*HEADER    SIGNALING PROTEIN                       13-AUG-19   6KOW              
*TITLE     RETRACTED STATE OF S65/T66 DOUBLE-PHOSPHORYLATED UBIQUITIN            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: POLYUBIQUITIN-B;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: UBB;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    PHOSPHORYLATION, UBIQUITIN, PH-SENSOR, SIGNALING PROTEIN              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    X.DONG,C.TANG                                                         
*REVDAT   1   28-AUG-19 6KOW    0                                                
# Restraints file 1: rt_talos.upload
! talos_pred2xplor.nawk Table !   Date: 2019? 03? 21? ??? 13:02:05 CST
!   Path: /home/chxxd/server/share2/data/dongxu/nmr/pp_Ubiquitin/structure/talos/minor
!
! V5 dihedrals

assign (resid   4 and name c)  (resid   5 and name n)
       (resid   5 and name ca) (resid   5 and name c)  1.0 -116.0  25.0 2      ! V5 talos phi

assign (resid   5 and name n)  (resid   5 and name ca)
       (resid   5 and name c) (resid   6 and name n)  1.0  123.0  20.0 2      ! V5 talos psi

! K6 dihedrals

assign (resid   5 and name c)  (resid   6 and name n)
       (resid   6 and name ca) (resid   6 and name c)  1.0 -108.0  20.0 2      ! K6 talos phi

assign (resid   6 and name n)  (resid   6 and name ca)
       (resid   6 and name c) (resid   7 and name n)  1.0  132.0  20.0 2      ! K6 talos psi

! T7 dihedrals

assign (resid   6 and name c)  (resid   7 and name n)
       (resid   7 and name ca) (resid   7 and name c)  1.0  -91.0  20.0 2      ! T7 talos phi

assign (resid   7 and name n)  (resid   7 and name ca)
       (resid   7 and name c) (resid   8 and name n)  1.0  169.0  20.0 2      ! T7 talos psi

! L8 dihedrals

assign (resid   7 and name c)  (resid   8 and name n)
       (resid   8 and name ca) (resid   8 and name c)  1.0  -59.0  20.0 2      ! L8 talos phi

assign (resid   8 and name n)  (resid   8 and name ca)
       (resid   8 and name c) (resid   9 and name n)  1.0  -26.0  20.0 2      ! L8 talos psi

! T9 dihedrals

assign (resid   8 and name c)  (resid   9 and name n)
       (resid   9 and name ca) (resid   9 and name c)  1.0  -99.0  20.0 2      ! T9 talos phi

assign (resid   9 and name n)  (resid   9 and name ca)
       (resid   9 and name c) (resid  10 and name n)  1.0   -5.0  28.0 2      ! T9 talos psi

! G10 dihedrals

assign (resid   9 and name c)  (resid  10 and name n)
       (resid  10 and name ca) (resid  10 and name c)  1.0   88.0  20.0 2      ! G10 talos phi

assign (resid  10 and name n)  (resid  10 and name ca)
       (resid  10 and name c) (resid  11 and name n)  1.0    2.0  20.0 2      ! G10 talos psi

! T12 dihedrals

assign (resid  11 and name c)  (resid  12 and name n)
       (resid  12 and name ca) (resid  12 and name c)  1.0 -113.0  20.0 2      ! T12 talos phi

assign (resid  12 and name n)  (resid  12 and name ca)
       (resid  12 and name c) (resid  13 and name n)  1.0  137.0  20.0 2      ! T12 talos psi

! I13 dihedrals

assign (resid  12 and name c)  (resid  13 and name n)
       (resid  13 and name ca) (resid  13 and name c)  1.0 -117.0  25.0 2      ! I13 talos phi

assign (resid  13 and name n)  (resid  13 and name ca)
       (resid  13 and name c) (resid  14 and name n)  1.0  134.0  20.0 2      ! I13 talos psi

! T14 dihedrals

assign (resid  13 and name c)  (resid  14 and name n)
       (resid  14 and name ca) (resid  14 and name c)  1.0 -118.0  20.0 2      ! T14 talos phi

assign (resid  14 and name n)  (resid  14 and name ca)
       (resid  14 and name c) (resid  15 and name n)  1.0  128.0  20.0 2      ! T14 talos psi

! L15 dihedrals

assign (resid  14 and name c)  (resid  15 and name n)
       (resid  15 and name ca) (resid  15 and name c)  1.0 -124.0  20.0 2      ! L15 talos phi

assign (resid  15 and name n)  (resid  15 and name ca)
       (resid  15 and name c) (resid  16 and name n)  1.0  141.0  25.0 2      ! L15 talos psi

! E16 dihedrals

assign (resid  15 and name c)  (resid  16 and name n)
       (resid  16 and name ca) (resid  16 and name c)  1.0 -113.0  22.0 2      ! E16 talos phi

assign (resid  16 and name n)  (resid  16 and name ca)
       (resid  16 and name c) (resid  17 and name n)  1.0  139.0  26.0 2      ! E16 talos psi

! V17 dihedrals

assign (resid  16 and name c)  (resid  17 and name n)
       (resid  17 and name ca) (resid  17 and name c)  1.0 -135.0  25.0 2      ! V17 talos phi

assign (resid  17 and name n)  (resid  17 and name ca)
       (resid  17 and name c) (resid  18 and name n)  1.0  168.0  20.0 2      ! V17 talos psi

! E18 dihedrals

assign (resid  18 and name n)  (resid  18 and name ca)
       (resid  18 and name c) (resid  19 and name n)  1.0  136.0  29.0 2      ! E18 talos psi

! P19 dihedrals

assign (resid  18 and name c)  (resid  19 and name n)
       (resid  19 and name ca) (resid  19 and name c)  1.0  -59.0  20.0 2      ! P19 talos phi

assign (resid  19 and name n)  (resid  19 and name ca)
       (resid  19 and name c) (resid  20 and name n)  1.0  -20.0  20.0 2      ! P19 talos psi

! S20 dihedrals

assign (resid  19 and name c)  (resid  20 and name n)
       (resid  20 and name ca) (resid  20 and name c)  1.0  -99.0  23.0 2      ! S20 talos phi

assign (resid  20 and name n)  (resid  20 and name ca)
       (resid  20 and name c) (resid  21 and name n)  1.0   -2.0  20.0 2      ! S20 talos psi

! T22 dihedrals

assign (resid  21 and name c)  (resid  22 and name n)
       (resid  22 and name ca) (resid  22 and name c)  1.0 -110.0  31.0 2      ! T22 talos phi

assign (resid  22 and name n)  (resid  22 and name ca)
       (resid  22 and name c) (resid  23 and name n)  1.0  165.0  20.0 2      ! T22 talos psi

! I23 dihedrals

assign (resid  22 and name c)  (resid  23 and name n)
       (resid  23 and name ca) (resid  23 and name c)  1.0  -65.0  20.0 2      ! I23 talos phi

assign (resid  23 and name n)  (resid  23 and name ca)
       (resid  23 and name c) (resid  24 and name n)  1.0  -36.0  20.0 2      ! I23 talos psi

! E24 dihedrals

assign (resid  23 and name c)  (resid  24 and name n)
       (resid  24 and name ca) (resid  24 and name c)  1.0  -65.0  20.0 2      ! E24 talos phi

assign (resid  24 and name n)  (resid  24 and name ca)
       (resid  24 and name c) (resid  25 and name n)  1.0  -39.0  20.0 2      ! E24 talos psi

! N25 dihedrals

assign (resid  24 and name c)  (resid  25 and name n)
       (resid  25 and name ca) (resid  25 and name c)  1.0  -66.0  20.0 2      ! N25 talos phi

assign (resid  25 and name n)  (resid  25 and name ca)
       (resid  25 and name c) (resid  26 and name n)  1.0  -41.0  20.0 2      ! N25 talos psi

! V26 dihedrals

assign (resid  25 and name c)  (resid  26 and name n)
       (resid  26 and name ca) (resid  26 and name c)  1.0  -63.0  20.0 2      ! V26 talos phi

assign (resid  26 and name n)  (resid  26 and name ca)
       (resid  26 and name c) (resid  27 and name n)  1.0  -43.0  20.0 2      ! V26 talos psi

! K27 dihedrals

assign (resid  26 and name c)  (resid  27 and name n)
       (resid  27 and name ca) (resid  27 and name c)  1.0  -59.0  20.0 2      ! K27 talos phi

assign (resid  27 and name n)  (resid  27 and name ca)
       (resid  27 and name c) (resid  28 and name n)  1.0  -42.0  20.0 2      ! K27 talos psi

! A28 dihedrals

assign (resid  27 and name c)  (resid  28 and name n)
       (resid  28 and name ca) (resid  28 and name c)  1.0  -65.0  20.0 2      ! A28 talos phi

assign (resid  28 and name n)  (resid  28 and name ca)
       (resid  28 and name c) (resid  29 and name n)  1.0  -37.0  20.0 2      ! A28 talos psi

! K29 dihedrals

assign (resid  28 and name c)  (resid  29 and name n)
       (resid  29 and name ca) (resid  29 and name c)  1.0  -65.0  20.0 2      ! K29 talos phi

assign (resid  29 and name n)  (resid  29 and name ca)
       (resid  29 and name c) (resid  30 and name n)  1.0  -44.0  20.0 2      ! K29 talos psi

! I30 dihedrals

assign (resid  29 and name c)  (resid  30 and name n)
       (resid  30 and name ca) (resid  30 and name c)  1.0  -64.0  20.0 2      ! I30 talos phi

assign (resid  30 and name n)  (resid  30 and name ca)
       (resid  30 and name c) (resid  31 and name n)  1.0  -45.0  20.0 2      ! I30 talos psi

! Q31 dihedrals

assign (resid  30 and name c)  (resid  31 and name n)
       (resid  31 and name ca) (resid  31 and name c)  1.0  -64.0  25.0 2      ! Q31 talos phi

assign (resid  31 and name n)  (resid  31 and name ca)
       (resid  31 and name c) (resid  32 and name n)  1.0  -39.0  20.0 2      ! Q31 talos psi

! D32 dihedrals

assign (resid  31 and name c)  (resid  32 and name n)
       (resid  32 and name ca) (resid  32 and name c)  1.0  -68.0  20.0 2      ! D32 talos phi

assign (resid  32 and name n)  (resid  32 and name ca)
       (resid  32 and name c) (resid  33 and name n)  1.0  -33.0  20.0 2      ! D32 talos psi

! K33 dihedrals

assign (resid  32 and name c)  (resid  33 and name n)
       (resid  33 and name ca) (resid  33 and name c)  1.0  -86.0  25.0 2      ! K33 talos phi

assign (resid  33 and name n)  (resid  33 and name ca)
       (resid  33 and name c) (resid  34 and name n)  1.0  -33.0  20.0 2      ! K33 talos psi

! E34 dihedrals

assign (resid  33 and name c)  (resid  34 and name n)
       (resid  34 and name ca) (resid  34 and name c)  1.0  -97.0  20.0 2      ! E34 talos phi

assign (resid  34 and name n)  (resid  34 and name ca)
       (resid  34 and name c) (resid  35 and name n)  1.0  -12.0  20.0 2      ! E34 talos psi

! G35 dihedrals

assign (resid  34 and name c)  (resid  35 and name n)
       (resid  35 and name ca) (resid  35 and name c)  1.0   73.0  20.0 2      ! G35 talos phi

assign (resid  35 and name n)  (resid  35 and name ca)
       (resid  35 and name c) (resid  36 and name n)  1.0   19.0  20.0 2      ! G35 talos psi

! I36 dihedrals

assign (resid  35 and name c)  (resid  36 and name n)
       (resid  36 and name ca) (resid  36 and name c)  1.0 -101.0  29.0 2      ! I36 talos phi

assign (resid  36 and name n)  (resid  36 and name ca)
       (resid  36 and name c) (resid  37 and name n)  1.0  118.0  26.0 2      ! I36 talos psi

! P37 dihedrals

assign (resid  36 and name c)  (resid  37 and name n)
       (resid  37 and name ca) (resid  37 and name c)  1.0  -64.0  20.0 2      ! P37 talos phi

assign (resid  37 and name n)  (resid  37 and name ca)
       (resid  37 and name c) (resid  38 and name n)  1.0  142.0  20.0 2      ! P37 talos psi

! P38 dihedrals

assign (resid  37 and name c)  (resid  38 and name n)
       (resid  38 and name ca) (resid  38 and name c)  1.0  -55.0  20.0 2      ! P38 talos phi

assign (resid  38 and name n)  (resid  38 and name ca)
       (resid  38 and name c) (resid  39 and name n)  1.0  -34.0  20.0 2      ! P38 talos psi

! D39 dihedrals

assign (resid  38 and name c)  (resid  39 and name n)
       (resid  39 and name ca) (resid  39 and name c)  1.0  -67.0  20.0 2      ! D39 talos phi

assign (resid  39 and name n)  (resid  39 and name ca)
       (resid  39 and name c) (resid  40 and name n)  1.0  -25.0  20.0 2      ! D39 talos psi

! Q40 dihedrals

assign (resid  39 and name c)  (resid  40 and name n)
       (resid  40 and name ca) (resid  40 and name c)  1.0  -98.0  20.0 2      ! Q40 talos phi

assign (resid  40 and name n)  (resid  40 and name ca)
       (resid  40 and name c) (resid  41 and name n)  1.0  -14.0  25.0 2      ! Q40 talos psi

! R42 dihedrals

assign (resid  41 and name c)  (resid  42 and name n)
       (resid  42 and name ca) (resid  42 and name c)  1.0 -106.0  25.0 2      ! R42 talos phi

assign (resid  42 and name n)  (resid  42 and name ca)
       (resid  42 and name c) (resid  43 and name n)  1.0  117.0  20.0 2      ! R42 talos psi

! L43 dihedrals

assign (resid  42 and name c)  (resid  43 and name n)
       (resid  43 and name ca) (resid  43 and name c)  1.0 -114.0  25.0 2      ! L43 talos phi

assign (resid  43 and name n)  (resid  43 and name ca)
       (resid  43 and name c) (resid  44 and name n)  1.0  135.0  20.0 2      ! L43 talos psi

! I44 dihedrals

assign (resid  43 and name c)  (resid  44 and name n)
       (resid  44 and name ca) (resid  44 and name c)  1.0 -111.0  20.0 2      ! I44 talos phi

assign (resid  44 and name n)  (resid  44 and name ca)
       (resid  44 and name c) (resid  45 and name n)  1.0  125.0  20.0 2      ! I44 talos psi

! F45 dihedrals

assign (resid  44 and name c)  (resid  45 and name n)
       (resid  45 and name ca) (resid  45 and name c)  1.0 -130.0  20.0 2      ! F45 talos phi

assign (resid  45 and name n)  (resid  45 and name ca)
       (resid  45 and name c) (resid  46 and name n)  1.0  145.0  42.0 2      ! F45 talos psi

! A46 dihedrals

assign (resid  45 and name c)  (resid  46 and name n)
       (resid  46 and name ca) (resid  46 and name c)  1.0   55.0  20.0 2      ! A46 talos phi

assign (resid  46 and name n)  (resid  46 and name ca)
       (resid  46 and name c) (resid  47 and name n)  1.0   40.0  20.0 2      ! A46 talos psi

! G47 dihedrals

assign (resid  46 and name c)  (resid  47 and name n)
       (resid  47 and name ca) (resid  47 and name c)  1.0   79.0  20.0 2      ! G47 talos phi

assign (resid  47 and name n)  (resid  47 and name ca)
       (resid  47 and name c) (resid  48 and name n)  1.0    1.0  20.0 2      ! G47 talos psi

! K48 dihedrals

assign (resid  47 and name c)  (resid  48 and name n)
       (resid  48 and name ca) (resid  48 and name c)  1.0 -116.0  25.0 2      ! K48 talos phi

assign (resid  48 and name n)  (resid  48 and name ca)
       (resid  48 and name c) (resid  49 and name n)  1.0  145.0  20.0 2      ! K48 talos psi

! Q49 dihedrals

assign (resid  48 and name c)  (resid  49 and name n)
       (resid  49 and name ca) (resid  49 and name c)  1.0 -103.0  30.0 2      ! Q49 talos phi

assign (resid  49 and name n)  (resid  49 and name ca)
       (resid  49 and name c) (resid  50 and name n)  1.0  145.0  31.0 2      ! Q49 talos psi

! L50 dihedrals

assign (resid  49 and name c)  (resid  50 and name n)
       (resid  50 and name ca) (resid  50 and name c)  1.0  -94.0  26.0 2      ! L50 talos phi

assign (resid  50 and name n)  (resid  50 and name ca)
       (resid  50 and name c) (resid  51 and name n)  1.0  124.0  22.0 2      ! L50 talos psi

