILE  25          HG23      ILE  25  39.713  23.594  13.783
 1046   HD11  ILE  25          HD11      ILE  25  36.086  26.787  12.891
 1047   HD12  ILE  25          HD12      ILE  25  36.760  26.011  11.456
 1048   HD13  ILE  25          HD13      ILE  25  37.800  26.387  12.829
 1049    H    GLY  26           HN       GLY  26  38.134  21.220  11.281
 1050    HA2  GLY  26           HA2      GLY  26  40.787  20.545  11.943
 1051    HA3  GLY  26           HA1      GLY  26  39.683  19.521  11.031
 1052    H    HIS  27           HN       HIS  27  39.235  20.984   8.771
 1053    HA   HIS  27           HA       HIS  27  41.500  20.447   7.186
 1054    HB2  HIS  27           HB2      HIS  27  39.223  20.510   6.273
 1055    HB3  HIS  27           HB1      HIS  27  39.141  22.246   6.579
 1056    HD2  HIS  27           HD2      HIS  27  42.425  20.700   5.057
 1057    HE1  HIS  27           HE1      HIS  27  40.550  23.021   2.070
 1058    HE2  HIS  27           HE2      HIS  27  42.641  21.703   2.655
 1059    H    LEU  28           HN       LEU  28  40.305  23.422   8.661
 1060    HA   LEU  28           HA       LEU  28  42.349  25.071   7.455
 1061    HB2  LEU  28           HB2      LEU  28  40.249  25.549   9.566
 1062    HB3  LEU  28           HB1      LEU  28  41.448  26.769   9.135
 1063    HG   LEU  28           HG       LEU  28  39.753  25.409   7.037
 1064   HD11  LEU  28          HD11      LEU  28  39.153  28.011   8.476
 1065   HD12  LEU  28          HD12      LEU  28  38.278  26.501   8.730
 1066   HD13  LEU  28          HD13      LEU  28  38.215  27.305   7.161
 1067   HD21  LEU  28          HD21      LEU  28  41.397  27.948   7.211
 1068   HD22  LEU  28          HD22      LEU  28  40.277  27.626   5.886
 1069   HD23  LEU  28          HD23      LEU  28  41.663  26.566   6.149
 1070    H    ASN  29           HN       ASN  29  42.256  22.902  10.062
 1071    HA   ASN  29           HA       ASN  29  43.735  22.412  11.742
 1072    HB2  ASN  29           HB2      ASN  29  45.314  22.806   9.721
 1073    HB3  ASN  29           HB1      ASN  29  45.683  24.340  10.509
 1074   HD21  ASN  29          HD21      ASN  29  47.762  23.920  11.364
 1075   HD22  ASN  29          HD22      ASN  29  48.099  22.645  12.433
 1076    H    GLN  30           HN       GLN  30  41.855  24.508  12.153
 1077    HA   GLN  30           HA       GLN  30  41.362  26.159  13.668
 1078    HB2  GLN  30           HB2      GLN  30  44.017  25.394  14.905
 1079    HB3  GLN  30           HB1      GLN  30  42.701  26.265  15.693
 1080    HG2  GLN  30           HG2      GLN  30  41.222  24.308  15.358
 1081    HG3  GLN  30           HG1      GLN  30  42.561  23.436  14.614
 1082   HE21  GLN  30          HE21      GLN  30  44.682  23.609  16.167
 1083   HE22  GLN  30          HE22      GLN  30  44.367  23.234  17.792
 1084    H    ILE  31           HN       ILE  31  43.256  26.605  11.265
 1085    HA   ILE  31           HA       ILE  31  44.323  28.382  10.299
 1086    HB   ILE  31           HB       ILE  31  43.156  29.963  12.604
 1087   HG12  ILE  31          HG12      ILE  31  41.974  29.476   9.849
 1088   HG13  ILE  31          HG11      ILE  31  41.485  28.579  11.286
 1089   HG21  ILE  31          HG21      ILE  31  44.286  30.680   9.889
 1090   HG22  ILE  31          HG22      ILE  31  44.761  31.307  11.468
 1091   HG23  ILE  31          HG23      ILE  31  43.213  31.770  10.765
 1092   HD11  ILE  31          HD11      ILE  31  39.923  30.379  11.061
 1093   HD12  ILE  31          HD12      ILE  31  41.215  31.548  10.788
 1094   HD13  ILE  31          HD13      ILE  31  41.006  30.823  12.381
 1095    H    LYS  32           HN       LYS  32  46.151  29.833  10.539
 1096    HA   LYS  32           HA       LYS  32  48.219  30.403  11.338
 1097    HB2  LYS  32           HB2      LYS  32  46.571  30.820  13.444
 1098    HB3  LYS  32           HB1      LYS  32  47.628  29.588  14.125
 1099    HG2  LYS  32           HG2      LYS  32  49.284  31.087  14.391
 1100    HG3  LYS  32           HG1      LYS  32  49.205  31.545  12.692
 1101    HD2  LYS  32           HD2      LYS  32  48.676  33.545  13.819
 1102    HD3  LYS  32           HD1      LYS  32  47.096  32.897  13.379
 1103    HE2  LYS  32           HE2      LYS  32  46.699  33.305  15.611
 1104    HE3  LYS  32           HE1      LYS  32  47.369  31.679  15.748
 1105    HZ1  LYS  32           HZ1      LYS  32  49.191  33.980  15.762
 1106    HZ2  LYS  32           HZ2      LYS  32  49.365  32.460  16.501
 1107    HZ3  LYS  32           HZ3      LYS  32  48.321  33.619  17.172
 1108    H    ARG  33           HN       ARG  33  50.089  29.449  12.757
 1109    HA   ARG  33           HA       ARG  33  50.577  26.815  11.772
 1110    HB2  ARG  33           HB2      ARG  33  52.140  28.913  12.700
 1111    HB3  ARG  33           HB1      ARG  33  52.344  27.664  13.928
 1112    HG2  ARG  33           HG2      ARG  33  53.124  26.075  12.341
 1113    HG3  ARG  33           HG1      ARG  33  52.562  27.045  10.978
 1114    HD2  ARG  33           HD2      ARG  33  54.888  27.430  11.029
 1115    HD3  ARG  33           HD1      ARG  33  54.213  28.845  11.824
 1116    HE   ARG  33           HE       ARG  33  55.709  26.669  13.089
 1117   HH11  ARG  33          HH11      ARG  33  53.782  29.568  13.487
 1118   HH12  ARG  33          HH12      ARG  33  54.341  29.849  15.097
 1119   HH21  ARG  33          HH21      ARG  33  56.397  27.078  15.198
 1120   HH22  ARG  33          HH22      ARG  33  55.799  28.459  16.058
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1  -0.837  11.628  -1.106
    2    H2   MET   1           HT2      MET   1  -1.399  10.861   0.302
    3    H3   MET   1           HT3      MET   1  -1.924  10.333  -1.225
    4    HA   MET   1           HA       MET   1  -0.088   9.021   0.023
    5    HB2  MET   1           HB2      MET   1   0.776   8.294  -2.124
    6    HB3  MET   1           HB1      MET   1  -0.940   8.654  -2.318
    7    HG2  MET   1           HG2      MET   1  -0.229  10.993  -3.059
    8    HG3  MET   1           HG1      MET   1   1.416  10.362  -3.145
    9    HE1  MET   1           HE1      MET   1  -0.279  10.788  -6.764
   10    HE2  MET   1           HE2      MET   1   1.183  11.214  -5.876
   11    HE3  MET   1           HE3      MET   1  -0.390  11.720  -5.265
   12    H    PHE   2           HN       PHE   2   0.373  11.958   0.483
   13    HA   PHE   2           HA       PHE   2   3.054  12.466  -0.468
   14    HB2  PHE   2           HB2      PHE   2   1.452  14.309  -0.136
   15    HB3  PHE   2           HB1      PHE   2   1.391  13.938   1.588
   16    HD1  PHE   2           HD1      PHE   2   3.786  14.806  -1.154
   17    HD2  PHE   2           HD2      PHE   2   2.957  14.888   3.061
   18    HE1  PHE   2           HE1      PHE   2   5.810  16.190  -0.783
   19    HE2  PHE   2           HE2      PHE   2   4.981  16.273   3.431
   20    HZ   PHE   2           HZ       PHE   2   6.407  16.925   1.510
   21    H    GLU   3           HN       GLU   3   4.912  11.998   0.531
   22    HA   GLU   3           HA       GLU   3   4.740  10.719   3.146
   23    HB2  GLU   3           HB2      GLU   3   6.914  10.649   1.076
   24    HB3  GLU   3           HB1      GLU   3   7.019   9.873   2.658
   25    HG2  GLU   3           HG2      GLU   3   4.934   8.607   2.138
   26    HG3  GLU   3           HG1      GLU   3   4.937   9.320   0.526
   27    HA   PRO   4           HA       PRO   4   6.597  14.587   4.610
   28    HB2  PRO   4           HB2      PRO   4   6.397  14.031   7.270
   29    HB3  PRO   4           HB1      PRO   4   5.023  14.574   6.291
   30    HG2  PRO   4           HG2      PRO   4   5.706  11.848   7.248
   31    HG3  PRO   4           HG1      PRO   4   4.123  12.615   7.048
   32    HD2  PRO   4           HD2      PRO   4   5.223  10.811   5.271
   33    HD3  PRO   4           HD1      PRO   4   3.961  11.991   4.857
   34    H    PHE   5           HN       PHE   5   7.495  11.397   5.895
   35    HA   PHE   5           HA       PHE   5  10.005  12.190   6.973
   36    HB2  PHE   5           HB2      PHE   5  10.350   9.940   7.433
   37    HB3  PHE   5           HB1      PHE   5   8.590  10.025   7.369
   38    HD1  PHE   5           HD1      PHE   5  11.580   8.648   5.858
   39    HD2  PHE   5           HD2      PHE   5   7.395   9.386   5.233
   40    HE1  PHE   5           HE1      PHE   5  11.567   7.004   4.002
   41    HE2  PHE   5           HE2      PHE   5   7.381   7.739   3.378
   42    HZ   PHE   5           HZ       PHE   5   9.469   6.550   2.762
   43    H    GLN   6           HN       GLN   6   8.971  11.981   3.779
   44    HA   GLN   6           HA       GLN   6  11.200  10.891   2.471
   45    HB2  GLN   6           HB2      GLN   6   8.924  11.402   1.474
   46    HB3  GLN   6           HB1      GLN   6   9.424  13.092   1.407
   47    HG2  GLN   6           HG2      GLN   6  10.188  12.476  -0.663
   48    HG3  GLN   6           HG1      GLN   6  11.586  11.944   0.270
   49   HE21  GLN   6          HE21      GLN   6  12.165  10.067  -0.927
   50   HE22  GLN   6          HE22      GLN   6  11.125   8.742  -1.139
   51    H    ILE   7           HN       ILE   7  10.546  14.071   3.805
   52    HA   ILE   7           HA       ILE   7  12.614  15.490   2.485
   53    HB   ILE   7           HB       ILE   7  12.247  17.205   4.116
   54   HG12  ILE   7          HG12      ILE   7  11.006  15.000   5.788
   55   HG13  ILE   7          HG11      ILE   7  12.463  15.911   6.161
   56   HG21  ILE   7          HG21      ILE   7   9.890  17.514   3.940
   57   HG22  ILE   7          HG22      ILE   7   9.588  15.776   3.905
   58   HG23  ILE   7          HG23      ILE   7  10.344  16.569   2.523
   59   HD11  ILE   7          HD11      ILE   7   9.613  16.889   6.145
   60   HD12  ILE   7          HD12      ILE   7  10.976  18.006   6.083
   61   HD13  ILE   7          HD13      ILE   7  10.777  16.932   7.467
   62    H    LEU   8           HN       LEU   8  12.548  13.488   5.402
   63    HA   LEU   8           HA       LEU   8  15.168  14.234   6.271
   64    HB2  LEU   8           HB2      LEU   8  13.347  13.363   7.770
   65    HB3  LEU   8           HB1      LEU   8  13.570  11.778   7.026
   66    HG   LEU   8           HG       LEU   8  16.032  11.971   7.651
   67   HD11  LEU   8          HD11      LEU   8  16.404  13.540   9.633
   68   HD12  LEU   8          HD12      LEU   8  14.890  14.321   9.178
   69   HD13  LEU   8          HD13      LEU   8  16.252  14.319   8.057
   70   HD21  LEU   8          HD21      LEU   8  14.513  10.538   8.916
   71   HD22  LEU   8          HD22      LEU   8  13.932  11.923   9.841
   72   HD23  LEU   8          HD23      LEU   8  15.593  11.366  10.038
   73    H    SER   9           HN       SER   9  13.789  11.746   4.242
   74    HA   SER   9           HA       SER   9  16.161  10.119   4.135