! E51 dihedrals

assign (resid  50 and name c)  (resid  51 and name n)
       (resid  51 and name ca) (resid  51 and name c)  1.0 -114.0  20.0 2      ! E51 talos phi

assign (resid  51 and name n)  (resid  51 and name ca)
       (resid  51 and name c) (resid  52 and name n)  1.0  139.0  20.0 2      ! E51 talos psi

! D52 dihedrals

assign (resid  51 and name c)  (resid  52 and name n)
       (resid  52 and name ca) (resid  52 and name c)  1.0  -76.0  31.0 2      ! D52 talos phi

assign (resid  52 and name n)  (resid  52 and name ca)
       (resid  52 and name c) (resid  53 and name n)  1.0  136.0  20.0 2      ! D52 talos psi

! R54 dihedrals

assign (resid  54 and name n)  (resid  54 and name ca)
       (resid  54 and name c) (resid  55 and name n)  1.0  157.0  20.0 2      ! R54 talos psi

! T55 dihedrals

assign (resid  54 and name c)  (resid  55 and name n)
       (resid  55 and name ca) (resid  55 and name c)  1.0  -94.0  25.0 2      ! T55 talos phi

assign (resid  55 and name n)  (resid  55 and name ca)
       (resid  55 and name c) (resid  56 and name n)  1.0  168.0  20.0 2      ! T55 talos psi

! L56 dihedrals

assign (resid  55 and name c)  (resid  56 and name n)
       (resid  56 and name ca) (resid  56 and name c)  1.0  -62.0  20.0 2      ! L56 talos phi

assign (resid  56 and name n)  (resid  56 and name ca)
       (resid  56 and name c) (resid  57 and name n)  1.0  -39.0  20.0 2      ! L56 talos psi

! S57 dihedrals

assign (resid  56 and name c)  (resid  57 and name n)
       (resid  57 and name ca) (resid  57 and name c)  1.0  -66.0  20.0 2      ! S57 talos phi

assign (resid  57 and name n)  (resid  57 and name ca)
       (resid  57 and name c) (resid  58 and name n)  1.0  -38.0  20.0 2      ! S57 talos psi

! D58 dihedrals

assign (resid  57 and name c)  (resid  58 and name n)
       (resid  58 and name ca) (resid  58 and name c)  1.0  -63.0  20.0 2      ! D58 talos phi

assign (resid  58 and name n)  (resid  58 and name ca)
       (resid  58 and name c) (resid  59 and name n)  1.0  -28.0  20.0 2      ! D58 talos psi

! Y59 dihedrals

assign (resid  58 and name c)  (resid  59 and name n)
       (resid  59 and name ca) (resid  59 and name c)  1.0  -94.0  20.0 2      ! Y59 talos phi

assign (resid  59 and name n)  (resid  59 and name ca)
       (resid  59 and name c) (resid  60 and name n)  1.0    4.0  20.0 2      ! Y59 talos psi

! N60 dihedrals

assign (resid  59 and name c)  (resid  60 and name n)
       (resid  60 and name ca) (resid  60 and name c)  1.0   58.0  20.0 2      ! N60 talos phi

assign (resid  60 and name n)  (resid  60 and name ca)
       (resid  60 and name c) (resid  61 and name n)  1.0   42.0  20.0 2      ! N60 talos psi

! I61 dihedrals

assign (resid  60 and name c)  (resid  61 and name n)
       (resid  61 and name ca) (resid  61 and name c)  1.0  -81.0  20.0 2      ! I61 talos phi

assign (resid  61 and name n)  (resid  61 and name ca)
       (resid  61 and name c) (resid  62 and name n)  1.0  130.0  20.0 2      ! I61 talos psi

! K63 dihedrals

assign (resid  62 and name c)  (resid  63 and name n)
       (resid  63 and name ca) (resid  63 and name c)  1.0  -87.0  21.0 2      ! K63 talos phi

assign (resid  63 and name n)  (resid  63 and name ca)
       (resid  63 and name c) (resid  64 and name n)  1.0   -9.0  21.0 2      ! K63 talos psi

! L67 dihedrals

assign (resid  66 and name c)  (resid  67 and name n)
       (resid  67 and name ca) (resid  67 and name c)  1.0 -126.0  59.0 2      ! L67 talos phi

assign (resid  67 and name n)  (resid  67 and name ca)
       (resid  67 and name c) (resid  68 and name n)  1.0  138.0  20.0 2      ! L67 talos psi

! H68 dihedrals

assign (resid  67 and name c)  (resid  68 and name n)
       (resid  68 and name ca) (resid  68 and name c)  1.0 -111.0  20.0 2      ! H68 talos phi

assign (resid  68 and name n)  (resid  68 and name ca)
       (resid  68 and name c) (resid  69 and name n)  1.0  131.0  20.0 2      ! H68 talos psi

! L69 dihedrals

assign (resid  68 and name c)  (resid  69 and name n)
       (resid  69 and name ca) (resid  69 and name c)  1.0 -119.0  20.0 2      ! L69 talos phi

assign (resid  69 and name n)  (resid  69 and name ca)
       (resid  69 and name c) (resid  70 and name n)  1.0  145.0  20.0 2      ! L69 talos psi

! V70 dihedrals

assign (resid  69 and name c)  (resid  70 and name n)
       (resid  70 and name ca) (resid  70 and name c)  1.0 -126.0  20.0 2      ! V70 talos phi

assign (resid  70 and name n)  (resid  70 and name ca)
       (resid  70 and name c) (resid  71 and name n)  1.0  127.0  20.0 2      ! V70 talos psi

! L71 dihedrals

assign (resid  70 and name c)  (resid  71 and name n)
       (resid  71 and name ca) (resid  71 and name c)  1.0 -108.0  25.0 2      ! L71 talos phi

assign (resid  71 and name n)  (resid  71 and name ca)
       (resid  71 and name c) (resid  72 and name n)  1.0  127.0  20.0 2      ! L71 talos psi

! R72 dihedrals

assign (resid  71 and name c)  (resid  72 and name n)
       (resid  72 and name ca) (resid  72 and name c)  1.0 -123.0  23.0 2      ! R72 talos phi

assign (resid  72 and name n)  (resid  72 and name ca)
       (resid  72 and name c) (resid  73 and name n)  1.0  145.0  20.0 2      ! R72 talos psi

! L73 dihedrals

assign (resid  72 and name c)  (resid  73 and name n)
       (resid  73 and name ca) (resid  73 and name c)  1.0  -96.0  20.0 2      ! L73 talos phi

assign (resid  73 and name n)  (resid  73 and name ca)
       (resid  73 and name c) (resid  74 and name n)  1.0  146.0  20.0 2      ! L73 talos psi

# Restraints file 2: rt_noe.upload
assign (segid "    " and resid   14 and name   HB) (segid "    " and resid   14 and name HG2*) 2.755 0.949 0.949 weight 1.000 ! spec=CNOE_major, no=8, id=175, vol=3.205627e+08
assign (segid "    " and resid   14 and name   HB) (segid "    " and resid   14 and name   HA) 3.141 1.234 1.234 weight 1.000 ! spec=CNOE_major, no=9, id=176, vol=1.458227e+08
assign (segid "    " and resid   32 and name  HB1) (segid "    " and resid   32 and name   HN) 3.097 1.199 1.199 weight 1.000 ! spec=CNOE_major, no=14, id=177, vol=1.588992e+08
assign (segid "    " and resid   33 and name  HB1) (segid "    " and resid   33 and name   HN) 3.399 1.444 1.444 weight 1.000 ! spec=CNOE_major, no=16, id=179, vol=9.094419e+07
assign (segid "    " and resid   33 and name  HB2) (segid "    " and resid   33 and name   HN) 3.338 1.393 1.393 weight 1.000 ! spec=CNOE_major, no=17, id=180, vol=1.012885e+08
assign (segid "    " and resid   33 and name  HG2) (segid "    " and resid   33 and name   HN) 3.401 1.446 1.446 weight 1.000 ! spec=CNOE_major, no=20, id=181, vol=9.049814e+07
assign (segid "    " and resid   47 and name   HN) (segid "    " and resid   47 and name  HA2) 3.374 1.423 1.423 weight 1.000 ! spec=CNOE_major, no=25, id=184, vol=9.493036e+07
assign (segid "    " and resid   43 and name HD1*) (segid "    " and resid   44 and name   HN) 3.251 1.321 1.321 weight 1.000 ! spec=CNOE_major, no=34, id=186, vol=1.187826e+08
assign (segid "    " and resid   68 and name   HA) (segid "    " and resid   68 and name  HB2) 3.580 1.602 1.602 weight 1.000 ! spec=CNOE_major, no=36, id=187, vol=6.660864e+07
assign (segid "    " and resid   68 and name   HA) (segid "    " and resid    4 and name  HB1) 3.858 1.860 1.860 weight 1.000 ! spec=CNOE_major, no=42, id=188, vol=4.251167e+07
assign (segid "    " and resid   68 and name   HA) (segid "    " and resid    4 and name  HB2) 4.202 2.207 2.207 weight 1.000 ! spec=CNOE_major, no=44, id=189, vol=2.546950e+07
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   72 and name   HN) 2.479 0.768 0.768 weight 1.000 ! spec=CNOE_major, no=45, id=190, vol=6.034261e+08
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   43 and name  HB1) 2.697 0.909 0.909 weight 1.000 ! spec=CNOE_major, no=46, id=191, vol=3.638459e+08
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   43 and name HD1*) 2.510 0.787 0.787 weight 1.000 ! spec=CNOE_major, no=47, id=192, vol=5.605812e+08
assign (segid "    " and resid    4 and name   HN) (segid "    " and resid    4 and name   HA) 2.616 0.855 0.855 weight 1.000 ! spec=CNOE_major, no=54, id=194, vol=4.375850e+08
assign (segid "    " and resid    4 and name   HA) (segid "    " and resid   12 and name HG2*) 3.042 1.156 1.156 weight 1.000 ! spec=CNOE_major, no=58, id=195, vol=1.770177e+08
  
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    4 and name   HA) 2.762 0.953 0.953 weight 1.000 ! spec=CNOE_major, no=64, id=197, vol=3.158303e+08

assign (segid "    " and resid    5 and name HG2*) (segid "    " and resid    5 and name   HB) 2.569 0.825 0.825 weight 1.000 ! spec=CNOE_major, no=69, id=199, vol=4.869779e+08
 
assign (segid "    " and resid    5 and name HG2*) (segid "    " and resid   69 and name  HB2) 2.535 0.804 0.804 weight 1.000 ! spec=CNOE_major, no=70, id=200, vol=5.274998e+08
   
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    7 and name HG2*) 3.074 1.181 1.181 weight 1.000 ! spec=CNOE_major, no=72, id=201, vol=1.660516e+08

assign (segid "    " and resid    7 and name HG2*) (segid "    " and resid    7 and name   HA) 2.713 0.920 0.920 weight 1.000 ! spec=CNOE_major, no=73, id=202, vol=3.516191e+08

assign (segid "    " and resid    7 and name HG2*) (segid "    " and resid    5 and name HG1*) 4.136 2.138 2.138 weight 1.000 ! spec=CNOE_major, no=77, id=203, vol=2.800107e+07

assign (segid "    " and resid    9 and name HG2*) (segid "    " and resid   10 and name   HN) 3.042 1.157 1.157 weight 1.000 ! spec=CNOE_major, no=79, id=204, vol=1.767510e+08
   
assign (segid "    " and resid   13 and name   HA) (segid "    " and resid   14 and name   HN) 2.930 1.073 1.073 weight 1.000 ! spec=CNOE_major, no=82, id=205, vol=2.216766e+08
assign (segid "    " and resid   44 and name HD1*) (segid "    " and resid   43 and name   HN) 4.124 2.126 2.126 weight 1.000 ! spec=CNOE_major, no=86, id=207, vol=2.849816e+07
 
assign (segid "    " and resid   44 and name HD1*) (segid "    " and resid   50 and name   HN) 3.924 1.925 1.925 weight 1.000 ! spec=CNOE_major, no=87, id=208, vol=3.838934e+07
  
assign (segid "    " and resid   44 and name HD1*) (segid "    " and resid   49 and name   HA) 3.267 1.334 1.334 weight 1.000 ! spec=CNOE_major, no=90, id=209, vol=1.152208e+08
   
assign (segid "    " and resid   44 and name HD1*) (segid "    " and resid   49 and name  HG2) 3.394 1.440 1.440 weight 1.000 ! spec=CNOE_major, no=92, id=210, vol=9.174821e+07
  
assign (segid "    " and resid   50 and name HD2*) (segid "    " and resid   59 and name  HD1) 3.375 1.424 1.424 weight 1.000 ! spec=CNOE_major, no=95, id=211, vol=9.488024e+07

assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   50 and name HD1*) 3.347 1.400 1.400 weight 1.000 ! spec=CNOE_major, no=96, id=212, vol=9.969143e+07
  
assign (segid "    " and resid   50 and name HD1*) (segid "    " and resid   59 and name  HD1) 4.022 2.022 2.022 weight 1.000 ! spec=CNOE_major, no=97, id=213, vol=3.311897e+07

assign (segid "    " and resid   50 and name HD1*) (segid "    " and resid   59 and name  HE1) 4.630 2.680 2.680 weight 1.000 ! spec=CNOE_major, no=98, id=214, vol=1.422421e+07
    
assign (segid "    " and resid   50 and name HD1*) (segid "    " and resid   49 and name   HA) 3.880 1.882 1.882 weight 1.000 ! spec=CNOE_major, no=100, id=215, vol=4.104785e+07

assign (segid "    " and resid   50 and name HD1*) (segid "    " and resid   50 and name  HB2) 2.450 0.750 0.750 weight 1.000 ! spec=CNOE_major, no=103, id=217, vol=6.479741e+08
  
assign (segid "    " and resid   50 and name HD1*) (segid "    " and resid   50 and name HD2*) 3.018 1.138 1.138 weight 1.000 ! spec=CNOE_major, no=104, id=218, vol=1.855577e+08
  
assign (segid "    " and resid   50 and name HD2*) (segid "    " and resid   59 and name  HE1) 3.760 1.767 1.767 weight 1.000 ! spec=CNOE_major, no=105, id=219, vol=4.957810e+07

assign (segid "    " and resid   50 and name HD2*) (segid "    " and resid   49 and name   HA) 3.873 1.875 1.875 weight 1.000 ! spec=CNOE_major, no=108, id=221, vol=4.150216e+07
    
assign (segid "    " and resid   50 and name HD2*) (segid "    " and resid   45 and name  HB2) 2.955 1.092 1.092 weight 1.000 ! spec=CNOE_major, no=111, id=222, vol=2.103966e+08
   
assign (segid "    " and resid   50 and name HD2*) (segid "    " and resid   59 and name  HB2) 3.933 1.933 1.933 weight 1.000 ! spec=CNOE_major, no=112, id=223, vol=3.788549e+07

assign (segid "    " and resid   50 and name HD2*) (segid "    " and resid   48 and name  HB2) 3.384 1.431 1.431 weight 1.000 ! spec=CNOE_major, no=113, id=224, vol=9.330938e+07
   
assign (segid "    " and resid   50 and name HD2*) (segid "    " and resid   50 and name  HB2) 2.815 0.991 0.991 weight 1.000 ! spec=CNOE_major, no=114, id=225, vol=2.816045e+08

assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   50 and name HD2*) 3.547 1.572 1.572 weight 1.000 ! spec=CNOE_major, no=116, id=226, vol=7.039354e+07

assign (segid "    " and resid   50 and name HD2*) (segid "    " and resid   50 and name   HA) 2.855 1.019 1.019 weight 1.000 ! spec=CNOE_major, no=118, id=227, vol=2.586491e+08
 
assign (segid "    " and resid   50 and name   HA) (segid "    " and resid   50 and name  HB1) 3.004 1.128 1.128 weight 1.000 ! spec=CNOE_major, no=119, id=228, vol=1.906794e+08
assign (segid "    " and resid   50 and name   HA) (segid "    " and resid   50 and name  HB2) 2.870 1.030 1.030 weight 1.000 ! spec=CNOE_major, no=120, id=229, vol=2.505530e+08
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   43 and name  HB2) 2.796 0.977 0.977 weight 1.000 ! spec=CNOE_major, no=122, id=230, vol=2.933735e+08
assign (segid "    " and resid   43 and name HD1*) (segid "    " and resid   43 and name  HB1) 2.414 0.728 0.728 weight 1.000 ! spec=CNOE_major, no=125, id=232, vol=7.081649e+08
   
assign (segid "    " and resid   50 and name HD1*) (segid "    " and resid   45 and name  HB2) 3.279 1.344 1.344 weight 1.000 ! spec=CNOE_major, no=140, id=233, vol=1.127284e+08
   
assign (segid "    " and resid   50 and name HD1*) (segid "    " and resid   50 and name   HA) 3.399 1.444 1.444 weight 1.000 ! spec=CNOE_major, no=142, id=234, vol=9.082469e+07

assign (segid "    " and resid   69 and name   HN) (segid "    " and resid   69 and name   HA) 3.109 1.208 1.208 weight 1.000 ! spec=NNOE_major, no=6, id=0, vol=4.939767e+07
assign (segid "    " and resid   69 and name   HN) (segid "    " and resid   68 and name   HA) 3.147 1.238 1.238 weight 1.000 ! spec=NNOE_major, no=7, id=1, vol=4.593553e+07
assign (segid "    " and resid   69 and name   HN) (segid "    " and resid    5 and name   HA) 3.436 1.476 1.476 weight 1.000 ! spec=NNOE_major, no=8, id=2, vol=2.709704e+07
assign (segid "    " and resid   69 and name   HN) (segid "    " and resid   69 and name  HB2) 3.263 1.331 1.331 weight 1.000 ! spec=NNOE_major, no=9, id=3, vol=3.695337e+07
assign (segid "    " and resid   69 and name   HN) (segid "    " and resid    5 and name HG1*) 3.625 1.643 1.643 weight 1.000 ! spec=NNOE_major, no=10, id=4, vol=1.964678e+07
 
assign (segid "    " and resid   70 and name   HN) (segid "    " and resid   70 and name   HB) 3.158 1.246 1.246 weight 1.000 ! spec=NNOE_major, no=12, id=5, vol=4.498361e+07
assign (segid "    " and resid   70 and name   HN) (segid "    " and resid   69 and name   HA) 3.101 1.202 1.202 weight 1.000 ! spec=NNOE_major, no=13, id=6, vol=5.019464e+07
assign (segid "    " and resid   71 and name   HN) (segid "    " and resid   70 and name   HA) 3.102 1.203 1.203 weight 1.000 ! spec=NNOE_major, no=15, id=7, vol=5.008898e+07
assign (segid "    " and resid   71 and name   HN) (segid "    " and resid   71 and name HD1*) 3.188 1.271 1.271 weight 1.000 ! spec=NNOE_major, no=17, id=8, vol=4.244782e+07

assign (segid "    " and resid   71 and name   HN) (segid "    " and resid   71 and name HD2*) 3.222 1.297 1.297 weight 1.000 ! spec=NNOE_major, no=18, id=9, vol=3.989542e+07

assign (segid "    " and resid   71 and name   HN) (segid "    " and resid   71 and name  HB2) 3.276 1.341 1.341 weight 1.000 ! spec=NNOE_major, no=19, id=10, vol=3.611251e+07
assign (segid "    " and resid   71 and name   HN) (segid "    " and resid   44 and name   HN) 3.655 1.669 1.669 weight 1.000 ! spec=NNOE_major, no=20, id=11, vol=1.872025e+07
assign (segid "    " and resid   71 and name   HN) (segid "    " and resid   71 and name   HA) 3.645 1.661 1.661 weight 1.000 ! spec=NNOE_major, no=21, id=12, vol=1.901338e+07
assign (segid "    " and resid   72 and name   HN) (segid "    " and resid   71 and name   HA) 2.812 0.988 0.988 weight 1.000 ! spec=NNOE_major, no=24, id=13, vol=9.025530e+07
assign (segid "    " and resid   72 and name   HN) (segid "    " and resid   72 and name  HB2) 3.125 1.221 1.221 weight 1.000 ! spec=NNOE_major, no=25, id=14, vol=4.789306e+07
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   72 and name  HB1) 2.435 0.741 0.741 weight 1.000 ! spec=NNOE_major, no=28, id=15, vol=2.138195e+08
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name  HG2) 2.719 0.924 0.924 weight 1.000 ! spec=NNOE_major, no=29, id=16, vol=1.104256e+08
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   14 and name   HA) 2.423 0.734 0.734 weight 1.000 ! spec=NNOE_major, no=31, id=17, vol=2.203216e+08
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name   HA) 2.498 0.780 0.780 weight 1.000 ! spec=NNOE_major, no=32, id=18, vol=1.834441e+08
assign (segid "    " and resid   69 and name   HN) (segid "    " and resid    4 and name   HN) 3.248 1.319 1.319 weight 1.000 ! spec=NNOE_major, no=37, id=19, vol=3.796725e+07
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    5 and name HG1*) 3.242 1.314 1.314 weight 1.000 ! spec=NNOE_major, no=40, id=22, vol=3.837990e+07

assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name   HA) 3.436 1.476 1.476 weight 1.000 ! spec=NNOE_major, no=45, id=23, vol=2.710665e+07
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name  HB2) 3.193 1.275 1.275 weight 1.000 ! spec=NNOE_major, no=46, id=24, vol=4.206593e+07
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name  HG2) 3.842 1.845 1.845 weight 1.000 ! spec=NNOE_major, no=47, id=25, vol=1.387221e+07
assign (segid "    " and resid    3 and name   HN) (segid "    " and resid   16 and name   HA) 2.715 0.922 0.922 weight 1.000 ! spec=NNOE_major, no=48, id=26, vol=1.112902e+08
assign (segid "    " and resid    3 and name   HN) (segid "    " and resid    3 and name HD1*) 3.133 1.227 1.227 weight 1.000 ! spec=NNOE_major, no=49, id=27, vol=4.720193e+07

assign (segid "    " and resid    4 and name   HN) (segid "    " and resid    3 and name   HA) 2.967 1.101 1.101 weight 1.000 ! spec=NNOE_major, no=51, id=29, vol=6.531239e+07
assign (segid "    " and resid    4 and name   HN) (segid "    " and resid    3 and name   HB) 3.280 1.345 1.345 weight 1.000 ! spec=NNOE_major, no=53, id=30, vol=3.581681e+07
assign (segid "    " and resid    4 and name   HN) (segid "    " and resid    3 and name HD1*) 3.473 1.508 1.508 weight 1.000 ! spec=NNOE_major, no=54, id=31, vol=2.539503e+07

assign (segid "    " and resid    4 and name   HN) (segid "    " and resid    4 and name  HB2) 3.523 1.551 1.551 weight 1.000 ! spec=NNOE_major, no=55, id=32, vol=2.332536e+07
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    5 and name   HB) 3.293 1.355 1.355 weight 1.000 ! spec=NNOE_major, no=58, id=33, vol=3.499636e+07
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    4 and name  HB1) 3.875 1.877 1.877 weight 1.000 ! spec=NNOE_major, no=61, id=34, vol=1.316872e+07
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    6 and name   HA) 2.927 1.071 1.071 weight 1.000 ! spec=NNOE_major, no=65, id=36, vol=7.099621e+07
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    7 and name   HA) 2.936 1.078 1.078 weight 1.000 ! spec=NNOE_major, no=67, id=37, vol=6.958160e+07
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    8 and name  HB2) 3.329 1.385 1.385 weight 1.000 ! spec=NNOE_major, no=68, id=38, vol=3.278809e+07
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    8 and name   HA) 3.889 1.891 1.891 weight 1.000 ! spec=NNOE_major, no=69, id=39, vol=1.288333e+07
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid   71 and name HD2*) 3.856 1.858 1.858 weight 1.000 ! spec=NNOE_major, no=70, id=40, vol=1.357363e+07
  
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name  HA2) 2.964 1.098 1.098 weight 1.000 ! spec=NNOE_major, no=71, id=41, vol=6.576337e+07
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name  HA1) 2.877 1.035 1.035 weight 1.000 ! spec=NNOE_major, no=72, id=42, vol=7.860446e+07
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   12 and name   HA) 2.584 0.835 0.835 weight 1.000 ! spec=NNOE_major, no=78, id=43, vol=1.498443e+08
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   15 and name HD1*) 2.914 1.062 1.062 weight 1.000 ! spec=NNOE_major, no=86, id=47, vol=7.278587e+07
 
assign (segid "    " and resid   16 and name   HN) (segid "    " and resid   15 and name   HA) 2.833 1.003 1.003 weight 1.000 ! spec=NNOE_major, no=87, id=48, vol=8.630149e+07
assign (segid "    " and resid   16 and name   HN) (segid "    " and resid   16 and name  HB1) 2.972 1.104 1.104 weight 1.000 ! spec=NNOE_major, no=88, id=49, vol=6.477083e+07
assign (segid "    " and resid   17 and name   HN) (segid "    " and resid   16 and name   HA) 3.185 1.268 1.268 weight 1.000 ! spec=NNOE_major, no=90, id=50, vol=4.275290e+07
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   17 and name   HB) 2.837 1.006 1.006 weight 1.000 ! spec=NNOE_major, no=91, id=51, vol=8.549506e+07
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   17 and name HG2*) 3.387 1.434 1.434 weight 1.000 ! spec=NNOE_major, no=92, id=52, vol=2.952396e+07
   
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   19 and name  HB2) 3.144 1.236 1.236 weight 1.000 ! spec=NNOE_major, no=95, id=54, vol=4.618707e+07
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   18 and name  HB2) 3.736 1.745 1.745 weight 1.000 ! spec=NNOE_major, no=96, id=55, vol=1.639950e+07
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   20 and name  HB1) 3.289 1.352 1.352 weight 1.000 ! spec=NNOE_major, no=97, id=56, vol=3.525518e+07
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   20 and name  HB2) 3.414 1.457 1.457 weight 1.000 ! spec=NNOE_major, no=99, id=57, vol=2.815976e+07
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   20 and name   HA) 3.505 1.536 1.536 weight 1.000 ! spec=NNOE_major, no=103, id=58, vol=2.404710e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   21 and name   HA) 3.288 1.351 1.351 weight 1.000 ! spec=NNOE_major, no=104, id=59, vol=3.531521e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name   HA) 3.457 1.494 1.494 weight 1.000 ! spec=NNOE_major, no=105, id=60, vol=2.611546e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   21 and name  HB1) 3.051 1.164 1.164 weight 1.000 ! spec=NNOE_major, no=106, id=61, vol=5.527986e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   21 and name  HB2) 3.409 1.452 1.452 weight 1.000 ! spec=NNOE_major, no=107, id=62, vol=2.843672e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   18 and name  HB2) 3.272 1.338 1.338 weight 1.000 ! spec=NNOE_major, no=108, id=63, vol=3.634468e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   56 and name HD1*) 3.713 1.724 1.724 weight 1.000 ! spec=NNOE_major, no=110, id=64, vol=1.700908e+07

assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   22 and name HG2*) 3.254 1.323 1.323 weight 1.000 ! spec=NNOE_major, no=111, id=65, vol=3.760278e+07
    
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   25 and name  HB1) 3.633 1.650 1.650 weight 1.000 ! spec=NNOE_major, no=112, id=66, vol=1.938496e+07
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   25 and name  HB2) 3.568 1.592 1.592 weight 1.000 ! spec=NNOE_major, no=113, id=67, vol=2.160428e+07
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   21 and name  HB2) 3.629 1.647 1.647 weight 1.000 ! spec=NNOE_major, no=114, id=68, vol=1.951174e+07
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   21 and name   HA) 2.814 0.989 0.989 weight 1.000 ! spec=NNOE_major, no=115, id=69, vol=8.991904e+07
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   22 and name   HB) 2.847 1.013 1.013 weight 1.000 ! spec=NNOE_major, no=116, id=70, vol=8.369616e+07
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   23 and name   HB) 3.160 1.248 1.248 weight 1.000 ! spec=NNOE_major, no=117, id=71, vol=4.478750e+07
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   23 and name HG12) 3.380 1.428 1.428 weight 1.000 ! spec=NNOE_major, no=119, id=72, vol=2.988516e+07
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   23 and name HD1*) 3.348 1.401 1.401 weight 1.000 ! spec=NNOE_major, no=120, id=73, vol=3.169288e+07

assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   23 and name   HA) 3.450 1.488 1.488 weight 1.000 ! spec=NNOE_major, no=121, id=74, vol=2.644124e+07
assign (segid "    " and resid   48 and name   HN) (segid "    " and resid   48 and name  HB2) 2.683 0.900 0.900 weight 1.000 ! spec=NNOE_major, no=123, id=75, vol=1.196686e+08
assign (segid "    " and resid   48 and name   HN) (segid "    " and resid   48 and name   HA) 2.977 1.108 1.108 weight 1.000 ! spec=NNOE_major, no=124, id=76, vol=6.410107e+07
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   25 and name  HB2) 3.324 1.381 1.381 weight 1.000 ! spec=NNOE_major, no=125, id=77, vol=3.309233e+07
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   25 and name  HB1) 3.053 1.165 1.165 weight 1.000 ! spec=NNOE_major, no=126, id=78, vol=5.505873e+07
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name   HB) 3.099 1.201 1.201 weight 1.000 ! spec=NNOE_major, no=127, id=79, vol=5.031248e+07
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name HG1*) 2.996 1.122 1.122 weight 1.000 ! spec=NNOE_major, no=128, id=80, vol=6.170857e+07

assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name HG2*) 3.072 1.180 1.180 weight 1.000 ! spec=NNOE_major, no=129, id=81, vol=5.304253e+07
    
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name   HA) 3.283 1.348 1.348 weight 1.000 ! spec=NNOE_major, no=130, id=82, vol=3.559406e+07
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   26 and name   HB) 2.708 0.917 0.917 weight 1.000 ! spec=NNOE_major, no=131, id=83, vol=1.130683e+08
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name  HB1) 2.667 0.889 0.889 weight 1.000 ! spec=NNOE_major, no=132, id=84, vol=1.240675e+08
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name  HB2) 2.463 0.758 0.758 weight 1.000 ! spec=NNOE_major, no=133, id=85, vol=1.998142e+08
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   26 and name HG2*) 2.774 0.962 0.962 weight 1.000 ! spec=NNOE_major, no=134, id=86, vol=9.792494e+07
   
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name   HA) 2.878 1.035 1.035 weight 1.000 ! spec=NNOE_major, no=135, id=87, vol=7.850899e+07
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   26 and name   HN) 2.613 0.853 0.853 weight 1.000 ! spec=NNOE_major, no=136, id=88, vol=1.402796e+08
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name   HA) 2.900 1.051 1.051 weight 1.000 ! spec=NNOE_major, no=138, id=89, vol=7.494110e+07
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name   HA) 2.994 1.120 1.120 weight 1.000 ! spec=NNOE_major, no=139, id=90, vol=6.194322e+07
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   28 and name   HA) 3.272 1.338 1.338 weight 1.000 ! spec=NNOE_major, no=141, id=91, vol=3.634484e+07
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name  HB2) 2.985 1.114 1.114 weight 1.000 ! spec=NNOE_major, no=142, id=92, vol=6.299885e+07
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name  HG2) 2.837 1.006 1.006 weight 1.000 ! spec=NNOE_major, no=143, id=93, vol=8.556647e+07
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   26 and name HG2*) 3.699 1.711 1.711 weight 1.000 ! spec=NNOE_major, no=144, id=94, vol=1.740196e+07
    
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name HD1*) 3.119 1.216 1.216 weight 1.000 ! spec=NNOE_major, no=146, id=95, vol=4.841310e+07

assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name HG2*) 2.923 1.068 1.068 weight 1.000 ! spec=NNOE_major, no=147, id=96, vol=7.145012e+07
   
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name  HG2) 3.232 1.002 1.002 weight 1.000 ! spec=NNOE_major, no=148, id=97, vol=8.648885e+07
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name   HA) 3.352 1.404 1.404 weight 1.000 ! spec=NNOE_major, no=149, id=98, vol=3.146429e+07
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   32 and name   HA) 2.753 0.947 0.947 weight 1.000 ! spec=NNOE_major, no=150, id=99, vol=1.024272e+08
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   32 and name  HB2) 2.565 0.822 0.822 weight 1.000 ! spec=NNOE_major, no=151, id=100, vol=1.567855e+08
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name  HG2) 2.894 1.047 1.047 weight 1.000 ! spec=NNOE_major, no=152, id=101, vol=7.584605e+07
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   33 and name   HN) 3.117 1.214 1.214 weight 1.000 ! spec=NNOE_major, no=155, id=102, vol=4.865460e+07
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   33 and name  HB1) 2.679 0.897 0.897 weight 1.000 ! spec=NNOE_major, no=156, id=103, vol=1.206250e+08
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name  HB1) 2.717 0.923 0.923 weight 1.000 ! spec=NNOE_major, no=157, id=104, vol=1.108782e+08
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name   HA) 3.085 1.189 1.189 weight 1.000 ! spec=NNOE_major, no=158, id=105, vol=5.177533e+07
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   33 and name   HN) 2.808 0.986 0.986 weight 1.000 ! spec=NNOE_major, no=159, id=106, vol=9.094940e+07
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   30 and name HG2*) 3.263 1.331 1.331 weight 1.000 ! spec=NNOE_major, no=160, id=107, vol=3.697448e+07
   