   75    HB2  SER   9           HB2      SER   9  13.945   9.162   3.702
   76    HB3  SER   9           HB1      SER   9  13.766  10.200   2.291
   77    HG   SER   9           HG       SER   9  14.551   8.265   1.567
   78    H    ILE  10           HN       ILE  10  14.683  12.548   2.019
   79    HA   ILE  10           HA       ILE  10  16.589  12.367  -0.060
   80    HB   ILE  10           HB       ILE  10  14.698  14.565   0.786
   81   HG12  ILE  10          HG12      ILE  10  13.944  12.302  -0.246
   82   HG13  ILE  10          HG11      ILE  10  13.335  13.783  -0.985
   83   HG21  ILE  10          HG21      ILE  10  16.691  14.459  -1.499
   84   HG22  ILE  10          HG22      ILE  10  16.464  15.734  -0.307
   85   HG23  ILE  10          HG23      ILE  10  15.249  15.476  -1.556
   86   HD11  ILE  10          HD11      ILE  10  14.356  11.896  -2.515
   87   HD12  ILE  10          HD12      ILE  10  15.902  12.580  -2.015
   88   HD13  ILE  10          HD13      ILE  10  14.718  13.585  -2.852
   89    H    CYS  11           HN       CYS  11  16.375  14.424   2.836
   90    HA   CYS  11           HA       CYS  11  18.620  16.038   2.239
   91    HB2  CYS  11           HB2      CYS  11  17.245  15.294   4.820
   92    HB3  CYS  11           HB1      CYS  11  18.611  16.408   4.762
   93    HG   CYS  11           HG       CYS  11  17.133  17.909   3.102
   94    H    SER  12           HN       SER  12  18.312  13.150   4.342
   95    HA   SER  12           HA       SER  12  21.001  12.982   5.084
   96    HB2  SER  12           HB2      SER  12  20.504  10.637   5.617
   97    HB3  SER  12           HB1      SER  12  19.187  11.681   6.143
   98    HG   SER  12           HG       SER  12  18.944   9.610   4.652
   99    H    PHE  13           HN       PHE  13  19.291  11.685   2.261
  100    HA   PHE  13           HA       PHE  13  21.374  10.116   1.219
  101    HB2  PHE  13           HB2      PHE  13  19.005  10.075   0.432
  102    HB3  PHE  13           HB1      PHE  13  19.271  11.637  -0.339
  103    HD1  PHE  13           HD1      PHE  13  19.923   8.042  -0.491
  104    HD2  PHE  13           HD2      PHE  13  20.879  11.857  -2.221
  105    HE1  PHE  13           HE1      PHE  13  20.905   6.903  -2.461
  106    HE2  PHE  13           HE2      PHE  13  21.861  10.716  -4.192
  107    HZ   PHE  13           HZ       PHE  13  21.873   8.239  -4.313
  108    H    ILE  14           HN       ILE  14  20.521  13.529   0.657
  109    HA   ILE  14           HA       ILE  14  22.531  14.062  -1.252
  110    HB   ILE  14           HB       ILE  14  21.083  15.868   0.696
  111   HG12  ILE  14          HG12      ILE  14  20.783  15.578  -2.305
  112   HG13  ILE  14          HG11      ILE  14  19.815  14.653  -1.157
  113   HG21  ILE  14          HG21      ILE  14  22.925  16.550  -1.617
  114   HG22  ILE  14          HG22      ILE  14  23.202  16.925   0.084
  115   HG23  ILE  14          HG23      ILE  14  21.890  17.711  -0.789
  116   HD11  ILE  14          HD11      ILE  14  19.951  17.676  -1.368
  117   HD12  ILE  14          HD12      ILE  14  19.064  16.798  -0.122
  118   HD13  ILE  14          HD13      ILE  14  18.583  16.655  -1.812
  119    H    LEU  15           HN       LEU  15  22.463  14.553   2.282
  120    HA   LEU  15           HA       LEU  15  25.072  15.621   2.479
  121    HB2  LEU  15           HB2      LEU  15  23.299  14.216   4.488
  122    HB3  LEU  15           HB1      LEU  15  24.851  14.945   4.902
  123    HG   LEU  15           HG       LEU  15  22.649  16.483   3.509
  124   HD11  LEU  15          HD11      LEU  15  22.083  17.416   5.707
  125   HD12  LEU  15          HD12      LEU  15  23.289  16.382   6.475
  126   HD13  LEU  15          HD13      LEU  15  21.864  15.665   5.722
  127   HD21  LEU  15          HD21      LEU  15  25.248  17.186   4.900
  128   HD22  LEU  15          HD22      LEU  15  23.997  18.393   4.601
  129   HD23  LEU  15          HD23      LEU  15  24.761  17.560   3.246
  130    H    SER  16           HN       SER  16  23.864  12.382   2.211
  131    HA   SER  16           HA       SER  16  26.165  11.040   3.236
  132    HB2  SER  16           HB2      SER  16  24.022   9.901   3.141
  133    HB3  SER  16           HB1      SER  16  23.965  10.085   1.390
  134    HG   SER  16           HG       SER  16  25.539   8.412   2.988
  135    H    ALA  17           HN       ALA  17  25.052  11.894  -0.025
  136    HA   ALA  17           HA       ALA  17  27.267  10.688  -1.367
  137    HB1  ALA  17           HB1      ALA  17  26.438  11.826  -3.343
  138    HB2  ALA  17           HB2      ALA  17  25.435  12.885  -2.353
  139    HB3  ALA  17           HB3      ALA  17  25.070  11.162  -2.448
  140    H    LEU  18           HN       LEU  18  26.663  13.826   0.074
  141    HA   LEU  18           HA       LEU  18  28.911  15.109  -1.193
  142    HB2  LEU  18           HB2      LEU  18  26.769  15.851   0.685
  143    HB3  LEU  18           HB1      LEU  18  28.303  16.679   0.954
  144    HG   LEU  18           HG       LEU  18  28.345  17.231  -1.507
  145   HD11  LEU  18          HD11      LEU  18  26.264  17.000  -2.772
  146   HD12  LEU  18          HD12      LEU  18  25.471  16.270  -1.377
  147   HD13  LEU  18          HD13      LEU  18  26.780  15.416  -2.194
  148   HD21  LEU  18          HD21      LEU  18  25.944  18.212   0.072
  149   HD22  LEU  18          HD22      LEU  18  26.659  19.031  -1.317
  150   HD23  LEU  18          HD23      LEU  18  27.579  18.866   0.179
  151    H    HIS  19           HN       HIS  19  28.288  13.398   1.814
  152    HA   HIS  19           HA       HIS  19  30.641  14.209   3.183
  153    HB2  HIS  19           HB2      HIS  19  28.680  13.233   4.322
  154    HB3  HIS  19           HB1      HIS  19  29.004  11.691   3.526
  155    HD2  HIS  19           HD2      HIS  19  30.623  10.077   5.060
  156    HE1  HIS  19           HE1      HIS  19  32.523  13.089   7.326
  157    HE2  HIS  19           HE2      HIS  19  32.328  10.583   6.971
  158    H    PHE  20           HN       PHE  20  29.819  11.346   1.235
  159    HA   PHE  20           HA       PHE  20  32.433  10.180   1.456
  160    HB2  PHE  20           HB2      PHE  20  29.911   9.560   0.124
  161    HB3  PHE  20           HB1      PHE  20  31.320   9.128  -0.843
  162    HD1  PHE  20           HD1      PHE  20  29.840   8.779   2.572
  163    HD2  PHE  20           HD2      PHE  20  32.612   7.228  -0.318
  164    HE1  PHE  20           HE1      PHE  20  30.229   6.797   4.010
  165    HE2  PHE  20           HE2      PHE  20  33.001   5.244   1.118
  166    HZ   PHE  20           HZ       PHE  20  31.817   5.030   3.287
  167    H    MET  21           HN       MET  21  30.930  12.531  -0.657
  168    HA   MET  21           HA       MET  21  32.714  12.389  -2.843
  169    HB2  MET  21           HB2      MET  21  30.813  14.389  -1.735
  170    HB3  MET  21           HB1      MET  21  32.049  14.994  -2.841
  171    HG2  MET  21           HG2      MET  21  30.423  12.546  -3.517
  172    HG3  MET  21           HG1      MET  21  29.821  14.164  -3.874
  173    HE1  MET  21           HE1      MET  21  30.420  15.614  -5.383
  174    HE2  MET  21           HE2      MET  21  31.611  15.510  -6.676
  175    HE3  MET  21           HE3      MET  21  32.119  15.985  -5.057
  176    H    ALA  22           HN       ALA  22  32.727  14.618  -0.028
  177    HA   ALA  22           HA       ALA  22  35.230  15.800  -0.637
  178    HB1  ALA  22           HB1      ALA  22  35.044  16.887   1.416
  179    HB2  ALA  22           HB2      ALA  22  34.221  15.525   2.175
  180    HB3  ALA  22           HB3      ALA  22  33.359  16.544   1.023
  181    H    TRP  23           HN       TRP  23  34.308  13.014   1.358
  182    HA   TRP  23           HA       TRP  23  36.797  12.507   2.548
  183    HB2  TRP  23           HB2      TRP  23  34.276  11.175   2.281
  184    HB3  TRP  23           HB1      TRP  23  35.568  10.018   1.957
  185    HD1  TRP  23           HD1      TRP  23  34.352  12.456   4.664
  186    HE1  TRP  23           HE1      TRP  23  35.360  11.725   6.924
  187    HE3  TRP  23           HE3      TRP  23  37.436   8.697   3.091
  188    HZ2  TRP  23           HZ2      TRP  23  37.223   9.802   7.932
  189    HZ3  TRP  23           HZ3      TRP  23  38.813   7.431   4.716
  190    HH2  TRP  23           HH2      TRP  23  38.710   7.981   7.136
  191    H    THR  24           HN       THR  24  35.432  11.250  -0.497
  192    HA   THR  24           HA       THR  24  37.543   9.617  -1.272
  193    HB   THR  24           HB       THR  24  35.746  11.311  -3.028
  194    HG1  THR  24           HG1      THR  24  34.338   9.976  -2.241
  195   HG21  THR  24          HG21      THR  24  37.663  10.509  -4.285
  196   HG22  THR  24          HG22      THR  24  36.257   9.539  -4.723
  197   HG23  THR  24          HG23      THR  24  37.467   8.888  -3.617
  198    H    ILE  25           HN       ILE  25  37.029  13.092  -1.892
  199    HA   ILE  25           HA       ILE  25  39.400  13.468  -3.412
  200    HB   ILE  25           HB       ILE  25  37.706  15.375  -1.798
  201   HG12  ILE  25          HG12      ILE  25  38.050  15.099  -4.796
  202   HG13  ILE  25          HG11      ILE  25  36.800  14.235  -3.896
  203   HG21  ILE  25          HG21      ILE  25  38.941  17.133  -3.157
  204   HG22  ILE  25          HG22      ILE  25  40.114  15.879  -3.564
  205   HG23  ILE  25          HG23      ILE  25  39.889  16.366  -1.882
  206   HD11  ILE  25          HD11      ILE  25  35.920  16.348  -4.824
  207   HD12  ILE  25          HD12      ILE  25  37.163  17.246  -3.952
  208   HD13  ILE  25          HD13      ILE  25  35.913  16.379  -3.060
  209    H    GLY  26           HN       GLY  26  38.711  13.732   0.027
  210    HA2  GLY  26           HA2      GLY  26  41.149  14.854   0.869
  211    HA3  GLY  26           HA1      GLY  26  40.101  13.859   1.877
  212    H    HIS  27           HN       HIS  27  40.168  11.441   0.612
  213    HA   HIS  27           HA       HIS  27  42.608  10.339   1.498
  214    HB2  HIS  27           HB2      HIS  27  40.370   9.154   1.247
  215    HB3  HIS  27           HB1      HIS  27  40.736   9.034  -0.476
  216    HD2  HIS  27           HD2      HIS  27  41.592   7.197   2.793
  217    HE1  HIS  27           HE1      HIS  27  44.301   5.779  -0.115
  218    HE2  HIS  27           HE2      HIS  27  43.400   5.400   2.228
  219    H    LEU  28           HN       LEU  28  41.457  11.297  -1.700
  220    HA   LEU  28           HA       LEU  28  43.646  10.212  -3.160
  221    HB2  LEU  28           HB2      LEU  28  41.376  12.033  -3.693
  222    HB3  LEU  28           HB1      LEU  28  42.789  12.274  -4.719
  223    HG   LEU  28           HG       LEU  28  41.071  10.597  -5.579
  224   HD11  LEU  28          HD11      LEU  28  43.509  10.717  -6.259
  225   HD12  LEU  28          HD12      LEU  28  42.771   9.127  -6.443
  226   HD13  LEU  28          HD13      LEU  28  43.830   9.451  -5.075
  227   HD21  LEU  28          HD21      LEU  28  40.851   9.611  -3.154
  228   HD22  LEU  28          HD22      LEU  28  42.285   8.684  -3.575
  229   HD23  LEU  28          HD23      LEU  28  40.810   8.507  -4.523
  230    H    ASN  29           HN       ASN  29  43.070  13.319  -1.626
  231    HA   ASN  29           HA       ASN  29  44.521  15.006  -1.065
  232    HB2  ASN  29           HB2      ASN  29  46.064  12.641  -0.972
  233    HB3  ASN  29           HB1      ASN  29  47.040  13.839  -1.820
  234   HD21  ASN  29          HD21      ASN  29  46.124  12.776   1.278
  235   HD22  ASN  29          HD22      ASN  29  46.605  14.147   2.154
  236    H    GLN  30           HN       GLN  30  44.665  16.746  -2.288
  237    HA   GLN  30           HA       GLN  30  45.298  16.489  -5.133
  238    HB2  GLN  30           HB2      GLN  30  44.656  18.932  -5.180
  239    HB3  GLN  30           HB1      GLN  30  43.369  17.833  -4.683
  240    HG2  GLN  30           HG2      GLN  30  45.061  18.800  -2.472
  241    HG3  GLN  30           HG1      GLN  30  44.128  20.061  -3.275
  242   HE21  GLN  30          HE21      GLN  30  42.391  20.376  -1.834
  243   HE22  GLN  30          HE22      GLN  30  41.357  19.136  -1.310
  244    H    ILE  31           HN       ILE  31  47.404  16.106  -3.172
  245    HA   ILE  31           HA       ILE  31  49.611  16.660  -2.914
  246    HB   ILE  31           HB       ILE  31  49.112  18.550  -5.235
  247   HG12  ILE  31          HG12      ILE  31  50.263  15.763  -5.294
  248   HG13  ILE  31          HG11      ILE  31  48.559  16.097  -5.605
  249   HG21  ILE  31          HG21      ILE  31  51.490  18.508  -5.538
  250   HG22  ILE  31          HG22      ILE  31  51.684  17.307  -4.263
  251   HG23  ILE  31          HG23      ILE  31  51.182  18.947  -3.859
  252   HD11  ILE  31          HD11      ILE  31  49.831  16.010  -7.715
  253   HD12  ILE  31          HD12      ILE  31  50.888  17.295  -7.131
  254   HD13  ILE  31          HD13      ILE  31  49.182  17.625  -7.434
  255    H    LYS  32           HN       LYS  32  48.623  19.868  -4.059
  256    HA   LYS  32           HA       LYS  32  48.363  20.955  -1.436
  257    HB2  LYS  32           HB2      LYS  32  50.974  20.782  -2.530
  258    HB3  LYS  32           HB1      LYS  32  50.492  22.474  -2.629
  259    HG2  LYS  32           HG2      LYS  32  49.611  21.790  -0.112
  260    HG3  LYS  32           HG1      LYS  32  51.083  20.831  -0.261
  261    HD2  LYS  32           HD2      LYS  32  52.287  22.902  -0.978
  262    HD3  LYS  32           HD1      LYS  32  50.811  23.818  -0.667
  263    HE2  LYS  32           HE2      LYS  32  50.932  22.645   1.690
  264    HE3  LYS  32           HE1      LYS  32  52.636  22.455   1.285
  265    HZ1  LYS  32           HZ1      LYS  32  52.935  24.546   1.901
  266    HZ2  LYS  32           HZ2      LYS  32  51.272  24.766   2.159
  267    HZ3  LYS  32           HZ3      LYS  32  51.944  25.069   0.628
  268    H    ARG  33           HN       ARG  33  46.955  20.822  -4.030
  269    HA   ARG  33           HA       ARG  33  45.702  22.184  -5.394
  270    HB2  ARG  33           HB2      ARG  33  44.980  23.009  -3.145
  271    HB3  ARG  33           HB1      ARG  33  46.219  24.260  -3.255
  272    HG2  ARG  33           HG2      ARG  33  45.183  25.250  -5.169
  273    HG3  ARG  33           HG1      ARG  33  44.091  23.879  -5.372
  274    HD2  ARG  33           HD2      ARG  33  43.064  24.410  -3.166
  275    HD3  ARG  33           HD1      ARG  33  44.109  25.820  -3.042
  276    HE   ARG  33           HE       ARG  33  41.764  25.549  -4.727
  277   HH11  ARG  33          HH11      ARG  33  44.776  27.217  -4.154
  278   HH12  ARG  33          HH12      ARG  33  44.292  28.631  -5.017
  279   HH21  ARG  33          HH21      ARG  33  41.160  27.419  -5.861
  280   HH22  ARG  33          HH22      ARG  33  42.263  28.748  -5.981
  281    H1   MET   1           HT1      MET   1   1.358  -4.812   5.534
  282    H2   MET   1           HT2      MET   1   0.509  -3.543   6.281
  283    H3   MET   1           HT3      MET   1   0.188  -5.153   6.716
  284    HA   MET   1           HA       MET   1   1.682  -3.680   8.224
  285    HB2  MET   1           HB2      MET   1   2.788  -5.694   8.995
  286    HB3  MET   1           HB1      MET   1   1.165  -6.133   8.463
  287    HG2  MET   1           HG2      MET   1   2.202  -6.680   6.192
  288    HG3  MET   1           HG1      MET   1   3.772  -6.540   6.985
  289    HE1  MET   1           HE1      MET   1   2.707 -10.359   6.328
  290    HE2  MET   1           HE2      MET   1   4.035  -9.234   6.053
  291    HE3  MET   1           HE3      MET   1   2.434  -8.869   5.415
  292    H    PHE   2           HN       PHE   2   2.337  -3.073   5.346
  293    HA   PHE   2           HA       PHE   2   5.165  -3.590   5.084
  294    HB2  PHE   2           HB2      PHE   2   3.711  -3.447   3.101
  295    HB3  PHE   2           HB1      PHE   2   3.349  -1.767   3.494
  296    HD1  PHE   2           HD1      PHE   2   6.208  -4.083   2.809
  297    HD2  PHE   2           HD2      PHE   2   4.754  -0.042   2.730
  298    HE1  PHE   2           HE1      PHE   2   8.268  -3.365   1.631
  299    HE2  PHE   2           HE2      PHE   2   6.815   0.677   1.552
  300    HZ   PHE   2           HZ       PHE   2   8.572  -0.984   1.004
  301    H    GLU   3           HN       GLU   3   6.798  -2.339   5.746
  302    HA   GLU   3           HA       GLU   3   6.110   0.178   7.044
  303    HB2  GLU   3           HB2      GLU   3   8.561  -1.538   7.287
  304    HB3  GLU   3           HB1      GLU   3   8.349   0.017   8.095
  305    HG2  GLU   3           HG2      GLU   3   6.268  -0.851   9.153
  306    HG3  GLU   3           HG1      GLU   3   6.576  -2.421   8.411
  307    HA   PRO   4           HA       PRO   4   8.067   2.031   3.401
  308    HB2  PRO   4           HB2      PRO   4   7.420   4.613   3.989
  309    HB3  PRO   4           HB1      PRO   4   6.263   3.459   3.300
  310    HG2  PRO   4           HG2      PRO   4   6.544   4.421   6.093
  311    HG3  PRO   4           HG1      PRO   4   5.087   4.005   5.180
  312    HD2  PRO   4           HD2      PRO   4   6.288   2.361   7.050
  313    HD3  PRO   4           HD1      PRO   4   5.207   1.801   5.757
  314    H    PHE   5           HN       PHE   5   8.473   3.329   6.687
  315    HA   PHE   5           HA       PHE   5  10.851   4.795   6.149
  316    HB2  PHE   5           HB2      PHE   5  10.921   5.230   8.429
  317    HB3  PHE   5           HB1      PHE   5   9.206   4.912   8.177
  318    HD1  PHE   5           HD1      PHE   5  12.244   3.823   9.814
  319    HD2  PHE   5           HD2      PHE   5   8.295   2.598   8.656
  320    HE1  PHE   5           HE1      PHE   5  12.359   1.937  11.419
  321    HE2  PHE   5           HE2      PHE   5   8.409   0.712  10.263
  322    HZ   PHE   5           HZ       PHE   5  10.442   0.381  11.644
  323    H    GLN   6           HN       GLN   6  10.299   1.478   6.208
  324    HA   GLN   6           HA       GLN   6  12.594   0.483   7.478
  325    HB2  GLN   6           HB2      GLN   6  10.552  -0.826   6.728
  326    HB3  GLN   6           HB1      GLN   6  11.212  -0.760   5.093
  327    HG2  GLN   6           HG2      GLN   6  12.219  -2.713   5.744
  328    HG3  GLN   6           HG1      GLN   6  13.405  -1.600   6.423
  329   HE21  GLN   6          HE21      GLN   6  13.985  -2.755   8.326
  330   HE22  GLN   6          HE22      GLN   6  12.872  -3.161   9.542
  331    H    ILE   7           HN       ILE   7  12.033   1.803   4.269
  332    HA   ILE   7           HA       ILE   7  14.402   0.858   3.033
  333    HB   ILE   7           HB       ILE   7  13.950   2.474   1.322
  334   HG12  ILE   7          HG12      ILE   7  12.265   3.861   3.428
  335   HG13  ILE   7          HG11      ILE   7  13.728   4.481   2.674
  336   HG21  ILE   7          HG21      ILE   7  11.685   1.953   0.785
  337   HG22  ILE   7          HG22      ILE   7  11.235   1.812   2.485
  338   HG23  ILE   7          HG23      ILE   7  12.266   0.590   1.740
  339   HD11  ILE   7          HD11      ILE   7  11.017   4.072   1.420
  340   HD12  ILE   7          HD12      ILE   7  12.474   4.251   0.440
  341   HD13  ILE   7          HD13      ILE   7  11.968   5.555   1.516
  342    H    LEU   8           HN       LEU   8  13.712   3.669   5.074
  343    HA   LEU   8           HA       LEU   8  16.225   4.940   4.593
  344    HB2  LEU   8           HB2      LEU   8  14.128   6.122   5.315
  345    HB3  LEU   8           HB1      LEU   8  14.316   5.367   6.898
  346    HG   LEU   8           HG       LEU   8  16.663   6.360   6.952
  347   HD11  LEU   8          HD11      LEU   8  16.870   8.424   5.463
  348   HD12  LEU   8          HD12      LEU   8  15.520   7.775   4.533
  349   HD13  LEU   8          HD13      LEU   8  17.030   6.871   4.642
  350   HD21  LEU   8          HD21      LEU   8  14.852   7.338   8.261
  351   HD22  LEU   8          HD22      LEU   8  14.253   8.204   6.845
  352   HD23  LEU   8          HD23      LEU   8  15.812   8.637   7.551
  353    H    SER   9           HN       SER   9  14.952   2.652   6.905
  354    HA   SER   9           HA       SER   9  17.154   2.847   8.746
  355    HB2  SER   9           HB2      SER   9  14.955   2.057   9.484
  356    HB3  SER   9           HB1      SER   9  15.081   0.672   8.404
  357    HG   SER   9           HG       SER   9  15.785   0.015  10.398
  358    H    ILE  10           HN       ILE  10  16.242   0.611   6.153
  359    HA   ILE  10           HA       ILE  10  18.419  -1.160   6.473
  360    HB   ILE  10           HB       ILE  10  16.631  -0.536   4.119
  361   HG12  ILE  10          HG12      ILE  10  15.834  -1.739   6.280
  362   HG13  ILE  10          HG11      ILE  10  15.486  -2.515   4.735
  363   HG21  ILE  10          HG21      ILE  10  18.928  -2.501   4.377
  364   HG22  ILE  10          HG22      ILE  10  18.640  -1.319   3.104
  365   HG23  ILE  10          HG23      ILE  10  17.610  -2.744   3.227
  366   HD11  ILE  10          HD11      ILE  10  16.546  -3.930   6.691
  367   HD12  ILE  10          HD12      ILE  10  18.055  -3.186   6.167
  368   HD13  ILE  10          HD13      ILE  10  17.111  -4.160   5.041
  369    H    CYS  11           HN       CYS  11  17.953   1.734   4.459
  370    HA   CYS  11           HA       CYS  11  20.399   1.538   3.053
  371    HB2  CYS  11           HB2      CYS  11  18.582   3.855   3.712
  372    HB3  CYS  11           HB1      CYS  11  20.040   4.045   2.738
  373    HG   CYS  11           HG       CYS  11  18.979   2.218   1.075