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   35 and name  HA2) 2.498 0.780 0.780 weight 1.000 ! spec=NNOE_major, no=161, id=108, vol=1.837439e+08
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   35 and name  HA1) 2.720 0.925 0.925 weight 1.000 ! spec=NNOE_major, no=162, id=109, vol=1.102296e+08
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name   HA) 2.912 1.060 1.060 weight 1.000 ! spec=NNOE_major, no=163, id=110, vol=7.316375e+07
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   31 and name   HA) 2.578 0.831 0.831 weight 1.000 ! spec=NNOE_major, no=164, id=111, vol=1.519545e+08
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name   HB) 2.411 0.727 0.727 weight 1.000 ! spec=NNOE_major, no=165, id=112, vol=2.271390e+08
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name HG2*) 2.810 0.987 0.987 weight 1.000 ! spec=NNOE_major, no=166, id=113, vol=9.054759e+07
 
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name HD1*) 2.889 1.043 1.043 weight 1.000 ! spec=NNOE_major, no=167, id=114, vol=7.677034e+07
   
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   34 and name  HB2) 3.117 1.214 1.214 weight 1.000 ! spec=NNOE_major, no=168, id=115, vol=4.866021e+07
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   39 and name  HB1) 2.691 0.905 0.905 weight 1.000 ! spec=NNOE_major, no=170, id=116, vol=1.173806e+08
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   39 and name  HB2) 2.646 0.875 0.875 weight 1.000 ! spec=NNOE_major, no=171, id=117, vol=1.300209e+08
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   39 and name   HA) 2.789 0.973 0.973 weight 1.000 ! spec=NNOE_major, no=172, id=118, vol=9.466404e+07
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   40 and name   HN) 2.890 1.044 1.044 weight 1.000 ! spec=NNOE_major, no=174, id=119, vol=7.661393e+07
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   41 and name   HN) 2.693 0.907 0.907 weight 1.000 ! spec=NNOE_major, no=175, id=120, vol=1.169013e+08
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   40 and name   HA) 2.823 0.996 0.996 weight 1.000 ! spec=NNOE_major, no=177, id=121, vol=8.809033e+07
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   40 and name  HB1) 2.627 0.863 0.863 weight 1.000 ! spec=NNOE_major, no=178, id=122, vol=1.356632e+08
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   40 and name  HB2) 2.574 0.828 0.828 weight 1.000 ! spec=NNOE_major, no=179, id=123, vol=1.534775e+08
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   40 and name  HB2) 2.992 1.119 1.119 weight 1.000 ! spec=NNOE_major, no=181, id=124, vol=6.217941e+07
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   40 and name  HB1) 3.364 1.414 1.414 weight 1.000 ! spec=NNOE_major, no=182, id=125, vol=3.079714e+07
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name  HB1) 3.064 1.174 1.174 weight 1.000 ! spec=NNOE_major, no=183, id=126, vol=5.385531e+07
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   42 and name   HA) 3.005 1.129 1.129 weight 1.000 ! spec=NNOE_major, no=184, id=127, vol=6.054094e+07
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   44 and name HG12) 3.295 1.357 1.357 weight 1.000 ! spec=NNOE_major, no=186, id=128, vol=3.483709e+07
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   44 and name HD1*) 3.327 1.384 1.384 weight 1.000 ! spec=NNOE_major, no=187, id=129, vol=3.289211e+07
  
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   44 and name   HB) 3.193 1.275 1.275 weight 1.000 ! spec=NNOE_major, no=188, id=130, vol=4.204943e+07
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   43 and name   HA) 2.884 1.040 1.040 weight 1.000 ! spec=NNOE_major, no=189, id=131, vol=7.750678e+07
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   44 and name   HA) 3.041 1.156 1.156 weight 1.000 ! spec=NNOE_major, no=190, id=132, vol=5.644962e+07
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   45 and name  HB2) 3.490 1.522 1.522 weight 1.000 ! spec=NNOE_major, no=191, id=133, vol=2.468302e+07
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   44 and name HG2*) 3.410 1.454 1.454 weight 1.000 ! spec=NNOE_major, no=192, id=134, vol=2.834866e+07
   
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   48 and name   HN) 4.070 2.070 2.070 weight 1.000 ! spec=NNOE_major, no=196, id=135, vol=9.815393e+06
assign (segid "    " and resid   47 and name   HN) (segid "    " and resid   47 and name  HA1) 3.247 1.318 1.318 weight 1.000 ! spec=NNOE_major, no=199, id=137, vol=3.806158e+07
assign (segid "    " and resid   47 and name   HN) (segid "    " and resid   44 and name HG2*) 3.418 1.460 1.460 weight 1.000 ! spec=NNOE_major, no=201, id=138, vol=2.796402e+07
 
assign (segid "    " and resid   49 and name   HN) (segid "    " and resid   49 and name  HB2) 2.896 1.048 1.048 weight 1.000 ! spec=NNOE_major, no=202, id=139, vol=7.568274e+07
assign (segid "    " and resid   49 and name   HN) (segid "    " and resid   48 and name   HA) 2.768 0.958 0.958 weight 1.000 ! spec=NNOE_major, no=203, id=140, vol=9.907135e+07
assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   50 and name  HB2) 2.937 1.078 1.078 weight 1.000 ! spec=NNOE_major, no=204, id=141, vol=6.953838e+07
assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   49 and name   HA) 2.846 1.013 1.013 weight 1.000 ! spec=NNOE_major, no=205, id=142, vol=8.387058e+07
assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   49 and name  HB2) 3.463 1.499 1.499 weight 1.000 ! spec=NNOE_major, no=206, id=143, vol=2.588173e+07
assign (segid "    " and resid   51 and name   HN) (segid "    " and resid   51 and name  HB2) 2.792 0.975 0.975 weight 1.000 ! spec=NNOE_major, no=212, id=147, vol=9.411948e+07
assign (segid "    " and resid   51 and name   HN) (segid "    " and resid   51 and name  HG2) 2.653 0.880 0.880 weight 1.000 ! spec=NNOE_major, no=213, id=148, vol=1.278969e+08
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   55 and name   HA) 3.265 1.333 1.333 weight 1.000 ! spec=NNOE_major, no=215, id=149, vol=3.679063e+07
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   55 and name   HB) 3.256 1.325 1.325 weight 1.000 ! spec=NNOE_major, no=216, id=150, vol=3.741962e+07
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   56 and name   HG) 3.208 1.286 1.286 weight 1.000 ! spec=NNOE_major, no=217, id=151, vol=4.094707e+07
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   56 and name  HB2) 3.246 1.317 1.317 weight 1.000 ! spec=NNOE_major, no=218, id=152, vol=3.811095e+07
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   56 and name  HB1) 3.484 1.517 1.517 weight 1.000 ! spec=NNOE_major, no=219, id=153, vol=2.493650e+07
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   56 and name HD1*) 3.408 1.452 1.452 weight 1.000 ! spec=NNOE_major, no=220, id=154, vol=2.846570e+07
  
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid   20 and name   HA) 3.243 1.314 1.314 weight 1.000 ! spec=NNOE_major, no=221, id=155, vol=3.836782e+07
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid   20 and name  HB1) 3.258 1.327 1.327 weight 1.000 ! spec=NNOE_major, no=222, id=156, vol=3.730342e+07
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid   56 and name  HB2) 3.515 1.545 1.545 weight 1.000 ! spec=NNOE_major, no=223, id=157, vol=2.363492e+07
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid   58 and name   HA) 3.343 1.397 1.397 weight 1.000 ! spec=NNOE_major, no=224, id=158, vol=3.193507e+07
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid   58 and name  HB2) 3.309 1.368 1.368 weight 1.000 ! spec=NNOE_major, no=225, id=159, vol=3.400026e+07
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid   58 and name  HB1) 3.494 1.526 1.526 weight 1.000 ! spec=NNOE_major, no=226, id=160, vol=2.453392e+07
assign (segid "    " and resid   59 and name   HN) (segid "    " and resid   59 and name  HB2) 3.939 1.940 1.940 weight 1.000 ! spec=NNOE_major, no=231, id=161, vol=1.193786e+07
assign (segid "    " and resid   59 and name   HN) (segid "    " and resid   59 and name   HA) 3.706 1.717 1.717 weight 1.000 ! spec=NNOE_major, no=232, id=162, vol=1.720152e+07
assign (segid "    " and resid   59 and name   HN) (segid "    " and resid   59 and name  HB1) 3.563 1.587 1.587 weight 1.000 ! spec=NNOE_major, no=233, id=163, vol=2.181380e+07
assign (segid "    " and resid   61 and name   HN) (segid "    " and resid   60 and name   HA) 2.979 1.109 1.109 weight 1.000 ! spec=NNOE_major, no=237, id=164, vol=6.385491e+07
assign (segid "    " and resid   61 and name   HN) (segid "    " and resid   60 and name  HB1) 3.228 1.303 1.303 weight 1.000 ! spec=NNOE_major, no=238, id=165, vol=3.939788e+07
assign (segid "    " and resid   61 and name   HN) (segid "    " and resid   61 and name   HB) 2.734 0.934 0.934 weight 1.000 ! spec=NNOE_major, no=241, id=167, vol=1.067588e+08
assign (segid "    " and resid   61 and name   HN) (segid "    " and resid   61 and name HD1*) 3.288 1.352 1.352 weight 1.000 ! spec=NNOE_major, no=242, id=168, vol=3.528017e+07
    
assign (segid "    " and resid   61 and name   HN) (segid "    " and resid   61 and name HG12) 3.591 1.612 1.612 weight 1.000 ! spec=NNOE_major, no=243, id=169, vol=2.081222e+07
assign (segid "    " and resid   61 and name   HN) (segid "    " and resid   61 and name HG11) 2.952 1.089 1.089 weight 1.000 ! spec=NNOE_major, no=245, id=170, vol=6.744120e+07
assign (segid "    " and resid   63 and name   HN) (segid "    " and resid   63 and name   HA) 3.248 1.318 1.318 weight 1.000 ! spec=NNOE_major, no=247, id=171, vol=3.800431e+07
assign (segid "    " and resid   63 and name   HN) (segid "    " and resid   63 and name  HB2) 3.237 1.309 1.309 weight 1.000 ! spec=NNOE_major, no=248, id=172, vol=3.880160e+07
assign (segid "    " and resid   70 and name   HN) (segid "    " and resid   70 and name HG1*) 3.345 1.398 1.398 weight 1.000 ! spec=NNOE_major, no=251, id=173, vol=3.185969e+07

assign (segid "    " and resid   72 and name   HN) (segid "    " and resid   71 and name HD1*) 3.133 1.227 1.227 weight 1.000 ! spec=NNOE_major, no=253, id=174, vol=4.716252e+07