  374    H    SER  12           HN       SER  12  19.516   3.475   5.937
  375    HA   SER  12           HA       SER  12  22.038   4.606   6.372
  376    HB2  SER  12           HB2      SER  12  21.256   4.989   8.666
  377    HB3  SER  12           HB1      SER  12  19.969   5.336   7.514
  378    HG   SER  12           HG       SER  12  19.762   3.781   9.529
  379    H    PHE  13           HN       PHE  13  20.660   1.519   7.456
  380    HA   PHE  13           HA       PHE  13  22.727   0.750   9.192
  381    HB2  PHE  13           HB2      PHE  13  20.510  -0.382   8.997
  382    HB3  PHE  13           HB1      PHE  13  21.028  -1.055   7.451
  383    HD1  PHE  13           HD1      PHE  13  21.368  -1.225  11.088
  384    HD2  PHE  13           HD2      PHE  13  22.917  -2.667   7.349
  385    HE1  PHE  13           HE1      PHE  13  22.530  -3.064  12.278
  386    HE2  PHE  13           HE2      PHE  13  24.078  -4.507   8.540
  387    HZ   PHE  13           HZ       PHE  13  23.884  -4.706  11.005
  388    H    ILE  14           HN       ILE  14  22.278   0.168   5.708
  389    HA   ILE  14           HA       ILE  14  24.597  -1.396   5.330
  390    HB   ILE  14           HB       ILE  14  23.038   0.371   3.431
  391   HG12  ILE  14          HG12      ILE  14  23.178  -2.649   3.634
  392   HG13  ILE  14          HG11      ILE  14  21.965  -1.691   4.483
  393   HG21  ILE  14          HG21      ILE  14  25.270  -1.612   2.884
  394   HG22  ILE  14          HG22      ILE  14  25.312   0.122   2.565
  395   HG23  ILE  14          HG23      ILE  14  24.229  -0.917   1.645
  396   HD11  ILE  14          HD11      ILE  14  22.409  -1.778   1.485
  397   HD12  ILE  14          HD12      ILE  14  21.262  -0.712   2.297
  398   HD13  ILE  14          HD13      ILE  14  21.037  -2.460   2.360
  399    H    LEU  15           HN       LEU  15  24.037   2.098   4.904
  400    HA   LEU  15           HA       LEU  15  26.673   2.722   4.091
  401    HB2  LEU  15           HB2      LEU  15  24.495   4.396   5.355
  402    HB3  LEU  15           HB1      LEU  15  26.025   5.062   4.785
  403    HG   LEU  15           HG       LEU  15  24.215   3.402   3.018
  404   HD11  LEU  15          HD11      LEU  15  23.408   5.523   2.077
  405   HD12  LEU  15          HD12      LEU  15  24.373   6.425   3.245
  406   HD13  LEU  15          HD13      LEU  15  23.020   5.436   3.794
  407   HD21  LEU  15          HD21      LEU  15  26.618   5.197   2.593
  408   HD22  LEU  15          HD22      LEU  15  25.544   4.748   1.267
  409   HD23  LEU  15          HD23      LEU  15  26.432   3.502   2.144
  410    H    SER  16           HN       SER  16  25.231   2.178   7.195
  411    HA   SER  16           HA       SER  16  27.219   3.491   8.766
  412    HB2  SER  16           HB2      SER  16  25.018   3.037   9.695
  413    HB3  SER  16           HB1      SER  16  25.252   1.304   9.478
  414    HG   SER  16           HG       SER  16  26.399   3.073  11.318
  415    H    ALA  17           HN       ALA  17  26.691   0.129   7.756
  416    HA   ALA  17           HA       ALA  17  28.966  -0.908   9.134
  417    HB1  ALA  17           HB1      ALA  17  28.552  -2.946   7.890
  418    HB2  ALA  17           HB2      ALA  17  27.515  -2.084   6.754
  419    HB3  ALA  17           HB3      ALA  17  27.010  -2.284   8.432
  420    H    LEU  18           HN       LEU  18  28.439   0.521   5.980
  421    HA   LEU  18           HA       LEU  18  30.963  -0.347   4.895
  422    HB2  LEU  18           HB2      LEU  18  28.637   1.212   3.985
  423    HB3  LEU  18           HB1      LEU  18  30.183   1.735   3.315
  424    HG   LEU  18           HG       LEU  18  30.650  -0.669   2.719
  425   HD11  LEU  18          HD11      LEU  18  28.773  -2.240   2.728
  426   HD12  LEU  18          HD12      LEU  18  27.719  -1.008   3.421
  427   HD13  LEU  18          HD13      LEU  18  29.061  -1.653   4.365
  428   HD21  LEU  18          HD21      LEU  18  28.128   0.557   1.553
  429   HD22  LEU  18          HD22      LEU  18  29.117  -0.678   0.776
  430   HD23  LEU  18          HD23      LEU  18  29.776   0.934   1.054
  431    H    HIS  19           HN       HIS  19  29.738   2.477   6.596
  432    HA   HIS  19           HA       HIS  19  31.918   4.209   6.031
  433    HB2  HIS  19           HB2      HIS  19  29.727   5.008   6.841
  434    HB3  HIS  19           HB1      HIS  19  30.026   4.216   8.390
  435    HD2  HIS  19           HD2      HIS  19  31.240   5.916  10.183
  436    HE1  HIS  19           HE1      HIS  19  33.040   8.545   7.412
  437    HE2  HIS  19           HE2      HIS  19  32.674   8.077   9.882
  438    H    PHE  20           HN       PHE  20  31.145   2.070   8.775
  439    HA   PHE  20           HA       PHE  20  33.577   2.645  10.186
  440    HB2  PHE  20           HB2      PHE  20  31.245   0.928  10.540
  441    HB3  PHE  20           HB1      PHE  20  32.741   0.171  11.085
  442    HD1  PHE  20           HD1      PHE  20  30.727   3.310  11.354
  443    HD2  PHE  20           HD2      PHE  20  33.757   0.823  13.110
  444    HE1  PHE  20           HE1      PHE  20  30.710   4.726  13.393
  445    HE2  PHE  20           HE2      PHE  20  33.739   2.234  15.147
  446    HZ   PHE  20           HZ       PHE  20  32.226   4.191  15.301
  447    H    MET  21           HN       MET  21  32.633   0.398   7.671
  448    HA   MET  21           HA       MET  21  34.712  -1.493   7.944
  449    HB2  MET  21           HB2      MET  21  32.855  -0.624   5.790
  450    HB3  MET  21           HB1      MET  21  34.295  -1.511   5.286
  451    HG2  MET  21           HG2      MET  21  32.576  -2.502   7.556
  452    HG3  MET  21           HG1      MET  21  32.184  -2.891   5.880
  453    HE1  MET  21           HE1      MET  21  33.128  -4.249   4.467
  454    HE2  MET  21           HE2      MET  21  34.491  -5.348   4.655
  455    HE3  MET  21           HE3      MET  21  34.782  -3.657   4.259
  456    H    ALA  22           HN       ALA  22  34.497   1.352   5.772
  457    HA   ALA  22           HA       ALA  22  37.162   1.171   4.824
  458    HB1  ALA  22           HB1      ALA  22  36.769   3.203   3.760
  459    HB2  ALA  22           HB2      ALA  22  35.718   3.787   5.050
  460    HB3  ALA  22           HB3      ALA  22  35.139   2.552   3.933
  461    H    TRP  23           HN       TRP  23  35.699   2.918   7.541
  462    HA   TRP  23           HA       TRP  23  37.920   4.452   8.305
  463    HB2  TRP  23           HB2      TRP  23  35.359   3.762   9.387
  464    HB3  TRP  23           HB1      TRP  23  36.575   3.601  10.654
  465    HD1  TRP  23           HD1      TRP  23  35.184   6.171   8.164
  466    HE1  TRP  23           HE1      TRP  23  35.762   8.531   9.025
  467    HE3  TRP  23           HE3      TRP  23  38.123   4.960  12.165
  468    HZ2  TRP  23           HZ2      TRP  23  37.267   9.747  11.134
  469    HZ3  TRP  23           HZ3      TRP  23  39.113   6.738  13.581
  470    HH2  TRP  23           HH2      TRP  23  38.689   9.128  13.071
  471    H    THR  24           HN       THR  24  36.925   1.199   9.376
  472    HA   THR  24           HA       THR  24  38.973   0.693  11.183
  473    HB   THR  24           HB       THR  24  37.622  -1.254   9.296
  474    HG1  THR  24           HG1      THR  24  35.995  -0.753  10.510
  475   HG21  THR  24          HG21      THR  24  39.625  -2.241  10.245
  476   HG22  THR  24          HG22      THR  24  38.221  -2.912  11.077
  477   HG23  THR  24          HG23      THR  24  39.193  -1.660  11.852
  478    H    ILE  25           HN       ILE  25  38.873   0.106   7.669
  479    HA   ILE  25           HA       ILE  25  41.474  -1.025   7.487
  480    HB   ILE  25           HB       ILE  25  39.735   0.380   5.459
  481   HG12  ILE  25          HG12      ILE  25  40.501  -2.540   5.712
  482   HG13  ILE  25          HG11      ILE  25  39.055  -1.865   6.464
  483   HG21  ILE  25          HG21      ILE  25  41.316  -0.720   3.801
  484   HG22  ILE  25          HG22      ILE  25  42.417  -0.989   5.152
  485   HG23  ILE  25          HG23      ILE  25  41.988   0.654   4.680
  486   HD11  ILE  25          HD11      ILE  25  38.530  -2.845   4.259
  487   HD12  ILE  25          HD12      ILE  25  39.703  -1.767   3.502
  488   HD13  ILE  25          HD13      ILE  25  38.256  -1.103   4.259
  489    H    GLY  26           HN       GLY  26  40.299   2.276   7.218
  490    HA2  GLY  26           HA2      GLY  26  42.675   3.511   6.347
  491    HA3  GLY  26           HA1      GLY  26  41.399   4.319   7.255
  492    H    HIS  27           HN       HIS  27  41.434   3.003   9.646
  493    HA   HIS  27           HA       HIS  27  43.601   4.209  10.992
  494    HB2  HIS  27           HB2      HIS  27  41.326   3.577  11.952
  495    HB3  HIS  27           HB1      HIS  27  41.946   1.931  12.074
  496    HD2  HIS  27           HD2      HIS  27  42.112   5.236  14.039
  497    HE1  HIS  27           HE1      HIS  27  45.092   2.727  15.667
  498    HE2  HIS  27           HE2      HIS  27  43.811   4.895  15.993
  499    H    LEU  28           HN       LEU  28  43.036   0.902   9.882
  500    HA   LEU  28           HA       LEU  28  45.317  -0.246  11.136
  501    HB2  LEU  28           HB2      LEU  28  43.328  -1.055   9.103
  502    HB3  LEU  28           HB1      LEU  28  44.896  -1.851   8.975
  503    HG   LEU  28           HG       LEU  28  43.188  -3.013  10.469
  504   HD11  LEU  28          HD11      LEU  28  45.700  -3.316  10.569
  505   HD12  LEU  28          HD12      LEU  28  44.860  -3.653  12.081
  506   HD13  LEU  28          HD13      LEU  28  45.724  -2.133  11.875
  507   HD21  LEU  28          HD21      LEU  28  42.509  -0.679  11.473
  508   HD22  LEU  28          HD22      LEU  28  43.901  -0.909  12.524
  509   HD23  LEU  28          HD23      LEU  28  42.580  -2.074  12.543
  510    H    ASN  29           HN       ASN  29  44.800   1.284   8.018
  511    HA   ASN  29           HA       ASN  29  46.296   2.110   6.487
  512    HB2  ASN  29           HB2      ASN  29  47.579   2.362   8.990
  513    HB3  ASN  29           HB1      ASN  29  48.781   1.701   7.883
  514   HD21  ASN  29          HD21      ASN  29  47.307   4.599   8.890
  515   HD22  ASN  29          HD22      ASN  29  47.784   5.574   7.586
  516    H    GLN  30           HN       GLN  30  46.781   0.980   4.747
  517    HA   GLN  30           HA       GLN  30  47.819  -1.744   5.011
  518    HB2  GLN  30           HB2      GLN  30  47.411  -1.811   2.520
  519    HB3  GLN  30           HB1      GLN  30  45.970  -1.543   3.501
  520    HG2  GLN  30           HG2      GLN  30  47.393   0.920   2.731
  521    HG3  GLN  30           HG1      GLN  30  46.704   0.027   1.376
  522   HE21  GLN  30          HE21      GLN  30  44.809   1.210   0.928
  523   HE22  GLN  30          HE22      GLN  30  43.603   1.538   2.074
  524    H    ILE  31           HN       ILE  31  49.558   0.497   5.626
  525    HA   ILE  31           HA       ILE  31  51.740   1.103   5.288
  526    HB   ILE  31           HB       ILE  31  51.772  -1.205   3.318
  527   HG12  ILE  31          HG12      ILE  31  52.654  -1.180   6.201
  528   HG13  ILE  31          HG11      ILE  31  51.059  -1.737   5.696
  529   HG21  ILE  31          HG21      ILE  31  54.154  -1.151   3.578
  530   HG22  ILE  31          HG22      ILE  31  54.043   0.095   4.818
  531   HG23  ILE  31          HG23      ILE  31  53.637   0.479   3.146
  532   HD11  ILE  31          HD11      ILE  31  52.628  -3.628   5.870
  533   HD12  ILE  31          HD12      ILE  31  53.700  -2.849   4.707
  534   HD13  ILE  31          HD13      ILE  31  52.101  -3.397   4.202
  535    H    LYS  32           HN       LYS  32  51.233  -0.073   1.979
  536    HA   LYS  32           HA       LYS  32  50.681   2.517   0.923
  537    HB2  LYS  32           HB2      LYS  32  53.401   1.808   1.317
  538    HB3  LYS  32           HB1      LYS  32  53.091   1.700  -0.414
  539    HG2  LYS  32           HG2      LYS  32  51.791   4.038   0.242
  540    HG3  LYS  32           HG1      LYS  32  53.180   4.070   1.327
  541    HD2  LYS  32           HD2      LYS  32  54.655   3.614  -0.635
  542    HD3  LYS  32           HD1      LYS  32  53.238   3.728  -1.679
  543    HE2  LYS  32           HE2      LYS  32  52.889   6.037  -0.458
  544    HE3  LYS  32           HE1      LYS  32  54.613   5.888  -0.118
  545    HZ1  LYS  32           HZ1      LYS  32  55.006   6.600  -2.161
  546    HZ2  LYS  32           HZ2      LYS  32  53.348   6.626  -2.527
  547    HZ3  LYS  32           HZ3      LYS  32  54.256   5.217  -2.797
  548    H    ARG  33           HN       ARG  33  49.685  -0.272   0.879
  549    HA   ARG  33           HA       ARG  33  48.777  -1.759  -0.621
  550    HB2  ARG  33           HB2      ARG  33  47.793   0.377  -1.469
  551    HB3  ARG  33           HB1      ARG  33  49.142   0.502  -2.597
  552    HG2  ARG  33           HG2      ARG  33  48.511  -1.517  -3.716
  553    HG3  ARG  33           HG1      ARG  33  47.339  -1.924  -2.462
  554    HD2  ARG  33           HD2      ARG  33  46.045   0.122  -3.056
  555    HD3  ARG  33           HD1      ARG  33  47.187   0.441  -4.355
  556    HE   ARG  33           HE       ARG  33  45.109  -1.587  -4.335
  557   HH11  ARG  33          HH11      ARG  33  48.133  -0.506  -5.707
  558   HH12  ARG  33          HH12      ARG  33  47.913  -1.384  -7.175
  559   HH21  ARG  33          HH21      ARG  33  44.856  -2.735  -6.273
  560   HH22  ARG  33          HH22      ARG  33  46.076  -2.642  -7.498
  561    H1   MET   1           HT1      MET   1   1.139   2.037  22.877
  562    H2   MET   1           HT2      MET   1   0.317   2.626  21.513
  563    H3   MET   1           HT3      MET   1  -0.210   3.046  23.073
  564    HA   MET   1           HA       MET   1   1.182   4.723  21.690
  565    HB2  MET   1           HB2      MET   1   1.986   5.681  23.765
  566    HB3  MET   1           HB1      MET   1   0.422   4.929  24.082
  567    HG2  MET   1           HG2      MET   1   1.716   2.842  24.786
  568    HG3  MET   1           HG1      MET   1   3.165   3.846  24.750
  569    HE1  MET   1           HE1      MET   1   1.874   3.119  28.486
  570    HE2  MET   1           HE2      MET   1   3.323   3.016  27.487
  571    HE3  MET   1           HE3      MET   1   1.867   2.147  27.007
  572    H    PHE   2           HN       PHE   2   2.287   1.960  21.225
  573    HA   PHE   2           HA       PHE   2   5.071   2.118  21.986
  574    HB2  PHE   2           HB2      PHE   2   3.930  -0.058  21.788
  575    HB3  PHE   2           HB1      PHE   2   3.662   0.242  20.072
  576    HD1  PHE   2           HD1      PHE   2   6.380   0.034  22.635
  577    HD2  PHE   2           HD2      PHE   2   5.302  -0.352  18.495
  578    HE1  PHE   2           HE1      PHE   2   8.643  -0.846  22.128
  579    HE2  PHE   2           HE2      PHE   2   7.565  -1.232  17.989
  580    HZ   PHE   2           HZ       PHE   2   9.234  -1.479  19.806
  581    H    GLU   3           HN       GLU   3   6.691   2.984  20.849
  582    HA   GLU   3           HA       GLU   3   6.041   4.116  18.241
  583    HB2  GLU   3           HB2      GLU   3   8.279   4.748  20.141
  584    HB3  GLU   3           HB1      GLU   3   8.081   5.487  18.551
  585    HG2  GLU   3           HG2      GLU   3   5.805   6.244  19.220
  586    HG3  GLU   3           HG1      GLU   3   6.086   5.584  20.830
  587    HA   PRO   4           HA       PRO   4   8.652   0.757  16.676
  588    HB2  PRO   4           HB2      PRO   4   8.148   1.188  14.034
  589    HB3  PRO   4           HB1      PRO   4   7.008   0.363  15.111
  590    HG2  PRO   4           HG2      PRO   4   6.972   3.152  14.091
  591    HG3  PRO   4           HG1      PRO   4   5.628   2.042  14.402
  592    HD2  PRO   4           HD2      PRO   4   6.385   4.090  16.089
  593    HD3  PRO   4           HD1      PRO   4   5.470   2.656  16.596
  594    H    PHE   5           HN       PHE   5   8.687   4.039  15.310
  595    HA   PHE   5           HA       PHE   5  11.234   3.827  14.061
  596    HB2  PHE   5           HB2      PHE   5  11.010   6.083  13.558
  597    HB3  PHE   5           HB1      PHE   5   9.327   5.588  13.744
  598    HD1  PHE   5           HD1      PHE   5  11.995   7.675  15.024
  599    HD2  PHE   5           HD2      PHE   5   8.162   5.978  15.959
  600    HE1  PHE   5           HE1      PHE   5  11.716   9.317  16.862
  601    HE2  PHE   5           HE2      PHE   5   7.883   7.620  17.796
  602    HZ   PHE   5           HZ       PHE   5   9.664   9.278  18.251
  603    H    GLN   6           HN       GLN   6  10.405   3.863  17.318
  604    HA   GLN   6           HA       GLN   6  12.396   5.483  18.452
  605    HB2  GLN   6           HB2      GLN   6  10.379   4.478  19.616
  606    HB3  GLN   6           HB1      GLN   6  11.267   2.953  19.659
  607    HG2  GLN   6           HG2      GLN   6  12.008   3.781  21.661
  608    HG3  GLN   6           HG1      GLN   6  13.171   4.607  20.626
  609   HE21  GLN   6          HE21      GLN   6  13.368   6.595  21.765
  610   HE22  GLN   6          HE22      GLN   6  12.061   7.640  22.047
  611    H    ILE   7           HN       ILE   7  12.423   2.203  17.190
  612    HA   ILE   7           HA       ILE   7  14.854   1.349  18.374
  613    HB   ILE   7           HB       ILE   7  14.795  -0.444  16.785
  614   HG12  ILE   7          HG12      ILE   7  12.949   1.363  15.199
  615   HG13  ILE   7          HG11      ILE   7  14.548   0.810  14.723
  616   HG21  ILE   7          HG21      ILE   7  12.597  -1.300  17.143
  617   HG22  ILE   7          HG22      ILE   7  11.895   0.318  17.190
  618   HG23  ILE   7          HG23      ILE   7  12.916  -0.239  18.515
  619   HD11  ILE   7          HD11      ILE   7  12.018  -0.811  14.967
  620   HD12  ILE   7          HD12      ILE   7  13.608  -1.573  14.925
  621   HD13  ILE   7          HD13      ILE   7  13.054  -0.609  13.556
  622    H    LEU   8           HN       LEU   8  14.114   3.205  15.458
  623    HA   LEU   8           HA       LEU   8  16.771   3.077  14.405
  624    HB2  LEU   8           HB2      LEU   8  14.698   3.458  13.033
  625    HB3  LEU   8           HB1      LEU   8  14.590   5.067  13.747
  626    HG   LEU   8           HG       LEU   8  16.978   5.446  12.946
  627   HD11  LEU   8          HD11      LEU   8  17.585   3.960  10.965
  628   HD12  LEU   8          HD12      LEU   8  16.328   2.857  11.521
  629   HD13  LEU   8          HD13      LEU   8  17.717   3.202  12.551
  630   HD21  LEU   8          HD21      LEU   8  15.093   6.451  11.776
  631   HD22  LEU   8          HD22      LEU   8  14.775   4.941  10.922
  632   HD23  LEU   8          HD23      LEU   8  16.246   5.852  10.583
  633    H    SER   9           HN       SER   9  14.986   5.212  16.512
  634    HA   SER   9           HA       SER   9  16.904   7.359  16.439
  635    HB2  SER   9           HB2      SER   9  14.564   7.782  17.021
  636    HB3  SER   9           HB1      SER   9  14.722   6.757  18.443
  637    HG   SER   9           HG       SER   9  15.078   8.832  19.110
  638    H    ILE  10           HN       ILE  10  16.197   4.693  18.664
  639    HA   ILE  10           HA       ILE  10  18.139   5.371  20.602
  640    HB   ILE  10           HB       ILE  10  16.768   2.771  19.914
  641   HG12  ILE  10          HG12      ILE  10  15.568   4.817  20.972
  642   HG13  ILE  10          HG11      ILE  10  15.383   3.256  21.772
  643   HG21  ILE  10          HG21      ILE  10  18.828   3.403  22.048
  644   HG22  ILE  10          HG22      ILE  10  18.826   2.076  20.892
  645   HG23  ILE  10          HG23      ILE  10  17.673   2.081  22.224
  646   HD11  ILE  10          HD11      ILE  10  16.022   5.372  23.204
  647   HD12  ILE  10          HD12      ILE  10  17.647   5.070  22.596
  648   HD13  ILE  10          HD13      ILE  10  16.809   3.830  23.527
  649    H    CYS  11           HN       CYS  11  18.219   3.258  17.742
  650    HA   CYS  11           HA       CYS  11  20.816   2.227  18.187
  651    HB2  CYS  11           HB2      CYS  11  19.129   2.565  15.709
  652    HB3  CYS  11           HB1      CYS  11  20.722   1.808  15.672
  653    HG   CYS  11           HG       CYS  11  19.748   0.057  17.472
  654    H    SER  12           HN       SER  12  19.691   4.914  16.094
  655    HA   SER  12           HA       SER  12  22.210   5.689  15.160
  656    HB2  SER  12           HB2      SER  12  21.140   7.830  14.631
  657    HB3  SER  12           HB1      SER  12  20.063   6.496  14.231
  658    HG   SER  12           HG       SER  12  19.457   8.503  15.698
  659    H    PHE  13           HN       PHE  13  20.438   6.613  18.088
  660    HA   PHE  13           HA       PHE  13  22.156   8.657  18.963
  661    HB2  PHE  13           HB2      PHE  13  19.903   8.171  19.915
  662    HB3  PHE  13           HB1      PHE  13  20.574   6.730  20.679
  663    HD1  PHE  13           HD1      PHE  13  20.381  10.380  20.754
  664    HD2  PHE  13           HD2      PHE  13  22.313   6.935  22.443
  665    HE1  PHE  13           HE1      PHE  13  21.200  11.766  22.642
  666    HE2  PHE  13           HE2      PHE  13  23.130   8.320  24.332
  667    HZ   PHE  13           HZ       PHE  13  22.573  10.736  24.431
  668    H    ILE  14           HN       ILE  14  22.175   5.155  19.607
  669    HA   ILE  14           HA       ILE  14  24.375   5.159  21.378
  670    HB   ILE  14           HB       ILE  14  23.271   3.015  19.553
  671   HG12  ILE  14          HG12      ILE  14  23.107   3.300  22.564
  672   HG13  ILE  14          HG11      ILE  14  21.876   3.943  21.479