assign (segid "    " and resid   18 and name   HA) (segid "    " and resid   19 and name  HD2) 2.399 0.719 0.719 weight 1.000 ! spec=CNOE , no=1197, id=563, vol=1.289571e+08
assign (segid "    " and resid   18 and name  HB2) (segid "    " and resid   18 and name   HA) 2.482 0.770 0.770 weight 1.000 ! spec=CNOE , no=753, id=347, vol=1.049982e+08
assign (segid "    " and resid   18 and name  HB2) (segid "    " and resid   18 and name   HN) 2.484 0.771 0.771 weight 1.000 ! spec=CNOE , no=397, id=191, vol=1.046379e+08
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   17 and name   HA) 2.850 1.015 1.015 weight 1.000 ! spec=NNOE , no=76, id=463, vol=9.075649e+07
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   18 and name   HA) 3.375 1.424 1.424 weight 1.000 ! spec=NNOE , no=75, id=462, vol=3.287827e+07
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   18 and name  HB2) 2.995 1.121 1.121 weight 1.000 ! spec=NNOE , no=78, id=465, vol=6.736057e+07
assign (segid "    " and resid   19 and name   HA) (segid "    " and resid   19 and name  HB2) 2.347 0.688 0.688 weight 1.000 ! spec=CNOE , no=813, id=338, vol=1.740472e+08
assign (segid "    " and resid   19 and name   HA) (segid "    " and resid   56 and name HD1*) 3.200 1.000 1.000 weight 1.000 ! spec=CNOE , no=809, id=336, vol=6.519655e+07
assign (segid "    " and resid   19 and name  HB2) (segid "    " and resid   19 and name  HG2) 1.960 0.480 0.480 weight 1.000 ! spec=CNOE , no=411, id=154, vol=5.125886e+08
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   18 and name  HB1) 3.043 1.157 1.157 weight 1.000 ! spec=NNOE , no=99, id=647, vol=4.353693e+07
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   18 and name  HB1) 3.470 1.505 1.505 weight 1.000 ! spec=NNOE , no=85, id=472, vol=2.784280e+07
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   19 and name   HA) 2.816 0.991 0.991 weight 1.000 ! spec=NNOE , no=102, id=649, vol=6.923906e+07
assign (segid "    " and resid   21 and name   HA) (segid "    " and resid   21 and name  HB1) 2.549 0.812 0.812 weight 1.000 ! spec=CNOE , no=695, id=279, vol=1.059436e+08
assign (segid "    " and resid   21 and name   HA) (segid "    " and resid   21 and name  HB2) 2.479 0.768 0.768 weight 1.000 ! spec=CNOE , no=792, id=377, vol=1.059436e+08
assign (segid "    " and resid   21 and name   HA) (segid "    " and resid   21 and name  HB2) 2.484 0.771 0.771 weight 1.000 ! spec=CNOE , no=694, id=278, vol=1.237030e+08
assign (segid "    " and resid   21 and name   HA) (segid "    " and resid   21 and name   HN) 2.201 0.605 0.605 weight 1.000 ! spec=CNOE , no=686, id=272, vol=2.558500e+08
assign (segid "    " and resid   21 and name  HB1) (segid "    " and resid   21 and name   HA) 2.415 0.729 0.729 weight 1.000 ! spec=CNOE , no=791, id=376, vol=1.237030e+08
assign (segid "    " and resid   21 and name  HB1) (segid "    " and resid   21 and name  HB2) 1.904 0.453 0.453 weight 1.000 ! spec=CNOE , no=570, id=256, vol=5.148462e+08
assign (segid "    " and resid   21 and name  HB1) (segid "    " and resid   21 and name   HN) 2.494 0.778 0.778 weight 1.000 ! spec=CNOE , no=571, id=257, vol=1.020534e+08
assign (segid "    " and resid   21 and name  HB1) (segid "    " and resid   22 and name   HN) 2.497 0.780 0.780 weight 1.000 ! spec=CNOE , no=502, id=201, vol=1.198439e+08
assign (segid "    " and resid   21 and name  HB1) (segid "    " and resid   26 and name HG2*) 2.766 0.956 0.956 weight 1.000 ! spec=CNOE , no=566, id=253, vol=5.485874e+07
assign (segid "    " and resid   21 and name  HB1) (segid "    " and resid   26 and name HG2*) 3.287 0.903 0.903 weight 1.000 ! spec=CNOE , no=564, id=251, vol=6.526075e+07
assign (segid "    " and resid   21 and name  HB2) (segid "    " and resid   21 and name  HB1) 1.959 0.480 0.480 weight 1.000 ! spec=CNOE , no=499, id=199, vol=5.148462e+08
assign (segid "    " and resid   21 and name  HB2) (segid "    " and resid   21 and name   HN) 2.575 0.829 0.829 weight 1.000 ! spec=CNOE , no=983, id=403, vol=9.974426e+07
assign (segid "    " and resid   21 and name  HB2) (segid "    " and resid   56 and name HD1*) 2.845 1.012 1.012 weight 1.000 ! spec=CNOE , no=496, id=197, vol=5.485874e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   17 and name HG2*) 3.073 1.181 1.181 weight 1.000 ! spec=NNOE , no=115, id=659, vol=4.100990e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name   HN) 2.831 1.002 1.002 weight 1.000 ! spec=NNOE , no=106, id=651, vol=6.709534e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   55 and name HG2*) 3.305 1.365 1.365 weight 1.000 ! spec=NNOE , no=116, id=660, vol=2.650505e+07
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   56 and name HD12) 3.548 1.401 1.401 weight 1.000 ! spec=NNOE , no=92, id=476, vol=3.451217e+07
assign (segid "    " and resid   22 and name   HB) (segid "    " and resid   22 and name   HA) 2.846 1.013 1.013 weight 1.000 ! spec=CNOE , no=834, id=350, vol=5.467621e+07
assign (segid "    " and resid   22 and name   HB) (segid "    " and resid   22 and name HG2*) 2.567 0.824 0.824 weight 1.000 ! spec=CNOE , no=847, id=352, vol=1.016464e+08
assign (segid "    " and resid   22 and name   HB) (segid "    " and resid   22 and name   HN) 3.161 1.249 1.249 weight 1.000 ! spec=CNOE , no=842, id=351, vol=2.916169e+07
assign (segid "    " and resid   22 and name HG2*) (segid "    " and resid   22 and name   HB) 2.015 0.508 0.508 weight 1.000 ! spec=CNOE , no=229, id=121, vol=3.666934e+08
assign (segid "    " and resid   22 and name HG2*) (segid "    " and resid   55 and name   HA) 2.787 0.971 0.971 weight 1.000 ! spec=CNOE , no=231, id=123, vol=5.242142e+07
assign (segid "    " and resid   22 and name HG2*) (segid "    " and resid   22 and name   HN) 2.877 0.767 0.767 weight 1.000 ! spec=CNOE , no=206, id=106, vol=1.062271e+08
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   21 and name  HB1) 2.994 1.121 1.121 weight 1.000 ! spec=NNOE , no=58, id=613, vol=4.793316e+07
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   22 and name   HB) 2.949 1.087 1.087 weight 1.000 ! spec=NNOE , no=100, id=482, vol=7.385451e+07
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   23 and name HD1*) 2.827 0.677 0.677 weight 1.000 ! spec=CNOE , no=1190, id=561, vol=1.547837e+08
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   23 and name HG11) 3.127 1.222 1.222 weight 1.000 ! spec=CNOE , no=1194, id=562, vol=2.627908e+07
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   23 and name HG12) 3.115 1.213 1.213 weight 1.000 ! spec=CNOE , no=896, id=444, vol=2.690191e+07
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   23 and name   HN) 2.808 0.986 0.986 weight 1.000 ! spec=CNOE , no=900, id=446, vol=5.011353e+07
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   26 and name   HB) 2.505 0.784 0.784 weight 1.000 ! spec=CNOE , no=894, id=443, vol=9.947956e+07
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   26 and name HG1*) 3.818 0.856 0.856 weight 1.000 ! spec=CNOE , no=1037, id=494, vol=7.636451e+07
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   26 and name   HN) 2.982 1.112 1.112 weight 1.000 ! spec=CNOE , no=901, id=447, vol=3.492297e+07
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   26 and name   HN) 3.024 1.143 1.143 weight 1.000 ! spec=NNOE , no=141, id=683, vol=4.518266e+07
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   56 and name HD1*) 3.831 1.222 1.222 weight 1.000 ! spec=CNOE , no=889, id=438, vol=1.989273e+08
assign (segid "    " and resid   23 and name HG11) (segid "    " and resid   23 and name   HN) 2.940 1.080 1.080 weight 1.000 ! spec=CNOE , no=1028, id=417, vol=4.503114e+07
assign (segid "    " and resid   23 and name HG11) (segid "    " and resid   59 and name  HE*) 3.190 1.272 1.272 weight 1.000 ! spec=CNOE , no=314, id=106, vol=2.757716e+07
assign (segid "    " and resid   23 and name HG12) (segid "    " and resid   23 and name   HN) 2.645 0.874 0.874 weight 1.000 ! spec=NNOE , no=107, id=487, vol=1.419055e+08
assign (segid "    " and resid   23 and name HG12) (segid "    " and resid   59 and name  HE*) 3.121 1.217 1.217 weight 1.000 ! spec=CNOE , no=315, id=107, vol=3.147453e+07
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   22 and name HG2*) 2.995 1.121 1.121 weight 1.000 ! spec=NNOE , no=108, id=488, vol=6.730172e+07
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   24 and name  HG2) 2.834 1.004 1.004 weight 1.000 ! spec=NNOE , no=106, id=486, vol=9.379314e+07
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   24 and name   HN) 2.856 1.019 1.019 weight 1.000 ! spec=CNOE , no=878, id=432, vol=4.529562e+07
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   25 and name   HN) 2.811 0.988 0.988 weight 1.000 ! spec=CNOE , no=845, id=411, vol=4.976452e+07
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   25 and name   HN) 2.891 1.045 1.045 weight 1.000 ! spec=CNOE , no=743, id=306, vol=4.976452e+07
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   25 and name   HN) 3.137 1.230 1.230 weight 1.000 ! spec=NNOE , no=133, id=675, vol=3.622473e+07
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   27 and name  HB*) 2.860 0.831 0.831 weight 1.000 ! spec=CNOE , no=848, id=413, vol=3.210567e+08
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   27 and name   HN) 2.862 1.024 1.024 weight 1.000 ! spec=CNOE , no=742, id=305, vol=5.291681e+07
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   27 and name   HN) 3.283 0.968 0.968 weight 1.000 ! spec=CNOE , no=844, id=410, vol=5.291681e+07
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   28 and name  HB*) 4.391 0.714 1.614 weight 1.000 ! spec=CNOE , no=851, id=416, vol=1.316199e+08
assign (segid "    " and resid   24 and name  HB2) (segid "    " and resid   24 and name   HA) 2.288 0.654 0.654 weight 1.000 ! spec=CNOE , no=274, id=88, vol=2.028315e+08
assign (segid "    " and resid   24 and name  HB2) (segid "    " and resid   25 and name   HN) 2.708 0.916 0.916 weight 1.000 ! spec=NNOE , no=118, id=494, vol=1.232733e+08
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   22 and name   HB) 3.857 1.860 1.860 weight 1.000 ! spec=NNOE , no=128, id=671, vol=1.048448e+07
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   23 and name   HB) 3.540 1.566 1.566 weight 1.000 ! spec=NNOE , no=127, id=670, vol=1.756686e+07
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   27 and name  HB*) 3.433 1.473 1.473 weight 1.000 ! spec=NNOE , no=126, id=669, vol=2.109011e+07
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   25 and name   HN) 2.337 0.683 0.683 weight 1.000 ! spec=CNOE , no=685, id=271, vol=1.783892e+08
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   25 and name   HN) 2.650 0.878 0.878 weight 1.000 ! spec=NNOE , no=132, id=674, vol=9.966054e+07
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   26 and name   HN) 2.791 0.973 0.973 weight 1.000 ! spec=NNOE , no=140, id=682, vol=7.316059e+07
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   28 and name   HN) 2.819 0.993 0.993 weight 1.000 ! spec=NNOE , no=159, id=701, vol=6.885331e+07
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   28 and name   HN) 3.272 0.645 0.645 weight 1.000 ! spec=CNOE , no=781, id=370, vol=1.783892e+08
assign (segid "    " and resid   25 and name  HB1) (segid "    " and resid   22 and name   HN) 2.860 0.819 0.819 weight 1.000 ! spec=CNOE , no=517, id=234, vol=8.727592e+07
assign (segid "    " and resid   25 and name  HB1) (segid "    " and resid   22 and name   HN) 2.917 1.064 1.064 weight 1.000 ! spec=NNOE , no=56, id=611, vol=5.603734e+07
assign (segid "    " and resid   25 and name  HB1) (segid "    " and resid   25 and name   HA) 2.436 0.742 0.742 weight 1.000 ! spec=CNOE , no=794, id=379, vol=1.176150e+08
assign (segid "    " and resid   25 and name  HB1) (segid "    " and resid   25 and name   HN) 2.489 0.774 0.774 weight 1.000 ! spec=NNOE , no=134, id=676, vol=1.453730e+08
assign (segid "    " and resid   25 and name  HB1) (segid "    " and resid   25 and name   HN) 2.562 0.820 0.820 weight 1.000 ! spec=CNOE , no=453, id=176, vol=1.028757e+08
assign (segid "    " and resid   25 and name  HB2) (segid "    " and resid   25 and name   HA) 2.346 0.688 0.688 weight 1.000 ! spec=CNOE , no=793, id=378, vol=1.472649e+08
assign (segid "    " and resid   25 and name  HB2) (segid "    " and resid   25 and name   HN) 2.463 0.758 0.758 weight 1.000 ! spec=CNOE , no=515, id=232, vol=1.101442e+08
assign (segid "    " and resid   25 and name  HB2) (segid "    " and resid   25 and name   HN) 2.533 0.802 0.802 weight 1.000 ! spec=CNOE , no=452, id=175, vol=1.101442e+08
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   24 and name  HG2) 2.884 1.040 1.040 weight 1.000 ! spec=NNOE , no=117, id=493, vol=8.447436e+07
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   26 and name HG1*) 4.248 1.486 1.486 weight 1.000 ! spec=NNOE , no=121, id=495, vol=2.890446e+07
assign (segid "    " and resid   26 and name   HA) (segid "    " and resid   26 and name HG12) 2.355 0.693 0.693 weight 1.000 ! spec=CNOE , no=806, id=333, vol=1.706267e+08
assign (segid "    " and resid   26 and name   HA) (segid "    " and resid   26 and name HG2*) 2.248 0.632 0.632 weight 1.000 ! spec=CNOE , no=807, id=334, vol=2.255191e+08
assign (segid "    " and resid   26 and name   HA) (segid "    " and resid   26 and name   HN) 2.622 0.859 0.859 weight 1.000 ! spec=CNOE , no=817, id=341, vol=8.954736e+07
assign (segid "    " and resid   26 and name   HA) (segid "    " and resid   27 and name   HN) 3.190 1.272 1.272 weight 1.000 ! spec=CNOE , no=826, id=346, vol=2.759220e+07
assign (segid "    " and resid   26 and name   HB) (segid "    " and resid   26 and name HG1*) 2.330 0.679 0.679 weight 1.000 ! spec=CNOE , no=371, id=180, vol=1.533897e+08
assign (segid "    " and resid   26 and name   HB) (segid "    " and resid   26 and name HG1*) 2.397 0.718 0.718 weight 1.000 ! spec=CNOE , no=327, id=115, vol=1.533897e+08
assign (segid "    " and resid   26 and name   HB) (segid "    " and resid   26 and name HG2*) 2.156 0.581 0.581 weight 1.000 ! spec=CNOE , no=372, id=181, vol=2.445582e+08
assign (segid "    " and resid   26 and name   HB) (segid "    " and resid   26 and name HG2*) 2.218 0.615 0.615 weight 1.000 ! spec=CNOE , no=328, id=116, vol=2.445582e+08
assign (segid "    " and resid   26 and name   HB) (segid "    " and resid   27 and name   HN) 2.578 0.830 0.830 weight 1.000 ! spec=CNOE , no=392, id=188, vol=8.375040e+07
assign (segid "    " and resid   26 and name   HB) (segid "    " and resid   27 and name   HN) 2.651 0.879 0.879 weight 1.000 ! spec=CNOE , no=347, id=122, vol=8.375040e+07
assign (segid "    " and resid   26 and name HG1*) (segid "    " and resid   27 and name   HA) 2.809 0.787 0.787 weight 1.000 ! spec=CNOE , no=244, id=132, vol=9.854089e+07
assign (segid "    " and resid   26 and name HG1*) (segid "    " and resid   26 and name   HB) 1.978 0.489 0.489 weight 1.000 ! spec=CNOE , no=156, id=43, vol=4.853221e+08
assign (segid "    " and resid   26 and name HG2*) (segid "    " and resid   27 and name   HN) 2.596 0.842 0.842 weight 1.000 ! spec=CNOE , no=196, id=59, vol=9.502004e+07
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name  HB2) 3.053 1.165 1.165 weight 1.000 ! spec=NNOE , no=143, id=685, vol=4.268228e+07
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name  HB2) 3.168 1.255 1.255 weight 1.000 ! spec=NNOE , no=125, id=498, vol=4.806079e+07
assign (segid "    " and resid   27 and name  HB2) (segid "    " and resid   27 and name   HN) 2.465 0.759 0.759 weight 1.000 ! spec=CNOE , no=432, id=205, vol=1.095527e+08
assign (segid "    " and resid   27 and name  HB*) (segid "    " and resid   27 and name   HN) 2.535 0.803 0.803 weight 1.000 ! spec=CNOE , no=380, id=135, vol=1.095527e+08
assign (segid "    " and resid   27 and name  HB2) (segid "    " and resid   28 and name   HN) 2.561 0.820 0.820 weight 1.000 ! spec=CNOE , no=435, id=206, vol=8.696949e+07
assign (segid "    " and resid   27 and name  HB*) (segid "    " and resid   27 and name   HN) 2.865 0.759 0.759 weight 1.000 ! spec=NNOE , no=156, id=698, vol=1.540025e+08
assign (segid "    " and resid   27 and name  HE*) (segid "    " and resid   43 and name HD1*) 2.615 0.855 0.855 weight 1.000 ! spec=CNOE , no=625, id=284, vol=7.687652e+07
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name  HG2) 2.388 0.713 0.713 weight 1.000 ! spec=NNOE , no=139, id=510, vol=2.620127e+08
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   28 and name   HN) 2.517 0.792 0.792 weight 1.000 ! spec=NNOE , no=131, id=504, vol=1.909244e+08
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   28 and name   HN) 2.931 1.074 1.074 weight 1.000 ! spec=NNOE , no=141, id=512, vol=7.655497e+07
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   43 and name HD1*) 3.859 0.818 0.818 weight 1.000 ! spec=NNOE , no=158, id=700, vol=1.230679e+08
assign (segid "    " and resid  27  and name   HN) (segid "    " and resid   43 and name HD1*) 3.870 0.978 0.978 weight 1.000 ! spec=NNOE , no=401, id=679, vol=5.802793e+07
assign (segid "    " and resid   28 and name   HA) (segid "    " and resid   28 and name  HB*) 2.056 0.528 0.528 weight 1.000 ! spec=CNOE , no=662, id=258, vol=3.850886e+08