  673   HG21  ILE  14          HG21      ILE  14  25.373   2.850  21.735
  674   HG22  ILE  14          HG22      ILE  14  25.612   2.499  20.023
  675   HG23  ILE  14          HG23      ILE  14  24.587   1.453  21.002
  676   HD11  ILE  14          HD11      ILE  14  22.735   1.045  21.707
  677   HD12  ILE  14          HD12      ILE  14  21.588   1.656  20.515
  678   HD13  ILE  14          HD13      ILE  14  21.195   1.726  22.233
  679    H    LEU  15           HN       LEU  15  24.186   4.585  17.858
  680    HA   LEU  15           HA       LEU  15  26.954   4.156  17.486
  681    HB2  LEU  15           HB2      LEU  15  24.766   5.047  15.597
  682    HB3  LEU  15           HB1      LEU  15  26.414   4.695  15.078
  683    HG   LEU  15           HG       LEU  15  24.746   2.716  16.645
  684   HD11  LEU  15          HD11      LEU  15  24.262   1.620  14.503
  685   HD12  LEU  15          HD12      LEU  15  25.129   2.889  13.639
  686   HD13  LEU  15          HD13      LEU  15  23.633   3.267  14.492
  687   HD21  LEU  15          HD21      LEU  15  27.333   2.615  15.069
  688   HD22  LEU  15          HD22      LEU  15  26.429   1.153  15.468
  689   HD23  LEU  15          HD23      LEU  15  27.065   2.176  16.755
  690    H    SER  16           HN       SER  16  25.035   7.024  17.816
  691    HA   SER  16           HA       SER  16  26.877   8.844  16.615
  692    HB2  SER  16           HB2      SER  16  24.527   9.439  16.867
  693    HB3  SER  16           HB1      SER  16  24.655   9.306  18.619
  694    HG   SER  16           HG       SER  16  25.666  11.245  16.869
  695    H    ALA  17           HN       ALA  17  26.226   7.823  19.954
  696    HA   ALA  17           HA       ALA  17  28.181   9.550  21.125
  697    HB1  ALA  17           HB1      ALA  17  27.772   8.310  23.164
  698    HB2  ALA  17           HB2      ALA  17  26.992   7.011  22.263
  699    HB3  ALA  17           HB3      ALA  17  26.232   8.599  22.359
  700    H    LEU  18           HN       LEU  18  28.237   6.325  19.753
  701    HA   LEU  18           HA       LEU  18  30.803   5.637  20.867
  702    HB2  LEU  18           HB2      LEU  18  28.774   4.365  19.159
  703    HB3  LEU  18           HB1      LEU  18  30.438   3.917  18.783
  704    HG   LEU  18           HG       LEU  18  30.785   3.446  21.235
  705   HD11  LEU  18          HD11      LEU  18  28.804   3.215  22.653
  706   HD12  LEU  18          HD12      LEU  18  27.764   3.715  21.318
  707   HD13  LEU  18          HD13      LEU  18  28.897   4.863  22.032
  708   HD21  LEU  18          HD21      LEU  18  28.570   1.899  19.847
  709   HD22  LEU  18          HD22      LEU  18  29.550   1.301  21.185
  710   HD23  LEU  18          HD23      LEU  18  30.300   1.638  19.626
  711    H    HIS  19           HN       HIS  19  29.590   7.072  17.897
  712    HA   HIS  19           HA       HIS  19  31.971   6.805  16.369
  713    HB2  HIS  19           HB2      HIS  19  29.762   7.270  15.368
  714    HB3  HIS  19           HB1      HIS  19  29.766   8.861  16.130
  715    HD2  HIS  19           HD2      HIS  19  30.844  10.775  14.471
  716    HE1  HIS  19           HE1      HIS  19  33.255   8.247  12.100
  717    HE2  HIS  19           HE2      HIS  19  32.489  10.643  12.448
  718    H    PHE  20           HN       PHE  20  30.630   9.447  18.346
  719    HA   PHE  20           HA       PHE  20  32.873  11.190  17.931
  720    HB2  PHE  20           HB2      PHE  20  30.375  11.227  19.442
  721    HB3  PHE  20           HB1      PHE  20  31.708  12.004  20.297
  722    HD1  PHE  20           HD1      PHE  20  29.953  11.903  16.998
  723    HD2  PHE  20           HD2      PHE  20  32.460  14.146  19.668
  724    HE1  PHE  20           HE1      PHE  20  29.751  13.885  15.523
  725    HE2  PHE  20           HE2      PHE  20  32.258  16.129  18.192
  726    HZ   PHE  20           HZ       PHE  20  30.897  15.996  16.120
  727    H    MET  21           HN       MET  21  32.116   8.598  20.162
  728    HA   MET  21           HA       MET  21  33.957   9.211  22.217
  729    HB2  MET  21           HB2      MET  21  32.514   6.794  21.260
  730    HB3  MET  21           HB1      MET  21  33.930   6.524  22.279
  731    HG2  MET  21           HG2      MET  21  31.816   8.533  23.052
  732    HG3  MET  21           HG1      MET  21  31.649   6.828  23.468
  733    HE1  MET  21           HE1      MET  21  32.669   5.613  24.963
  734    HE2  MET  21           HE2      MET  21  33.907   6.030  26.146
  735    HE3  MET  21           HE3      MET  21  34.374   5.637  24.493
  736    H    ALA  22           HN       ALA  22  34.313   6.983  19.425
  737    HA   ALA  22           HA       ALA  22  37.059   6.443  19.868
  738    HB1  ALA  22           HB1      ALA  22  37.004   5.294  17.842
  739    HB2  ALA  22           HB2      ALA  22  35.826   6.399  17.135
  740    HB3  ALA  22           HB3      ALA  22  35.318   5.231  18.354
  741    H    TRP  23           HN       TRP  23  35.372   8.877  17.916
  742    HA   TRP  23           HA       TRP  23  37.583   9.931  16.548
  743    HB2  TRP  23           HB2      TRP  23  34.841  10.636  16.985
  744    HB3  TRP  23           HB1      TRP  23  35.841  12.072  17.206
  745    HD1  TRP  23           HD1      TRP  23  35.055   9.350  14.616
  746    HE1  TRP  23           HE1      TRP  23  35.702  10.236  12.282
  747    HE3  TRP  23           HE3      TRP  23  37.267  13.764  15.926
  748    HZ2  TRP  23           HZ2      TRP  23  36.986  12.516  11.124
  749    HZ3  TRP  23           HZ3      TRP  23  38.189  15.276  14.195
  750    HH2  TRP  23           HH2      TRP  23  38.054  14.655  11.793
  751    H    THR  24           HN       THR  24  36.170  10.898  19.675
  752    HA   THR  24           HA       THR  24  37.882  13.004  20.282
  753    HB   THR  24           HB       THR  24  36.659  10.979  22.176
  754    HG1  THR  24           HG1      THR  24  34.921  11.923  21.497
  755   HG21  THR  24          HG21      THR  24  38.408  12.241  23.289
  756   HG22  THR  24          HG22      THR  24  36.846  12.868  23.813
  757   HG23  THR  24          HG23      THR  24  37.796  13.753  22.619
  758    H    ILE  25           HN       ILE  25  38.247   9.517  20.960
  759    HA   ILE  25           HA       ILE  25  40.733   9.749  22.317
  760    HB   ILE  25           HB       ILE  25  39.431   7.460  20.842
  761   HG12  ILE  25          HG12      ILE  25  39.905   7.880  23.804
  762   HG13  ILE  25          HG11      ILE  25  38.429   8.402  22.991
  763   HG21  ILE  25          HG21      ILE  25  41.136   6.069  22.108
  764   HG22  ILE  25          HG22      ILE  25  42.003   7.571  22.436
  765   HG23  ILE  25          HG23      ILE  25  41.792   7.018  20.774
  766   HD11  ILE  25          HD11      ILE  25  38.140   6.165  23.995
  767   HD12  ILE  25          HD12      ILE  25  39.501   5.565  23.048
  768   HD13  ILE  25          HD13      ILE  25  38.026   6.087  22.237
  769    H    GLY  26           HN       GLY  26  39.906   9.235  18.937
  770    HA2  GLY  26           HA2      GLY  26  42.482   8.702  17.939
  771    HA3  GLY  26           HA1      GLY  26  41.163   9.392  16.996
  772    H    HIS  27           HN       HIS  27  40.731  11.790  18.220
  773    HA   HIS  27           HA       HIS  27  42.774  13.418  17.158
  774    HB2  HIS  27           HB2      HIS  27  40.341  14.046  17.556
  775    HB3  HIS  27           HB1      HIS  27  40.779  14.289  19.246
  776    HD2  HIS  27           HD2      HIS  27  40.957  16.200  15.914
  777    HE1  HIS  27           HE1      HIS  27  43.435  18.288  18.619
  778    HE2  HIS  27           HE2      HIS  27  42.317  18.387  16.341
  779    H    LEU  28           HN       LEU  28  42.097  12.293  20.437
  780    HA   LEU  28           HA       LEU  28  44.059  13.903  21.728
  781    HB2  LEU  28           HB2      LEU  28  42.323  11.619  22.440
  782    HB3  LEU  28           HB1      LEU  28  43.819  11.740  23.366
  783    HG   LEU  28           HG       LEU  28  41.821  12.993  24.332
  784   HD11  LEU  28          HD11      LEU  28  44.247  13.464  24.851
  785   HD12  LEU  28          HD12      LEU  28  43.182  14.857  25.041
  786   HD13  LEU  28          HD13      LEU  28  44.206  14.721  23.615
  787   HD21  LEU  28          HD21      LEU  28  41.212  13.838  21.917
  788   HD22  LEU  28          HD22      LEU  28  42.410  15.087  22.230
  789   HD23  LEU  28          HD23      LEU  28  41.001  14.934  23.278
  790    H    ASN  29           HN       ASN  29  44.133  10.709  20.274
  791    HA   ASN  29           HA       ASN  29  45.901   9.397  19.624
  792    HB2  ASN  29           HB2      ASN  29  46.823  12.055  19.398
  793    HB3  ASN  29           HB1      ASN  29  48.113  11.150  20.186
  794   HD21  ASN  29          HD21      ASN  29  46.783  11.889  17.151
  795   HD22  ASN  29          HD22      ASN  29  47.513  10.644  16.257
  796    H    GLN  30           HN       GLN  30  46.536   7.772  20.844
  797    HA   GLN  30           HA       GLN  30  47.285   8.238  23.634
  798    HB2  GLN  30           HB2      GLN  30  47.243   5.713  23.744
  799    HB3  GLN  30           HB1      GLN  30  45.702   6.467  23.334
  800    HG2  GLN  30           HG2      GLN  30  47.422   5.869  21.015
  801    HG3  GLN  30           HG1      GLN  30  46.860   4.446  21.889
  802   HE21  GLN  30          HE21      GLN  30  45.157   3.711  20.562
  803   HE22  GLN  30          HE22      GLN  30  43.831   4.667  20.107
  804    H    ILE  31           HN       ILE  31  49.101   9.058  21.523
  805    HA   ILE  31           HA       ILE  31  51.352   9.034  21.109
  806    HB   ILE  31           HB       ILE  31  51.477   7.135  23.473
  807   HG12  ILE  31          HG12      ILE  31  51.935  10.115  23.429
  808   HG13  ILE  31          HG11      ILE  31  50.387   9.396  23.866
  809   HG21  ILE  31          HG21      ILE  31  53.792   7.734  23.597
  810   HG22  ILE  31          HG22      ILE  31  53.609   8.930  22.317
  811   HG23  ILE  31          HG23      ILE  31  53.480   7.213  21.942
  812   HD11  ILE  31          HD11      ILE  31  51.749   9.831  25.874
  813   HD12  ILE  31          HD12      ILE  31  53.034   8.815  25.223
  814   HD13  ILE  31          HD13      ILE  31  51.479   8.102  25.655
  815    H    LYS  32           HN       LYS  32  51.233   5.710  22.345
  816    HA   LYS  32           HA       LYS  32  51.059   4.533  19.753
  817    HB2  LYS  32           HB2      LYS  32  53.621   5.336  20.667
  818    HB3  LYS  32           HB1      LYS  32  53.556   3.580  20.810
  819    HG2  LYS  32           HG2      LYS  32  52.381   3.984  18.352
  820    HG3  LYS  32           HG1      LYS  32  53.596   5.264  18.397
  821    HD2  LYS  32           HD2      LYS  32  55.296   3.550  19.041