assign (segid "    " and resid   28 and name   HA) (segid "    " and resid   28 and name   HN) 2.418 0.731 0.731 weight 1.000 ! spec=CNOE , no=1085, id=525, vol=1.228360e+08
assign (segid "    " and resid   28 and name   HA) (segid "    " and resid   32 and name   HN) 3.221 0.817 0.817 weight 1.000 ! spec=CNOE , no=950, id=391, vol=2.420768e+08
assign (segid "    " and resid   28 and name  HB*) (segid "    " and resid   28 and name   HA) 1.999 0.499 0.499 weight 1.000 ! spec=CNOE , no=758, id=351, vol=3.850886e+08
assign (segid "    " and resid   28 and name  HB*) (segid "    " and resid   28 and name   HN) 2.287 0.654 0.654 weight 1.000 ! spec=NNOE , no=161, id=703, vol=2.412846e+08
assign (segid "    " and resid   28 and name  HB*) (segid "    " and resid   25 and name   HA) 2.102 0.552 0.552 weight 1.000 ! spec=CNOE , no=790, id=375, vol=2.846434e+08
assign (segid "    " and resid   28 and name  HB*) (segid "    " and resid   25 and name   HA) 2.162 0.584 0.584 weight 1.000 ! spec=CNOE , no=693, id=277, vol=2.846434e+08
assign (segid "    " and resid   28 and name  HB*) (segid "    " and resid   27 and name   HN) 3.571 0.960 0.960 weight 1.000 ! spec=CNOE , no=150, id=71, vol=5.425122e+07
assign (segid "    " and resid   28 and name  HB*) (segid "    " and resid   28 and name   HN) 1.993 0.497 0.497 weight 1.000 ! spec=CNOE , no=139, id=64, vol=3.915689e+08
assign (segid "    " and resid   28 and name  HB*) (segid "    " and resid   29 and name   HN) 2.821 0.732 0.732 weight 1.000 ! spec=NNOE , no=168, id=708, vol=1.717391e+08
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name  HB2) 2.897 1.049 1.049 weight 1.000 ! spec=NNOE , no=145, id=515, vol=8.211602e+07
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name  HB*) 2.448 0.749 0.749 weight 1.000 ! spec=NNOE , no=146, id=516, vol=2.260143e+08
assign (segid "    " and resid   29 and name   HA) (segid "    " and resid   29 and name  HD2) 3.500 0.800 0.800 weight 1.000 ! spec=CNOE , no=744, id=307, vol=3.347422e+08
assign (segid "    " and resid   29 and name   HA) (segid "    " and resid   29 and name   HN) 2.749 0.944 0.944 weight 1.000 ! spec=NNOE , no=163, id=705, vol=8.009719e+07
assign (segid "    " and resid   29 and name  HB2) (segid "    " and resid   15 and name HD2*) 3.215 0.855 0.855 weight 1.000 ! spec=CNOE , no=484, id=217, vol=7.681224e+07
assign (segid "    " and resid   29 and name  HB2) (segid "    " and resid   29 and name   HA) 2.470 0.763 0.763 weight 1.000 ! spec=CNOE , no=451, id=211, vol=1.082044e+08
assign (segid "    " and resid   29 and name  HB2) (segid "    " and resid   29 and name   HA) 2.540 0.807 0.807 weight 1.000 ! spec=CNOE , no=398, id=145, vol=1.082044e+08
assign (segid "    " and resid   29 and name  HB2) (segid "    " and resid   29 and name   HN) 2.496 0.779 0.779 weight 1.000 ! spec=NNOE , no=165, id=707, vol=1.429922e+08
assign (segid "    " and resid   29 and name  HG2) (segid "    " and resid   29 and name   HN) 2.922 1.067 1.067 weight 1.000 ! spec=CNOE , no=338, id=165, vol=3.944271e+07
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   15 and name HD1*) 3.764 1.955 1.955 weight 1.000 ! spec=NNOE , no=381, id=705, vol=1.089399e+08
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   26 and name   HA) 2.967 1.100 1.100 weight 1.000 ! spec=NNOE , no=164, id=706, vol=5.063367e+07
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   28 and name  HB*) 2.624 0.860 0.860 weight 1.000 ! spec=NNOE , no=151, id=520, vol=1.489553e+08
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name   HA) 2.922 1.067 1.067 weight 1.000 ! spec=NNOE , no=148, id=517, vol=7.811308e+07
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name  HD2) 2.555 0.816 0.816 weight 1.000 ! spec=NNOE , no=150, id=519, vol=1.748158e+08
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name  HE2) 3.441 1.480 1.480 weight 1.000 ! spec=NNOE , no=153, id=521, vol=2.925211e+07
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   13 and name HD1*) 3.553 1.215 1.215 weight 1.000 ! spec=CNOE , no=1065, id=16, vol=1.050203e+08
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name   HB) 2.721 0.926 0.926 weight 1.000 ! spec=CNOE , no=913, id=449, vol=6.046264e+07
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name   HB) 2.957 1.093 1.093 weight 1.000 ! spec=CNOE , no=805, id=332, vol=4.353932e+07
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   33 and name  HB1) 3.575 1.533 1.533 weight 1.000 ! spec=CNOE , no=915, id=451, vol=4.353932e+07
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   33 and name  HB2) 3.519 1.672 1.672 weight 1.000 ! spec=CNOE , no=914, id=450, vol=1.578889e+08
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   33 and name   HN) 3.070 1.178 1.178 weight 1.000 ! spec=CNOE , no=824, id=345, vol=3.475997e+07
assign (segid "    " and resid   30 and name   HB) (segid "    " and resid   27 and name   HA) 2.336 0.682 0.682 weight 1.000 ! spec=CNOE , no=501, id=225, vol=1.512338e+08
assign (segid "    " and resid   30 and name HD1*) (segid "    " and resid   15 and name HD2*) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE , no=1210, id=563, vol=1.289571e+08
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   30 and name   HA) 2.896 0.603 0.603 weight 1.000 ! spec=CNOE , no=126, id=55, vol=2.187513e+08
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   30 and name   HB) 2.807 0.498 0.498 weight 1.000 ! spec=CNOE , no=123, id=54, vol=3.877329e+08
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   31 and name   HA) 2.800 0.925 0.925 weight 1.000 ! spec=CNOE , no=129, id=58, vol=6.067811e+07
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   31 and name   HN) 2.853 0.815 0.815 weight 1.000 ! spec=CNOE , no=145, id=68, vol=8.870824e+07
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   30 and name   HA) 2.010 0.505 0.505 weight 1.000 ! spec=CNOE , no=919, id=452, vol=3.720702e+08
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   30 and name   HA) 2.259 0.638 0.638 weight 1.000 ! spec=CNOE , no=105, id=25, vol=2.187513e+08
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   30 and name   HA) 2.868 0.534 0.534 weight 1.000 ! spec=CNOE , no=808, id=335, vol=3.720702e+08
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   30 and name   HN) 2.666 0.889 0.889 weight 1.000 ! spec=CNOE , no=1021, id=414, vol=8.093198e+07
assign (segid "    " and resid   30 and name HG2*) (segid "    " and resid   31 and name   HA) 2.797 0.978 0.978 weight 1.000 ! spec=CNOE , no=108, id=27, vol=6.067811e+07
assign (segid "    " and resid  30  and name   HN) (segid "    " and resid   15 and name HD1*) 3.270 0.978 0.978 weight 1.000 ! spec=NNOE , no=400, id=679, vol=5.802793e+07
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   27 and name   HA) 3.167 1.254 1.254 weight 1.000 ! spec=NNOE , no=172, id=712, vol=3.423298e+07
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   29 and name   HN) 2.839 1.007 1.007 weight 1.000 ! spec=NNOE , no=171, id=711, vol=6.599490e+07
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name   HA) 3.029 1.147 1.147 weight 1.000 ! spec=NNOE , no=173, id=713, vol=4.474633e+07
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name   HA) 3.118 1.215 1.215 weight 1.000 ! spec=NNOE , no=156, id=524, vol=5.287289e+07
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name   HB) 2.565 0.822 0.822 weight 1.000 ! spec=NNOE , no=174, id=714, vol=1.213988e+08
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name   HB) 3.234 1.307 1.307 weight 1.000 ! spec=NNOE , no=158, id=526, vol=4.247278e+07
assign (segid "    " and resid  30  and name   HN) (segid "    " and resid   30 and name HG11) 3.270 0.978 0.978 weight 1.000 ! spec=NNOE , no=399, id=679, vol=5.802793e+07
assign (segid "    " and resid   31 and name   HA) (segid "    " and resid   31 and name   HN) 2.875 1.033 1.033 weight 1.000 ! spec=NNOE , no=179, id=718, vol=6.121098e+07
assign (segid "    " and resid   31 and name   HA) (segid "    " and resid   35 and name   HN) 3.082 0.710 0.710 weight 1.000 ! spec=CNOE , no=843, id=409, vol=1.343120e+08
assign (segid "    " and resid   31 and name   HA) (segid "    " and resid   36 and name   HN) 3.193 0.775 0.775 weight 1.000 ! spec=CNOE , no=909, id=368, vol=2.742831e+07
assign (segid "    " and resid   31 and name   HA) (segid "    " and resid   36 and name   HN) 3.222 0.674 0.674 weight 1.000 ! spec=CNOE , no=1035, id=493, vol=1.568019e+08
assign (segid "    " and resid   31 and name   HA) (segid "    " and resid   41 and name HE22) 3.553 1.215 1.215 weight 1.000 ! spec=CNOE , no=1060, id=16, vol=1.050203e+08
assign (segid "    " and resid   31 and name  HB1) (segid "    " and resid   31 and name   HA) 2.827 0.737 0.737 weight 1.000 ! spec=CNOE , no=309, id=152, vol=1.200709e+08
assign (segid "    " and resid   31 and name  HB1) (segid "    " and resid   31 and name   HN) 2.885 0.844 0.844 weight 1.000 ! spec=CNOE , no=327, id=158, vol=5.477275e+08
assign (segid "    " and resid   31 and name  HB2) (segid "    " and resid   31 and name   HA) 2.827 0.737 0.737 weight 1.000 ! spec=CNOE , no=289, id=152, vol=1.200709e+08
assign (segid "    " and resid   31 and name  HB2) (segid "    " and resid   31 and name  HB1) 2.427 0.737 0.737 weight 1.000 ! spec=CNOE , no=322, id=152, vol=1.200709e+08
assign (segid "    " and resid   31 and name  HB2) (segid "    " and resid   31 and name   HN) 2.885 0.844 0.844 weight 1.000 ! spec=CNOE , no=329, id=158, vol=5.477275e+08
assign (segid "    " and resid   31 and name  HB2) (segid "    " and resid   32 and name   HN) 2.885 0.844 0.844 weight 1.000 ! spec=CNOE , no=324, id=158, vol=5.477275e+08
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   28 and name   HA) 2.959 0.800 0.800 weight 1.000 ! spec=NNOE , no=163, id=530, vol=7.242154e+07
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   28 and name  HB*) 3.985 1.268 1.268 weight 1.000 ! spec=NNOE , no=190, id=729, vol=3.308728e+07
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name   HA) 3.444 1.483 1.483 weight 1.000 ! spec=NNOE , no=168, id=534, vol=2.909928e+07
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name  HB2) 3.002 1.126 1.126 weight 1.000 ! spec=NNOE , no=171, id=536, vol=6.640661e+07
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name   HN) 2.812 0.988 0.988 weight 1.000 ! spec=NNOE , no=183, id=722, vol=6.991266e+07
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name   HN) 2.925 1.070 1.070 weight 1.000 ! spec=NNOE , no=165, id=532, vol=7.750930e+07
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   33 and name  HB2) 2.147 0.576 0.576 weight 1.000 ! spec=CNOE , no=941, id=385, vol=2.965450e+08
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   33 and name   HN) 2.505 0.784 0.784 weight 1.000 ! spec=CNOE , no=713, id=288, vol=1.177494e+08
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   34 and name   HN) 2.900 1.052 1.052 weight 1.000 ! spec=CNOE , no=1089, id=527, vol=4.125474e+07
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   34 and name   HN) 2.983 1.112 1.112 weight 1.000 ! spec=CNOE , no=955, id=395, vol=4.125474e+07
assign (segid "    " and resid   33 and name  HG2) (segid "    " and resid   33 and name   HA) 2.802 0.721 0.721 weight 1.000 ! spec=CNOE , no=252, id=137, vol=1.279193e+08
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   32 and name   HA) 2.845 0.875 0.875 weight 1.000 ! spec=NNOE , no=193, id=732, vol=1.007850e+08
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   33 and name  HD2) 2.774 0.962 0.962 weight 1.000 ! spec=NNOE , no=177, id=541, vol=1.065175e+08
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   33 and name  HG2) 2.603 0.847 0.847 weight 1.000 ! spec=NNOE , no=198, id=735, vol=1.111139e+08
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   34 and name   HN) 2.526 0.797 0.797 weight 1.000 ! spec=NNOE , no=201, id=736, vol=1.330879e+08
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   34 and name   HN) 2.673 0.893 0.893 weight 1.000 ! spec=NNOE , no=179, id=543, vol=1.330879e+08
assign (segid "    " and resid   34 and name  HB1) (segid "    " and resid   30 and name HG2*) 3.562 0.820 0.820 weight 1.000 ! spec=CNOE , no=463, id=176, vol=1.028757e+08
assign (segid "    " and resid   34 and name  HB2) (segid "    " and resid   34 and name   HN) 2.594 0.841 0.841 weight 1.000 ! spec=CNOE , no=382, id=136, vol=9.546428e+07
assign (segid "    " and resid   34 and name  HB2) (segid "    " and resid   36 and name HD1*) 2.201 0.606 0.606 weight 1.000 ! spec=CNOE , no=363, id=129, vol=2.554456e+08
assign (segid "    " and resid   34 and name  HB2) (segid "    " and resid   36 and name   HN) 3.054 1.166 1.166 weight 1.000 ! spec=CNOE , no=420, id=158, vol=3.584183e+07
assign (segid "    " and resid   34 and name  HB2) (segid "    " and resid   36 and name   HN) 3.116 1.214 1.214 weight 1.000 ! spec=CNOE , no=416, id=156, vol=3.175120e+07
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   31 and name   HA) 3.161 1.249 1.249 weight 1.000 ! spec=NNOE , no=204, id=739, vol=3.460282e+07
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name  HG2) 2.634 0.867 0.867 weight 1.000 ! spec=NNOE , no=186, id=546, vol=1.456049e+08
assign (segid "    " and resid   35 and name  HA1) (segid "    " and resid   35 and name   HN) 2.339 0.684 0.684 weight 1.000 ! spec=NNOE , no=194, id=550, vol=2.966178e+08
assign (segid "    " and resid   35 and name  HA1) (segid "    " and resid   35 and name   HN) 2.390 0.714 0.714 weight 1.000 ! spec=NNOE , no=212, id=745, vol=1.854060e+08
assign (segid "    " and resid   35 and name  HA1) (segid "    " and resid   36 and name   HN) 2.724 0.927 0.927 weight 1.000 ! spec=NNOE , no=218, id=751, vol=8.463694e+07
assign (segid "    " and resid   35 and name  HA1) (segid "    " and resid   36 and name   HN) 3.098 1.200 1.200 weight 1.000 ! spec=CNOE , no=575, id=225, vol=3.289265e+07
assign (segid "    " and resid   35 and name  HA2) (segid "    " and resid   34 and name   HN) 3.246 1.317 1.317 weight 1.000 ! spec=CNOE , no=663, id=296, vol=2.099006e+07
assign (segid "    " and resid   35 and name  HA2) (segid "    " and resid   35 and name   HN) 2.210 0.610 0.610 weight 1.000 ! spec=NNOE , no=213, id=746, vol=2.966178e+08
assign (segid "    " and resid   35 and name  HA2) (segid "    " and resid   35 and name   HN) 2.530 0.800 0.800 weight 1.000 ! spec=NNOE , no=190, id=549, vol=1.854060e+08
assign (segid "    " and resid   35 and name  HA2) (segid "    " and resid   36 and name   HN) 3.012 1.134 1.134 weight 1.000 ! spec=CNOE , no=665, id=298, vol=3.289265e+07
assign (segid "    " and resid   35 and name  HA2) (segid "    " and resid   36 and name   HN) 3.089 1.193 1.193 weight 1.000 ! spec=CNOE , no=574, id=224, vol=3.347175e+07
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name   HA) 2.986 1.115 1.115 weight 1.000 ! spec=NNOE , no=211, id=744, vol=4.871230e+07
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name   HA) 3.161 1.249 1.249 weight 1.000 ! spec=NNOE , no=189, id=548, vol=4.871230e+07
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   36 and name   HN) 2.559 0.819 0.819 weight 1.000 ! spec=NNOE , no=226, id=757, vol=1.229919e+08
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   36 and name   HN) 2.834 1.004 1.004 weight 1.000 ! spec=NNOE , no=188, id=547, vol=9.372202e+07
assign (segid "    " and resid   36 and name   HA) (segid "    " and resid   36 and name HG2*) 2.263 0.640 0.640 weight 1.000 ! spec=CNOE , no=1121, id=533, vol=1.828285e+08
assign (segid "    " and resid   36 and name   HA) (segid "    " and resid   36 and name   HN) 2.632 0.866 0.866 weight 1.000 ! spec=NNOE , no=217, id=750, vol=1.040080e+08
assign (segid "    " and resid   36 and name   HA) (segid "    " and resid   36 and name   HN) 2.786 0.970 0.970 weight 1.000 ! spec=NNOE , no=193, id=551, vol=1.040080e+08
assign (segid "    " and resid   36 and name   HB) (segid "    " and resid   36 and name   HA) 2.423 0.734 0.734 weight 1.000 ! spec=CNOE , no=1070, id=511, vol=1.213800e+08
assign (segid "    " and resid   36 and name   HB) (segid "    " and resid   36 and name   HA) 2.492 0.776 0.776 weight 1.000 ! spec=CNOE , no=937, id=384, vol=1.213800e+08
assign (segid "    " and resid   36 and name   HB) (segid "    " and resid   36 and name   HA) 2.833 0.623 0.623 weight 1.000 ! spec=CNOE , no=2, id=4, vol=1.979747e+08
assign (segid "    " and resid   36 and name   HB) (segid "    " and resid   36 and name HG2*) 1.980 0.490 0.490 weight 1.000 ! spec=CNOE , no=1177, id=555, vol=4.079835e+08
assign (segid "    " and resid   36 and name   HB) (segid "    " and resid   36 and name   HN) 2.150 0.578 0.578 weight 1.000 ! spec=NNOE , no=223, id=756, vol=3.494639e+08
assign (segid "    " and resid   36 and name   HB) (segid "    " and resid   36 and name   HN) 2.276 0.648 0.648 weight 1.000 ! spec=NNOE , no=199, id=557, vol=3.494639e+08
assign (segid "    " and resid   36 and name   HB) (segid "    " and resid   36 and name   HN) 2.833 0.623 0.623 weight 1.000 ! spec=CNOE , no=1, id=4, vol=1.979747e+08
assign (segid "    " and resid   36 and name HD1*) (segid "    " and resid   34 and name  HB1) 3.053 0.815 0.815 weight 1.000 ! spec=CNOE , no=1037, id=16, vol=1.050203e+08
assign (segid "    " and resid   36 and name HD1*) (segid "    " and resid   34 and name  HB2) 3.053 0.815 0.815 weight 1.000 ! spec=CNOE , no=1038, id=16, vol=1.050203e+08
assign (segid "    " and resid   36 and name HD1*) (segid "    " and resid   36 and name   HA) 2.553 0.815 0.815 weight 1.000 ! spec=CNOE , no=76, id=16, vol=1.050203e+08
assign (segid "    " and resid   36 and name HD1*) (segid "    " and resid   36 and name   HB) 2.553 0.815 0.815 weight 1.000 ! spec=CNOE , no=79, id=16, vol=1.050203e+08
assign (segid "    " and resid   36 and name HD1*) (segid "    " and resid   36 and name HG11) 2.853 0.815 0.815 weight 1.000 ! spec=CNOE , no=1039, id=16, vol=1.050203e+08
assign (segid "    " and resid   36 and name HD1*) (segid "    " and resid   36 and name   HN) 3.277 0.830 0.830 weight 1.000 ! spec=CNOE , no=1036, id=416, vol=9.930218e+07
assign (segid "    " and resid   36 and name HG2*) (segid "    " and resid   36 and name   HN) 2.559 0.819 0.819 weight 1.000 ! spec=CNOE , no=137, id=62, vol=8.746347e+07
assign (segid "    " and resid   36 and name HG2*) (segid "    " and resid   40 and name  HB2) 2.102 0.552 0.552 weight 1.000 ! spec=CNOE , no=116, id=49, vol=2.847916e+08
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   35 and name  HA2) 2.339 0.684 0.684 weight 1.000 ! spec=NNOE , no=192, id=550, vol=2.966178e+08
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name HG12) 2.572 0.827 0.827 weight 1.000 ! spec=NNOE , no=230, id=761, vol=1.192476e+08
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   38 and name   HA) 2.255 0.635 0.635 weight 1.000 ! spec=CNOE , no=814, id=339, vol=2.214382e+08
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   38 and name   HA) 2.800 0.800 0.800 weight 1.000 ! spec=CNOE , no=427, id=158, vol=3.584183e+07
assign (segid "    " and resid   38 and name  HG2) (segid "    " and resid   38 and name   HA) 2.851 0.691 0.691 weight 1.000 ! spec=CNOE , no=284, id=148, vol=1.452841e+08
assign (segid "    " and resid   38 and name  HG2) (segid "    " and resid   38 and name   HA) 2.882 0.651 0.651 weight 1.000 ! spec=CNOE , no=922, id=453, vol=1.739769e+08
assign (segid "    " and resid   39 and name   HA) (segid "    " and resid   39 and name   HN) 2.630 0.864 0.864 weight 1.000 ! spec=CNOE , no=778, id=367, vol=7.425431e+07
assign (segid "    " and resid   39 and name   HA) (segid "    " and resid   39 and name   HN) 2.705 0.915 0.915 weight 1.000 ! spec=CNOE , no=682, id=268, vol=7.425431e+07
assign (segid "    " and resid   39 and name   HA) (segid "    " and resid   40 and name   HN) 2.557 0.817 0.817 weight 1.000 ! spec=NNOE , no=236, id=766, vol=1.235158e+08
assign (segid "    " and resid   39 and name   HA) (segid "    " and resid   40 and name   HN) 2.794 0.976 0.976 weight 1.000 ! spec=CNOE , no=931, id=382, vol=6.116894e+07
assign (segid "    " and resid   40 and name   HA) (segid "    " and resid   40 and name  HG2) 2.083 0.542 0.542 weight 1.000 ! spec=CNOE , no=700, id=282, vol=3.559433e+08
assign (segid "    " and resid   40 and name  HB2) (segid "    " and resid   40 and name   HN) 2.683 0.900 0.900 weight 1.000 ! spec=CNOE , no=323, id=113, vol=7.794230e+07
assign (segid "    " and resid   40 and name  HB*) (segid "    " and resid   40 and name   HN) 2.609 0.851 0.851 weight 1.000 ! spec=CNOE , no=365, id=176, vol=7.794230e+07
assign (segid "    " and resid   40 and name  HG2) (segid "    " and resid   40 and name   HN) 2.589 0.838 0.838 weight 1.000 ! spec=CNOE , no=389, id=140, vol=9.655285e+07
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   36 and name HG2*) 3.819 1.216 1.216 weight 1.000 ! spec=NNOE , no=239, id=769, vol=3.754798e+07
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   39 and name   HN) 3.298 1.359 1.359 weight 1.000 ! spec=NNOE , no=210, id=567, vol=3.778169e+07
assign (segid "    " and resid   41 and name   HA) (segid "    " and resid   41 and name   HN) 2.892 1.045 1.045 weight 1.000 ! spec=NNOE , no=242, id=772, vol=5.904149e+07
assign (segid "    " and resid   41 and name   HA) (segid "    " and resid   41 and name   HN) 3.091 1.195 1.195 weight 1.000 ! spec=NNOE , no=216, id=570, vol=5.566100e+07
assign (segid "    " and resid   41 and name   HA) (segid "    " and resid   42 and name   HN) 2.389 0.713 0.713 weight 1.000 ! spec=NNOE , no=250, id=780, vol=1.858122e+08
assign (segid "    " and resid   41 and name  HB2) (segid "    " and resid   41 and name   HN) 2.644 0.874 0.874 weight 1.000 ! spec=NNOE , no=218, id=572, vol=1.423739e+08
assign (segid "    " and resid   41 and name  HG2) (segid "    " and resid   41 and name   HA) 2.846 1.012 1.012 weight 1.000 ! spec=CNOE , no=412, id=155, vol=5.474194e+07
assign (segid "    " and resid   41 and name  HG2) (segid "    " and resid   41 and name  HB2) 2.441 0.745 0.745 weight 1.000 ! spec=CNOE , no=407, id=151, vol=1.375823e+08
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   36 and name HG2*) 3.173 1.259 1.259 weight 1.000 ! spec=NNOE , no=246, id=776, vol=3.382682e+07
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   40 and name   HA) 2.997 1.122 1.122 weight 1.000 ! spec=NNOE , no=241, id=771, vol=4.770295e+07
assign (segid "    " and resid  41  and name   HN) (segid "    " and resid   40 and name   HA) 3.270 0.578 0.578 weight 1.000 ! spec=NNOE , no=403, id=679, vol=5.802793e+07
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   41 and name  HG2) 2.915 1.062 1.062 weight 1.000 ! spec=NNOE , no=217, id=571, vol=7.922864e+07
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   42 and name  HD2) 3.249 0.877 0.877 weight 1.000 ! spec=CNOE , no=795, id=380, vol=7.105052e+07
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   42 and name  HG2) 2.120 0.562 0.562 weight 1.000 ! spec=CNOE , no=751, id=346, vol=2.702186e+08
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   42 and name   HN) 2.691 0.905 0.905 weight 1.000 ! spec=CNOE , no=779, id=368, vol=6.464896e+07
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   43 and name HD2*) 3.729 1.231 1.231 weight 1.000 ! spec=CNOE , no=762, id=355, vol=5.940420e+07
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   43 and name   HN) 2.135 0.570 0.570 weight 1.000 ! spec=CNOE , no=733, id=333, vol=2.590494e+08
assign (segid "    " and resid   42 and name  HG2) (segid "    " and resid   42 and name  HD2) 2.827 0.737 0.737 weight 1.000 ! spec=CNOE , no=300, id=152, vol=1.200709e+08
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   41 and name   HA) 2.647 0.876 0.876 weight 1.000 ! spec=NNOE , no=221, id=575, vol=1.412431e+08
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   43 and name   HA) 3.546 0.943 0.943 weight 1.000 ! spec=NNOE , no=386, id=700, vol=1.132461e+08
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   72 and name  HB2) 3.500 1.000 1.000 weight 1.000 ! spec=NNOE , no=226, id=575, vol=1.412431e+08
assign (segid "    " and resid  42  and name   HN) (segid "    " and resid   72 and name   HN) 3.270 0.800 0.800 weight 1.000 ! spec=NNOE , no=418, id=679, vol=5.802793e+07
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   43 and name   HN) 3.034 1.151 1.151 weight 1.000 ! spec=CNOE , no=1055, id=502, vol=3.149094e+07
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   44 and name   HN) 2.138 0.572 0.572 weight 1.000 ! spec=CNOE , no=647, id=248, vol=3.041869e+08
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   44 and name   HN) 2.348 0.689 0.689 weight 1.000 ! spec=CNOE , no=737, id=337, vol=1.466482e+08
assign (segid "    " and resid   43 and name  HB1) (segid "    " and resid   43 and name  HB2) 1.965 0.482 0.482 weight 1.000 ! spec=CNOE , no=1014, id=487, vol=4.270904e+08
assign (segid "    " and resid   43 and name  HB1) (segid "    " and resid   43 and name HD2*) 2.817 0.615 0.615 weight 1.000 ! spec=CNOE , no=1008, id=483, vol=2.066004e+08
assign (segid "    " and resid   43 and name  HB1) (segid "    " and resid   43 and name   HN) 3.013 1.135 1.135 weight 1.000 ! spec=NNOE , no=257, id=787, vol=4.619396e+07
assign (segid "    " and resid   43 and name  HB1) (segid "    " and resid   44 and name   HN) 2.821 1.010 1.010 weight 1.000 ! spec=CNOE , no=897, id=367, vol=4.270904e+08
assign (segid "    " and resid   43 and name  HB2) (segid "    " and resid   43 and name  HB1) 2.800 0.800 0.800 weight 1.000 ! spec=CNOE , no=894, id=367, vol=4.270904e+08
assign (segid "    " and resid   43 and name  HB2) (segid "    " and resid   43 and name HD22) 2.800 0.650 0.650 weight 1.000 ! spec=CNOE , no=888, id=364, vol=2.066004e+08
assign (segid "    " and resid   43 and name  HB2) (segid "    " and resid   43 and name   HN) 2.804 0.983 0.983 weight 1.000 ! spec=CNOE , no=1030, id=492, vol=5.051407e+07
assign (segid "    " and resid   43 and name  HB2) (segid "    " and resid   44 and name   HN) 3.193 1.275 1.275 weight 1.000 ! spec=CNOE , no=904, id=368, vol=2.742831e+07
assign (segid "    " and resid   43 and name HD1*) (segid "    " and resid   43 and name  HB2) 2.800 1.000 1.000 weight 1.000 ! spec=CNOE , no=1217, id=700, vol=1.230679e+08
assign (segid "    " and resid   43 and name HD2*) (segid "    " and resid   44 and name   HN) 3.612 1.253 1.253 weight 1.000 ! spec=CNOE , no=1141, id=541, vol=7.735629e+07
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name HD1*) 3.374 1.423 1.423 weight 1.000 ! spec=NNOE , no=232, id=583, vol=3.292041e+07
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name HD22) 3.400 1.445 1.445 weight 1.000 ! spec=NNOE , no=233, id=584, vol=3.144247e+07
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name HD2*) 2.974 1.106 1.106 weight 1.000 ! spec=NNOE , no=258, id=788, vol=4.989233e+07
assign (segid "    " and resid   44 and name   HB) (segid "    " and resid   44 and name   HN) 2.615 0.855 0.855 weight 1.000 ! spec=CNOE , no=625, id=284, vol=7.687652e+07
assign (segid "    " and resid   44 and name   HB) (segid "    " and resid   44 and name   HN) 2.799 0.979 0.979 weight 1.000 ! spec=CNOE , no=476, id=188, vol=6.046347e+07
assign (segid "    " and resid   44 and name   HB) (segid "    " and resid   70 and name   HN) 3.500 0.800 0.800 weight 1.000 ! spec=CNOE , no=1054, id=16, vol=1.050203e+08
assign (segid "    " and resid   44 and name HG2*) (segid "    " and resid   44 and name   HB) 2.886 0.445 0.445 weight 1.000 ! spec=CNOE , no=119, id=52, vol=5.457867e+08
assign (segid "    " and resid   44 and name HG2*) (segid "    " and resid   48 and name   HN) 3.500 0.690 0.690 weight 1.000 ! spec=CNOE , no=144, id=67, vol=1.457866e+08
assign (segid "    " and resid   44 and name HG2*) (segid "    " and resid   44 and name   HA) 2.276 0.647 0.647 weight 1.000 ! spec=CNOE , no=48, id=14, vol=2.093482e+08
assign (segid "    " and resid   44 and name HG2*) (segid "    " and resid   44 and name   HB) 2.203 0.607 0.607 weight 1.000 ! spec=CNOE , no=607, id=272, vol=2.146779e+08
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   43 and name  HB1) 2.877 1.035 1.035 weight 1.000 ! spec=NNOE , no=263, id=793, vol=6.091053e+07
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   43 and name  HB2) 3.289 1.352 1.352 weight 1.000 ! spec=NNOE , no=237, id=588, vol=3.837113e+07
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   43 and name HD1*) 3.500 1.200 1.200 weight 1.000 ! spec=NNOE , no=238, id=589, vol=7.890514e+07
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   43 and name HD2*) 3.538 1.079 1.079 weight 1.000 ! spec=NNOE , no=239, id=590, vol=7.552560e+07
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   44 and name   HA) 3.420 1.462 1.462 weight 1.000 ! spec=NNOE , no=235, id=586, vol=3.035422e+07
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   44 and name HG2*) 3.583 0.968 0.968 weight 1.000 ! spec=NNOE , no=264, id=794, vol=7.429333e+07
assign (segid "    " and resid   45 and name  HB1) (segid "    " and resid   45 and name   HA) 2.388 0.713 0.713 weight 1.000 ! spec=CNOE , no=691, id=275, vol=1.567462e+08
assign (segid "    " and resid   45 and name  HB1) (segid "    " and resid   45 and name   HA) 2.790 0.973 0.973 weight 1.000 ! spec=CNOE , no=672, id=304, vol=5.205129e+07
assign (segid "    " and resid   45 and name  HB1) (segid "    " and resid   45 and name  HD1) 2.776 0.963 0.963 weight 1.000 ! spec=CNOE , no=668, id=300, vol=5.366606e+07
assign (segid "    " and resid   45 and name  HB1) (segid "    " and resid   45 and name   HN) 3.170 1.256 1.256 weight 1.000 ! spec=CNOE , no=671, id=303, vol=2.419515e+07
assign (segid "    " and resid   45 and name  HB2) (segid "    " and resid   45 and name   HA) 2.891 1.045 1.045 weight 1.000 ! spec=CNOE , no=673, id=305, vol=4.206086e+07
assign (segid "    " and resid   45 and name  HB2) (segid "    " and resid   45 and name   HA) 2.942 1.082 1.082 weight 1.000 ! spec=CNOE , no=583, id=227, vol=4.482875e+07
assign (segid "    " and resid   45 and name  HB2) (segid "    " and resid   45 and name  HD1) 2.595 0.842 0.842 weight 1.000 ! spec=CNOE , no=669, id=301, vol=8.046670e+07
assign (segid "    " and resid   45 and name  HB2) (segid "    " and resid   45 and name   HN) 2.926 1.070 1.070 weight 1.000 ! spec=NNOE , no=265, id=795, vol=5.502347e+07
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   44 and name HD1*) 2.938 1.079 1.079 weight 1.000 ! spec=NNOE , no=244, id=595, vol=7.558718e+07
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   45 and name   HA) 3.351 1.403 1.403 weight 1.000 ! spec=NNOE , no=241, id=592, vol=3.432488e+07
assign (segid "    " and resid  45  and name   HN) (segid "    " and resid   45 and name  HD*) 3.270 0.800 0.800 weight 1.000 ! spec=NNOE , no=420, id=679, vol=5.802793e+07
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   49 and name   HA) 3.197 1.277 1.277 weight 1.000 ! spec=NNOE , no=271, id=801, vol=3.237849e+07
assign (segid "    " and resid   46 and name   HA) (segid "    " and resid   46 and name  HB*) 2.436 0.742 0.742 weight 1.000 ! spec=CNOE , no=614, id=231, vol=1.390977e+08
assign (segid "    " and resid   46 and name  HB*) (segid "    " and resid   46 and name   HA) 2.263 0.640 0.640 weight 1.000 ! spec=CNOE , no=106, id=43, vol=1.827160e+08
assign (segid "    " and resid   47 and name  HA1) (segid "    " and resid   47 and name  HA2) 2.118 0.561 0.561 weight 1.000 ! spec=CNOE , no=682, id=307, vol=2.719167e+08
assign (segid "    " and resid   47 and name  HA2) (segid "    " and resid   44 and name HG2*) 2.895 1.048 1.048 weight 1.000 ! spec=CNOE , no=651, id=288, vol=4.170842e+07
assign (segid "    " and resid   47 and name  HA2) (segid "    " and resid   47 and name  HA1) 2.179 0.593 0.593 weight 1.000 ! spec=CNOE , no=591, id=229, vol=2.719167e+08
assign (segid "    " and resid   47 and name  HA2) (segid "    " and resid   47 and name   HN) 2.847 1.013 1.013 weight 1.000 ! spec=NNOE , no=278, id=807, vol=6.485274e+07
assign (segid "    " and resid   47 and name   HN) (segid "    " and resid   46 and name   HA) 3.116 1.214 1.214 weight 1.000 ! spec=NNOE , no=277, id=806, vol=3.773296e+07
assign (segid "    " and resid   47 and name   HN) (segid "    " and resid   46 and name   HA) 3.634 1.651 1.651 weight 1.000 ! spec=NNOE , no=249, id=600, vol=2.108150e+07
assign (segid "    " and resid   47 and name   HN) (segid "    " and resid   46 and name  HB*) 3.290 1.353 1.353 weight 1.000 ! spec=NNOE , no=281, id=808, vol=2.725581e+07)
assign (segid "    " and resid   48 and name   HA) (segid "    " and resid   48 and name  HG*) 2.277 0.648 0.648 weight 1.000 ! spec=CNOE , no=725, id=326, vol=1.764679e+08
assign (segid "    " and resid   48 and name   HA) (segid "    " and resid   48 and name   HN) 2.632 0.866 0.866 weight 1.000 ! spec=CNOE , no=734, id=334, vol=7.389164e+07
assign (segid "    " and resid   48 and name  HB2) (segid "    " and resid   48 and name   HA) 2.128 0.566 0.566 weight 1.000 ! spec=CNOE , no=631, id=238, vol=3.134376e+08
assign (segid "    " and resid   48 and name  HG2) (segid "    " and resid   48 and name   HA) 2.341 0.685 0.685 weight 1.000 ! spec=CNOE , no=632, id=239, vol=1.764679e+08
assign (segid "    " and resid   48 and name   HN) (segid "    " and resid   48 and name  HG2) 2.924 1.069 1.069 weight 1.000 ! spec=NNOE , no=128, id=501, vol=7.770377e+07
assign (segid "    " and resid   49 and name   HA) (segid "    " and resid   44 and name HD1*) 2.881 0.770 0.770 weight 1.000 ! spec=CNOE , no=760, id=353, vol=1.052154e+08
assign (segid "    " and resid   49 and name   HA) (segid "    " and resid   44 and name HG2*) 3.511 1.059 1.059 weight 1.000 ! spec=CNOE , no=761, id=354, vol=4.034627e+07
assign (segid "    " and resid   49 and name   HA) (segid "    " and resid   49 and name  HG2) 2.176 0.592 0.592 weight 1.000 ! spec=CNOE , no=798, id=383, vol=2.311288e+08
assign (segid "    " and resid   49 and name   HA) (segid "    " and resid   49 and name  HG2) 2.238 0.626 0.626 weight 1.000 ! spec=CNOE , no=701, id=283, vol=2.311288e+08
assign (segid "    " and resid   49 and name   HA) (segid "    " and resid   49 and name   HN) 2.105 0.554 0.554 weight 1.000 ! spec=CNOE , no=780, id=369, vol=2.821254e+08
assign (segid "    " and resid   49 and name  HB2) (segid "    " and resid   49 and name   HA) 2.160 0.583 0.583 weight 1.000 ! spec=CNOE , no=1083, id=523, vol=2.420768e+08
assign (segid "    " and resid   49 and name  HB2) (segid "    " and resid   49 and name   HA) 2.221 0.617 0.617 weight 1.000 ! spec=CNOE , no=950, id=391, vol=2.420768e+08
# Restraints file 3: sds_retract.upload