  822    HD3  LYS  32           HD1      LYS  32  54.060   2.306  18.844
  823    HE2  LYS  32           HE2      LYS  32  53.741   3.416  16.475
  824    HE3  LYS  32           HE1      LYS  32  55.378   4.008  16.755
  825    HZ1  LYS  32           HZ1      LYS  32  56.120   2.029  16.141
  826    HZ2  LYS  32           HZ2      LYS  32  54.541   1.423  15.999
  827    HZ3  LYS  32           HZ3      LYS  32  55.360   1.321  17.483
  828    H    ARG  33           HN       ARG  33  49.846   4.400  22.454
  829    HA   ARG  33           HA       ARG  33  49.036   2.814  23.907
  830    HB2  ARG  33           HB2      ARG  33  48.382   1.782  21.723
  831    HB3  ARG  33           HB1      ARG  33  49.885   0.860  21.757
  832    HG2  ARG  33           HG2      ARG  33  49.241  -0.293  23.751
  833    HG3  ARG  33           HG1      ARG  33  47.872   0.789  24.015
  834    HD2  ARG  33           HD2      ARG  33  46.856  -0.028  21.893
  835    HD3  ARG  33           HD1      ARG  33  48.194  -1.154  21.708
  836    HE   ARG  33           HE       ARG  33  45.971  -1.399  23.559
  837   HH11  ARG  33          HH11      ARG  33  49.243  -2.332  22.773
  838   HH12  ARG  33          HH12      ARG  33  49.165  -3.799  23.676
  839   HH21  ARG  33          HH21      ARG  33  45.905  -3.332  24.744
  840   HH22  ARG  33          HH22      ARG  33  47.294  -4.366  24.788
  841    H1   MET   1           HT1      MET   1  -1.272  17.975  15.933
  842    H2   MET   1           HT2      MET   1  -1.811  16.516  15.249
  843    H3   MET   1           HT3      MET   1  -2.559  17.983  14.828
  844    HA   MET   1           HA       MET   1  -0.840  16.912  13.228
  845    HB2  MET   1           HB2      MET   1  -0.317  19.131  12.394
  846    HB3  MET   1           HB1      MET   1  -1.966  19.152  13.021
  847    HG2  MET   1           HG2      MET   1  -0.979  19.979  15.225
  848    HG3  MET   1           HG1      MET   1   0.533  20.220  14.350
  849    HE1  MET   1           HE1      MET   1  -1.403  23.666  15.056
  850    HE2  MET   1           HE2      MET   1   0.181  22.917  15.242
  851    HE3  MET   1           HE3      MET   1  -1.232  22.171  15.986
  852    H    PHE   2           HN       PHE   2   0.126  16.512  16.046
  853    HA   PHE   2           HA       PHE   2   2.747  17.729  16.131
  854    HB2  PHE   2           HB2      PHE   2   1.499  17.262  18.203
  855    HB3  PHE   2           HB1      PHE   2   1.544  15.537  17.836
  856    HD1  PHE   2           HD1      PHE   2   3.773  18.501  18.334
  857    HD2  PHE   2           HD2      PHE   2   3.376  14.228  18.512
  858    HE1  PHE   2           HE1      PHE   2   6.017  18.336  19.376
  859    HE2  PHE   2           HE2      PHE   2   5.621  14.063  19.554
  860    HZ   PHE   2           HZ       PHE   2   6.941  16.117  19.987
  861    H    GLU   3           HN       GLU   3   4.590  16.917  15.354
  862    HA   GLU   3           HA       GLU   3   4.475  14.286  14.109
  863    HB2  GLU   3           HB2      GLU   3   6.403  16.554  13.712
  864    HB3  GLU   3           HB1      GLU   3   6.532  14.984  12.918
  865    HG2  GLU   3           HG2      GLU   3   4.236  15.295  11.998
  866    HG3  GLU   3           HG1      GLU   3   4.195  16.903  12.718
  867    HA   PRO   4           HA       PRO   4   7.051  13.038  17.621
  868    HB2  PRO   4           HB2      PRO   4   7.036  10.368  17.078
  869    HB3  PRO   4           HB1      PRO   4   5.673  11.208  17.842
  870    HG2  PRO   4           HG2      PRO   4   6.009  10.309  15.033
  871    HG3  PRO   4           HG1      PRO   4   4.554  10.352  16.044
  872    HD2  PRO   4           HD2      PRO   4   5.165  12.224  14.106
  873    HD3  PRO   4           HD1      PRO   4   4.077  12.511  15.479
  874    H    PHE   5           HN       PHE   5   7.559  11.821  14.319
  875    HA   PHE   5           HA       PHE   5  10.254  11.004  14.692
  876    HB2  PHE   5           HB2      PHE   5  10.283  10.568  12.411
  877    HB3  PHE   5           HB1      PHE   5   8.560  10.457  12.776
  878    HD1  PHE   5           HD1      PHE   5  11.127  12.246  10.951
  879    HD2  PHE   5           HD2      PHE   5   7.075  12.465  12.360
  880    HE1  PHE   5           HE1      PHE   5  10.670  14.082   9.348
  881    HE2  PHE   5           HE2      PHE   5   6.619  14.300  10.756
  882    HZ   PHE   5           HZ       PHE   5   8.415  15.108   9.251
  883    H    GLN   6           HN       GLN   6   8.894  14.083  14.677
  884    HA   GLN   6           HA       GLN   6  10.784  15.594  13.258
  885    HB2  GLN   6           HB2      GLN   6   8.532  16.366  14.139
  886    HB3  GLN   6           HB1      GLN   6   9.290  16.490  15.727
  887    HG2  GLN   6           HG2      GLN   6   9.737  18.622  15.016
  888    HG3  GLN   6           HG1      GLN   6  11.117  17.828  14.259
  889   HE21  GLN   6          HE21      GLN   6  11.269  19.063  12.324
  890   HE22  GLN   6          HE22      GLN   6  10.015  19.165  11.185
  891    H    ILE   7           HN       ILE   7  10.773  14.231  16.493
  892    HA   ILE   7           HA       ILE   7  12.908  15.745  17.573
  893    HB   ILE   7           HB       ILE   7  12.981  14.096  19.308
  894   HG12  ILE   7          HG12      ILE   7  11.568  12.303  17.315
  895   HG13  ILE   7          HG11      ILE   7  13.180  12.076  17.977
  896   HG21  ILE   7          HG21      ILE   7  10.700  14.051  19.996
  897   HG22  ILE   7          HG22      ILE   7  10.117  14.041  18.330
  898   HG23  ILE   7          HG23      ILE   7  10.856  15.497  18.999
  899   HD11  ILE   7          HD11      ILE   7  10.532  11.824  19.398
  900   HD12  ILE   7          HD12      ILE   7  12.044  12.022  20.285
  901   HD13  ILE   7          HD13      ILE   7  11.808  10.620  19.242
  902    H    LEU   8           HN       LEU   8  12.804  12.831  15.578
  903    HA   LEU   8           HA       LEU   8  15.582  12.221  15.885
  904    HB2  LEU   8           HB2      LEU   8  13.801  10.547  15.303
  905    HB3  LEU   8           HB1      LEU   8  13.695  11.300  13.710
  906    HG   LEU   8           HG       LEU   8  16.204  10.917  13.497
  907   HD11  LEU   8          HD11      LEU   8  17.021   9.003  14.976
  908   HD12  LEU   8          HD12      LEU   8  15.613   9.309  15.992
  909   HD13  LEU   8          HD13      LEU   8  16.836  10.560  15.780
  910   HD21  LEU   8          HD21      LEU   8  14.617   9.493  12.319
  911   HD22  LEU   8          HD22      LEU   8  14.340   8.539  13.776
  912   HD23  LEU   8          HD23      LEU   8  15.908   8.486  12.972
  913    H    SER   9           HN       SER   9  13.636  14.097  13.676
  914    HA   SER   9           HA       SER   9  15.694  14.426  11.689
  915    HB2  SER   9           HB2      SER   9  13.317  14.638  11.111
  916    HB3  SER   9           HB1      SER   9  13.181  16.039  12.173
  917    HG   SER   9           HG       SER   9  13.573  16.820  10.148
  918    H    ILE  10           HN       ILE  10  14.421  16.406  14.342
  919    HA   ILE  10           HA       ILE  10  16.066  18.654  13.886
  920    HB   ILE  10           HB       ILE  10  14.640  17.642  16.348
  921   HG12  ILE  10          HG12      ILE  10  13.438  18.579  14.243
  922   HG13  ILE  10          HG11      ILE  10  13.003  19.266  15.809
  923   HG21  ILE  10          HG21      ILE  10  16.362  20.105  15.947
  924   HG22  ILE  10          HG22      ILE  10  16.448  18.911  17.237
  925   HG23  ILE  10          HG23      ILE  10  15.095  20.038  17.176
  926   HD11  ILE  10          HD11      ILE  10  13.553  20.877  13.802
  927   HD12  ILE  10          HD12      ILE  10  15.230  20.532  14.217
  928   HD13  ILE  10          HD13      ILE  10  14.155  21.256  15.412
  929    H    CYS  11           HN       CYS  11  16.460  15.772  15.924
  930    HA   CYS  11           HA       CYS  11  18.869  16.585  17.164
  931    HB2  CYS  11           HB2      CYS  11  17.655  13.878  16.618
  932    HB3  CYS  11           HB1      CYS  11  19.168  14.077  17.502
  933    HG   CYS  11           HG       CYS  11  17.775  15.601  19.225
  934    H    SER  12           HN       SER  12  18.306  14.453  14.341
  935    HA   SER  12           HA       SER  12  20.997  13.971  13.733
  936    HB2  SER  12           HB2      SER  12  20.187  13.368  11.500
  937    HB3  SER  12           HB1      SER  12  19.102  12.736  12.734
  938    HG   SER  12           HG       SER  12  18.402  14.172  10.734
  939    H    PHE  13           HN       PHE  13  18.833  16.606  12.751
  940    HA   PHE  13           HA       PHE  13  20.529  17.834  10.881
  941    HB2  PHE  13           HB2      PHE  13  18.117  18.389  11.229
  942    HB3  PHE  13           HB1      PHE  13  18.558  19.192  12.736
  943    HD1  PHE  13           HD1      PHE  13  18.609  19.378   9.084
  944    HD2  PHE  13           HD2      PHE  13  19.984  21.224  12.710
  945    HE1  PHE  13           HE1      PHE  13  19.201  21.427   7.816
  946    HE2  PHE  13           HE2      PHE  13  20.574  23.273  11.443
  947    HZ   PHE  13           HZ       PHE  13  20.182  23.374   8.997
  948    H    ILE  14           HN       ILE  14  20.178  18.337  14.389
  949    HA   ILE  14           HA       ILE  14  22.057  20.430  14.615
  950    HB   ILE  14           HB       ILE  14  21.115  18.360  16.612
  951   HG12  ILE  14          HG12      ILE  14  20.473  21.314  16.398
  952   HG13  ILE  14          HG11      ILE  14  19.489  20.068  15.635
  953   HG21  ILE  14          HG21      ILE  14  22.792  20.859  17.018
  954   HG22  ILE  14          HG22      ILE  14  23.310  19.199  17.314
  955   HG23  ILE  14          HG23      ILE  14  22.058  19.924  18.317
  956   HD11  ILE  14          HD11      ILE  14  20.090  20.317  18.596
  957   HD12  ILE  14          HD12      ILE  14  19.202  18.981  17.864
  958   HD13  ILE  14          HD13      ILE  14  18.538  20.613  17.815
  959    H    LEU  15           HN       LEU  15  22.406  16.919  15.074
  960    HA   LEU  15           HA       LEU  15  25.163  16.972  15.709
  961    HB2  LEU  15           HB2      LEU  15  23.391  14.793  14.593
  962    HB3  LEU  15           HB1      LEU  15  25.071  14.535  15.059
  963    HG   LEU  15           HG       LEU  15  23.022  15.721  16.943
  964   HD11  LEU  15          HD11      LEU  15  22.821  13.489  17.933
  965   HD12  LEU  15          HD12      LEU  15  23.928  12.832  16.727
  966   HD13  LEU  15          HD13      LEU  15  22.342  13.432  16.237
  967   HD21  LEU  15          HD21      LEU  15  25.823  14.594  17.208
  968   HD22  LEU  15          HD22      LEU  15  24.759  14.784  18.602
  969   HD23  LEU  15          HD23      LEU  15  25.245  16.197  17.666
  970    H    SER  16           HN       SER  16  23.435  17.112  12.710
  971    HA   SER  16           HA       SER  16  25.580  16.302  11.009
  972    HB2  SER  16           HB2      SER  16  23.280  16.184  10.232
  973    HB3  SER  16           HB1      SER  16  23.094  17.925  10.432
  974    HG   SER  16           HG       SER  16  24.503  16.460   8.515
  975    H    ALA  17           HN       ALA  17  24.307  19.443  12.058
  976    HA   ALA  17           HA       ALA  17  26.160  20.988  10.532
  977    HB1  ALA  17           HB1      ALA  17  25.333  22.880  11.798
  978    HB2  ALA  17           HB2      ALA  17  24.618  21.809  13.003
  979    HB3  ALA  17           HB3      ALA  17  23.971  21.849  11.363
  980    H    LEU  18           HN       LEU  18  26.200  19.527  13.713
  981    HA   LEU  18           HA       LEU  18  28.496  21.005  14.633
  982    HB2  LEU  18           HB2      LEU  18  26.693  18.932  15.691
  983    HB3  LEU  18           HB1      LEU  18  28.358  18.818  16.259
  984    HG   LEU  18           HG       LEU  18  28.251  21.272  16.826
  985   HD11  LEU  18          HD11      LEU  18  26.055  22.337  16.933
  986   HD12  LEU  18          HD12      LEU  18  25.285  20.869  16.332
  987   HD13  LEU  18          HD13      LEU  18  26.359  21.796  15.283
  988   HD21  LEU  18          HD21      LEU  18  26.192  19.479  18.153
  989   HD22  LEU  18          HD22      LEU  18  26.895  20.931  18.866
  990   HD23  LEU  18          HD23      LEU  18  27.911  19.525  18.540
  991    H    HIS  19           HN       HIS  19  27.902  17.940  13.016
  992    HA   HIS  19           HA       HIS  19  30.477  16.812  13.430
  993    HB2  HIS  19           HB2      HIS  19  28.503  15.485  12.764
  994    HB3  HIS  19           HB1      HIS  19  28.504  16.299  11.199
  995    HD2  HIS  19           HD2      HIS  19  29.976  14.904   9.338
  996    HE1  HIS  19           HE1      HIS  19  32.553  12.874  11.992
  997    HE2  HIS  19           HE2      HIS  19  31.921  13.175   9.552
  998    H    PHE  20           HN       PHE  20  29.023  18.658  10.751
  999    HA   PHE  20           HA       PHE  20  31.425  18.680   9.180
 1000    HB2  PHE  20           HB2      PHE  20  28.721  19.759   8.984
 1001    HB3  PHE  20           HB1      PHE  20  29.944  20.857   8.344
 1002    HD1  PHE  20           HD1      PHE  20  28.771  17.310   8.203
 1003    HD2  PHE  20           HD2      PHE  20  30.948  20.454   6.252
 1004    HE1  PHE  20           HE1      PHE  20  28.975  15.905   6.167
 1005    HE2  PHE  20           HE2      PHE  20  31.153  19.054   4.217
 1006    HZ   PHE  20           HZ       PHE  20  30.179  16.781   4.168
 1007    H    MET  21           HN       MET  21  30.117  20.657  11.753
 1008    HA   MET  21           HA       MET  21  31.638  23.002  11.352
 1009    HB2  MET  21           HB2      MET  21  30.199  21.729  13.623
 1010    HB3  MET  21           HB1      MET  21  31.399  22.957  14.031
 1011    HG2  MET  21           HG2      MET  21  29.341  23.446  11.884
 1012    HG3  MET  21           HG1      MET  21  28.978  23.756  13.581
 1013    HE1  MET  21           HE1      MET  21  29.643  25.340  14.922
 1014    HE2  MET  21           HE2      MET  21  30.681  26.734  14.638
 1015    HE3  MET  21           HE3      MET  21  31.401  25.173  15.016
 1016    H    ALA  22           HN       ALA  22  32.273  20.226  13.524
 1017    HA   ALA  22           HA       ALA  22  34.866  21.075  14.300
 1018    HB1  ALA  22           HB1      ALA  22  35.060  19.027  15.385
 1019    HB2  ALA  22           HB2      ALA  22  34.107  18.179  14.167
 1020    HB3  ALA  22           HB3      ALA  22  33.312  19.250  15.319
 1021    H    TRP  23           HN       TRP  23  33.712  18.985  11.678
 1022    HA   TRP  23           HA       TRP  23  36.195  18.037  10.772
 1023    HB2  TRP  23           HB2      TRP  23  33.481  18.045   9.861
 1024    HB3  TRP  23           HB1      TRP  23  34.534  18.490   8.516
 1025    HD1  TRP  23           HD1      TRP  23  33.998  15.692  11.092
 1026    HE1  TRP  23           HE1      TRP  23  35.089  13.537  10.190
 1027    HE3  TRP  23           HE3      TRP  23  36.268  17.535   6.903
 1028    HZ2  TRP  23           HZ2      TRP  23  36.711  12.704   7.985
 1029    HZ3  TRP  23           HZ3      TRP  23  37.578  16.041   5.422
 1030    HH2  TRP  23           HH2      TRP  23  37.802  13.628   5.957
 1031    H    THR  24           HN       THR  24  34.358  20.926   9.778
 1032    HA   THR  24           HA       THR  24  36.098  21.892   7.837
 1033    HB   THR  24           HB       THR  24  34.428  23.478   9.806
 1034    HG1  THR  24           HG1      THR  24  32.907  22.546   8.712
 1035   HG21  THR  24          HG21      THR  24  36.057  24.909   8.716
 1036   HG22  THR  24          HG22      THR  24  34.477  25.194   7.984
 1037   HG23  THR  24          HG23      THR  24  35.673  24.207   7.144
 1038    H    ILE  25           HN       ILE  25  36.078  22.481  11.352
 1039    HA   ILE  25           HA       ILE  25  38.321  24.229  11.368
 1040    HB   ILE  25           HB       ILE  25  37.113  22.468  13.502
 1041   HG12  ILE  25          HG12      ILE  25  37.116  25.482  13.206
 1042   HG13  ILE  25          HG11      ILE  25  35.841  24.461  12.541
 1043   HG21  ILE  25          HG21      ILE  25  38.475  23.953  15.055
 1044   HG22  ILE  25          HG22      ILE  25  39.390  24.459  13.635
 1045   HG23  ILE  25          HG23      ILE  25  39.406  22.768  14.139
 1046   HD11  ILE  25          HD11      ILE  25  35.217  25.306  14.776
 1047   HD12  ILE  25          HD12      ILE  25  36.667  24.571  15.458
 1048   HD13  ILE  25          HD13      ILE  25  35.391  23.551  14.792
 1049    H    GLY  26           HN       GLY  26  38.018  20.748  11.702
 1050    HA2  GLY  26           HA2      GLY  26  40.677  20.146  12.416
 1051    HA3  GLY  26           HA1      GLY  26  39.585  19.037  11.591
 1052    H    HIS  27           HN       HIS  27  39.144  20.283   9.203
 1053    HA   HIS  27           HA       HIS  27  41.455  19.635   7.719
 1054    HB2  HIS  27           HB2      HIS  27  39.043  19.657   6.908
 1055    HB3  HIS  27           HB1      HIS  27  39.213  21.404   6.748
 1056    HD2  HIS  27           HD2      HIS  27  40.086  18.226   4.766
 1057    HE1  HIS  27           HE1      HIS  27  42.233  21.382   2.964
 1058    HE2  HIS  27           HE2      HIS  27  41.519  18.959   2.711
 1059    H    LEU  28           HN       LEU  28  40.158  22.713   8.871
 1060    HA   LEU  28           HA       LEU  28  41.993  24.372   7.467
 1061    HB2  LEU  28           HB2      LEU  28  40.004  24.690   9.632
 1062    HB3  LEU  28           HB1      LEU  28  41.330  25.853   9.653
 1063    HG   LEU  28           HG       LEU  28  39.291  26.531   8.281
 1064   HD11  LEU  28          HD11      LEU  28  41.632  27.452   8.013
 1065   HD12  LEU  28          HD12      LEU  28  40.642  27.539   6.557
 1066   HD13  LEU  28          HD13      LEU  28  41.872  26.288   6.711
 1067   HD21  LEU  28          HD21      LEU  28  39.150  24.089   7.321
 1068   HD22  LEU  28          HD22      LEU  28  40.368  24.642   6.179
 1069   HD23  LEU  28          HD23      LEU  28  38.800  25.441   6.250
 1070    H    ASN  29           HN       ASN  29  42.070  22.823  10.619
 1071    HA   ASN  29           HA       ASN  29  43.822  22.410  12.043
 1072    HB2  ASN  29           HB2      ASN  29  44.967  22.456   9.462
 1073    HB3  ASN  29           HB1      ASN  29  46.036  23.399  10.499
 1074   HD21  ASN  29          HD21      ASN  29  45.284  20.227   9.550
 1075   HD22  ASN  29          HD22      ASN  29  46.052  19.406  10.822
 1076    H    GLN  30           HN       GLN  30  44.129  23.648  13.751
 1077    HA   GLN  30           HA       GLN  30  44.432  26.541  13.424
 1078    HB2  GLN  30           HB2      GLN  30  44.184  26.540  15.940
 1079    HB3  GLN  30           HB1      GLN  30  42.794  25.913  15.053
 1080    HG2  GLN  30           HG2      GLN  30  44.824  23.885  15.719
 1081    HG3  GLN  30           HG1      GLN  30  44.027  24.599  17.120
 1082   HE21  GLN  30          HE21      GLN  30  42.518  22.985  17.684
 1083   HE22  GLN  30          HE22      GLN  30  41.354  22.360  16.618
 1084    H    ILE  31           HN       ILE  31  46.631  24.801  12.689
 1085    HA   ILE  31           HA       ILE  31  48.913  24.760  12.883
 1086    HB   ILE  31           HB       ILE  31  48.496  27.031  14.851
 1087   HG12  ILE  31          HG12      ILE  31  49.175  27.186  11.917
 1088   HG13  ILE  31          HG11      ILE  31  47.525  27.330  12.521
 1089   HG21  ILE  31          HG21      ILE  31  50.793  27.564  14.447
 1090   HG22  ILE  31          HG22      ILE  31  50.920  26.324  13.201
 1091   HG23  ILE  31          HG23      ILE  31  50.729  25.859  14.890
 1092   HD11  ILE  31          HD11      ILE  31  48.558  29.553  12.252
 1093   HD12  ILE  31          HD12      ILE  31  49.854  29.084  13.352
 1094   HD13  ILE  31          HD13      ILE  31  48.200  29.222  13.947
 1095    H    LYS  32           HN       LYS  32  48.334  25.817  16.220
 1096    HA   LYS  32           HA       LYS  32  48.513  23.189  17.307
 1097    HB2  LYS  32           HB2      LYS  32  50.942  24.536  16.731
 1098    HB3  LYS  32           HB1      LYS  32  50.728  24.598  18.480
 1099    HG2  LYS  32           HG2      LYS  32  50.004  22.001  17.925
 1100    HG3  LYS  32           HG1      LYS  32  51.278  22.287  16.741
 1101    HD2  LYS  32           HD2      LYS  32  52.728  23.136  18.591
 1102    HD3  LYS  32           HD1      LYS  32  51.460  22.690  19.734
 1103    HE2  LYS  32           HE2      LYS  32  51.616  20.347  18.535
 1104    HE3  LYS  32           HE1      LYS  32  53.221  20.915  18.078
 1105    HZ1  LYS  32           HZ1      LYS  32  53.913  20.347  20.088
 1106    HZ2  LYS  32           HZ2      LYS  32  52.341  19.928  20.569
 1107    HZ3  LYS  32           HZ3      LYS  32  52.897  21.520  20.774
 1108    H    ARG  33           HN       ARG  33  46.856  25.636  17.425
 1109    HA   ARG  33           HA       ARG  33  45.706  26.875  18.982
 1110    HB2  ARG  33           HB2      ARG  33  45.359  24.570  19.896
 1111    HB3  ARG  33           HB1      ARG  33  46.761  24.822  20.937
 1112    HG2  ARG  33           HG2      ARG  33  45.699  26.631  22.086
 1113    HG3  ARG  33           HG1      ARG  33  44.392  26.703  20.904
 1114    HD2  ARG  33           HD2      ARG  33  43.689  24.415  21.581
 1115    HD3  ARG  33           HD1      ARG  33  44.955  24.406  22.802
 1116    HE   ARG  33           HE       ARG  33  42.442  25.850  22.926
 1117   HH11  ARG  33          HH11      ARG  33  45.722  25.583  24.087
 1118   HH12  ARG  33          HH12      ARG  33  45.388  26.400  25.568
 1119   HH21  ARG  33          HH21      ARG  33  42.035  26.928  24.880
 1120   HH22  ARG  33          HH22      ARG  33  43.320  27.162  26.018