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 3    and name HN )
       ( resid 3    and name N )  -0.947881  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 5    and name HN )
       ( resid 5    and name N )  5.25643  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 6    and name HN )
       ( resid 6    and name N )  4.30855  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 11    and name HN )
       ( resid 11    and name N )  -7.75539  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 13    and name HN )
       ( resid 13    and name N )  2.92981  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 14    and name HN )
       ( resid 14    and name N )  2.49896  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 15    and name HN )
       ( resid 15    and name N )  0.517026  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 23    and name HN )
       ( resid 23    and name N )  6.29048  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 25    and name HN )
       ( resid 25    and name N )  0.947881  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 27    and name HN )
       ( resid 27    and name N )  4.65323  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 28    and name HN )
       ( resid 28    and name N )  3.70535  0.2000 


assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 31    and name HN )
       ( resid 31    and name N )  5.17026  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 32    and name HN )
       ( resid 32    and name N )  2.24045  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 33    and name HN )
       ( resid 33    and name N )  3.2745  0.2000 


assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 39    and name HN )
       ( resid 39    and name N )  -0.258513  0.2000 


assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 41    and name HN )
       ( resid 41    and name N )  3.87769  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 42    and name HN )
       ( resid 42    and name N )  5.68729  0.2000 


assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 44    and name HN )
       ( resid 44    and name N )  4.99792  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 45    and name HN )
       ( resid 45    and name N )  1.98193  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 47    and name HN )
       ( resid 47    and name N )  5.9458  0.2000 


assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 49    and name HN )
       ( resid 49    and name N )  3.53301  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 50    and name HN )
       ( resid 50    and name N )  6.549  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 54    and name HN )
       ( resid 54    and name N )  3.61918  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 55    and name HN )
       ( resid 55    and name N )  4.05004  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 56    and name HN )
       ( resid 56    and name N )  4.82558  0.2000 


assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 60    and name HN )
       ( resid 60    and name N )  4.56706  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 68    and name HN )
       ( resid 68    and name N )  2.32662  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 69    and name HN )
       ( resid 69    and name N )  4.99792  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 70    and name HN )
       ( resid 70    and name N )  5.17026  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 71    and name HN )
       ( resid 71    and name N )  2.24045  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 72    and name HN )
       ( resid 72    and name N )  5.60111  0.2000 


# Restraints file 4: ctab_retract.upload

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 3    and name HN )
       ( resid 3    and name N )  0.947881  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 4    and name HN )
       ( resid 4    and name N )  -0.517026  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 5    and name HN )
       ( resid 5    and name N )  5.68729  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 6    and name HN )
       ( resid 6    and name N )  5.3426  0.2000 



assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 13    and name HN )
       ( resid 13    and name N )  4.13621  0.2000 



assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 15    and name HN )
       ( resid 15    and name N )  1.46491  0.2000 



assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 21    and name HN )
       ( resid 21    and name N )  -3.18833  0.2000 



assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 23    and name HN )
       ( resid 23    and name N )  7.23836  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 25    and name HN )
       ( resid 25    and name N )  1.55108  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 27    and name HN )
       ( resid 27    and name N )  5.51494  0.2000 


assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 31    and name HN )
       ( resid 31    and name N )  6.72134  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 32    and name HN )
       ( resid 32    and name N )  1.20639  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 33    and name HN )
       ( resid 33    and name N )  3.87769  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 35    and name HN )
       ( resid 35    and name N )  0.517026  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 40    and name HN )
       ( resid 40    and name N )  4.22238  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 41    and name HN )
       ( resid 41    and name N )  5.60111  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 42    and name HN )
       ( resid 42    and name N )  7.15219  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 44    and name HN )
       ( resid 44    and name N )  5.60111  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 45    and name HN )
       ( resid 45    and name N )  3.01598  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 47    and name HN )
       ( resid 47    and name N )  5.25643  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 48    and name HN )
       ( resid 48    and name N )  -2.6713  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 49    and name HN )
       ( resid 49    and name N )  3.36067  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 50    and name HN )
       ( resid 50    and name N )  5.25643  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 51    and name HN )
       ( resid 51    and name N )  -5.42877  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 55    and name HN )
       ( resid 55    and name N )  4.30855  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 56    and name HN )
       ( resid 56    and name N )  4.91175  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 60    and name HN )
       ( resid 60    and name N )  4.91175  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 68    and name HN )
       ( resid 68    and name N )  4.99792  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 69    and name HN )
       ( resid 69    and name N )  5.77346  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 70    and name HN )
       ( resid 70    and name N )  5.68729  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 71    and name HN )
       ( resid 71    and name N )  3.96387  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 72    and name HN )
       ( resid 72    and name N )  6.20431  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 74    and name HN )
       ( resid 74    and name N )  3.79152  0.2000 
# Restraints file 5: ppUb_retract_rdc.upload

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 4    and name HN )
       ( resid 4    and name N )  -27.0049  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 5    and name HN )
       ( resid 5    and name N )  12.2256  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 6    and name HN )
       ( resid 6    and name N )  9.7312  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 7    and name HN )
       ( resid 7    and name N )  15.3275  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 11    and name HN )
       ( resid 11    and name N )  -15.2664  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 13    and name HN )
       ( resid 13    and name N )  8.6971  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 14    and name HN )
       ( resid 14    and name N )  10.9477  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 16    and name HN )
       ( resid 16    and name N )  -8.3935  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 17    and name HN )
       ( resid 17    and name N )  -17.1518  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 18    and name HN )
       ( resid 18    and name N )  6.5688  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 22    and name HN )
       ( resid 22    and name N )  7.0553  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 23    and name HN )
       ( resid 23    and name N )  10.2183  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 27    and name HN )
       ( resid 27    and name N )  11.6774  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 28    and name HN )
       ( resid 28    and name N )  8.5148  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 29    and name HN )
       ( resid 29    and name N )  5.1698  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 30    and name HN )
       ( resid 30    and name N )  23.4163  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 31    and name HN )
       ( resid 31    and name N )  11.4955  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 32    and name HN )
       ( resid 32    and name N )  3.6494  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 33    and name HN )
       ( resid 33    and name N )  8.7582  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 41    and name HN )
       ( resid 41    and name N )  10.0967  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 43    and name HN )
       ( resid 43    and name N )  6.3865  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 44    and name HN )
       ( resid 44    and name N )  12.7116  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 45    and name HN )
       ( resid 45    and name N )  4.0751  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 47    and name HN )
       ( resid 47    and name N )  7.8465  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 48    and name HN )
       ( resid 48    and name N )  -8.3326  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 49    and name HN )
       ( resid 49    and name N )  6.6298  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 50    and name HN )
       ( resid 50    and name N )  15.3884  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 54    and name HN )
       ( resid 54    and name N )  5.474  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 55    and name HN )
       ( resid 55    and name N )  6.2646  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 57    and name HN )
       ( resid 57    and name N )  6.0822  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 58    and name HN )
       ( resid 58    and name N )  -6.8121  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 60    and name HN )
       ( resid 60    and name N )  32.6005  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 63    and name HN )
       ( resid 63    and name N )  1.332  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 64    and name HN )
       ( resid 64    and name N )  -8.515  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 68    and name HN )
       ( resid 68    and name N )  8.7588  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 69    and name HN )
       ( resid 69    and name N )  22.261  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 70    and name HN )
       ( resid 70    and name N )  10.1569  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 71    and name HN )
       ( resid 71    and name N )  7.6632  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 72    and name HN )
       ( resid 72    and name N )  11.4349  0.2000 

assign ( resid 5000  and name OO  )
       ( resid 5000  and name Z   )
       ( resid 5000  and name X   )
       ( resid 5000  and name Y   )
       ( resid 73    and name HN )
       ( resid 73    and name N )  8.3329  0.2000 
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1  29.337  28.678   2.698
    2    H2   MET   1           HT2      MET   1  28.538  27.392   1.926
    3    H3   MET   1           HT3      MET   1  28.797  27.349   3.605
    4    HA   MET   1           HA       MET   1  26.909  29.025   2.070
    5    HB2  MET   1           HB2      MET   1  26.587  27.351   4.579
    6    HB3  MET   1           HB1      MET   1  25.298  28.105   3.640
    7    HG2  MET   1           HG2      MET   1  27.188  25.975   2.598
    8    HG3  MET   1           HG1      MET   1  25.526  25.690   3.114
    9    HE1  MET   1           HE1      MET   1  26.814  25.064   0.076
   10    HE2  MET   1           HE2      MET   1  25.237  25.275  -0.680
   11    HE3  MET   1           HE3      MET   1  25.351  24.519   0.908
   12    H    GLN   2           HN       GLN   2  25.653  30.521   3.601
   13    HA   GLN   2           HA       GLN   2  27.606  32.160   5.074
   14    HB2  GLN   2           HB2      GLN   2  24.631  32.660   4.835
   15    HB3  GLN   2           HB1      GLN   2  25.912  33.837   5.126
   16    HG2  GLN   2           HG2      GLN   2  25.394  34.109   2.833
   17    HG3  GLN   2           HG1      GLN   2  26.848  33.111   2.828
   18   HE21  GLN   2          HE21      GLN   2  23.332  32.380   3.280
   19   HE22  GLN   2          HE22      GLN   2  23.298  31.138   2.124
   20    H    ILE   3           HN       ILE   3  28.002  30.615   6.834
   21    HA   ILE   3           HA       ILE   3  25.860  29.719   8.550
   22    HB   ILE   3           HB       ILE   3  28.831  29.985   9.101
   23   HG12  ILE   3          HG12      ILE   3  27.223  27.560   8.250
   24   HG13  ILE   3          HG11      ILE   3  28.162  28.552   7.133
   25   HG21  ILE   3          HG21      ILE   3  28.346  28.218  10.811
   26   HG22  ILE   3          HG22      ILE   3  26.627  28.443  10.499
   27   HG23  ILE   3          HG23      ILE   3  27.580  29.763  11.175
   28   HD11  ILE   3          HD11      ILE   3  29.221  27.015   9.516
   29   HD12  ILE   3          HD12      ILE   3  30.185  28.126   8.544
   30   HD13  ILE   3          HD13      ILE   3  29.524  26.663   7.815
   31    H    PHE   4           HN       PHE   4  24.912  30.774  10.248
   32    HA   PHE   4           HA       PHE   4  25.674  33.578  10.731
   33    HB2  PHE   4           HB2      PHE   4  23.422  31.828  11.740
   34    HB3  PHE   4           HB1      PHE   4  23.663  33.489  12.283
   35    HD1  PHE   4           HD1      PHE   4  22.722  31.333   9.455
   36    HD2  PHE   4           HD2      PHE   4  23.373  35.378  10.747
   37    HE1  PHE   4           HE1      PHE   4  21.573  32.168   7.422
   38    HE2  PHE   4           HE2      PHE   4  22.224  36.212   8.714
   39    HZ   PHE   4           HZ       PHE   4  21.324  34.607   7.051
   40    H    VAL   5           HN       VAL   5  26.337  34.397  12.741
   41    HA   VAL   5           HA       VAL   5  26.982  32.458  14.912
   42    HB   VAL   5           HB       VAL   5  28.972  34.406  13.701
   43   HG11  VAL   5          HG11      VAL   5  30.532  33.260  15.340
   44   HG12  VAL   5          HG12      VAL   5  29.103  32.549  16.091
   45   HG13  VAL   5          HG13      VAL   5  29.315  34.300  16.081
   46   HG21  VAL   5          HG21      VAL   5  28.786  32.461  12.295
   47   HG22  VAL   5          HG22      VAL   5  28.755  31.384  13.691
   48   HG23  VAL   5          HG23      VAL   5  30.237  32.244  13.272
   49    H    LYS   6           HN       LYS   6  25.599  33.380  16.415
   50    HA   LYS   6           HA       LYS   6  25.680  36.343  16.795
   51    HB2  LYS   6           HB2      LYS   6  23.463  35.237  16.491
   52    HB3  LYS   6           HB1      LYS   6  23.768  34.293  17.950
   53    HG2  LYS   6           HG2      LYS   6  23.932  36.349  19.276
   54    HG3  LYS   6           HG1      LYS   6  23.699  37.323  17.823
   55    HD2  LYS   6           HD2      LYS   6  21.474  36.286  17.496
   56    HD3  LYS   6           HD1      LYS   6  21.704  35.348  18.973
   57    HE2  LYS   6           HE2      LYS   6  21.720  38.377  18.828
   58    HE3  LYS   6           HE1      LYS   6  20.354  37.401  19.368
   59    HZ1  LYS   6           HZ1      LYS   6  23.031  37.614  20.622
   60    HZ2  LYS   6           HZ2      LYS   6  21.896  36.426  21.053
   61    HZ3  LYS   6           HZ3      LYS   6  21.538  38.071  21.285
   62    H    THR   7           HN       THR   7  26.558  37.208  18.624
   63    HA   THR   7           HA       THR   7  27.735  35.331  20.623
   64    HB   THR   7           HB       THR   7  28.210  38.307  20.268
   65    HG1  THR   7           HG1      THR   7  30.257  37.367  19.402
   66   HG21  THR   7          HG21      THR   7  28.841  37.636  22.469
   67   HG22  THR   7          HG22      THR   7  30.334  37.665  21.532
   68   HG23  THR   7          HG23      THR   7  29.544  36.128  21.885
   69    H    LEU   8           HN       LEU   8  27.568  36.022  22.945
   70    HA   LEU   8           HA       LEU   8  24.852  36.455  23.714
   71    HB2  LEU   8           HB2      LEU   8  27.479  36.581  25.200
   72    HB3  LEU   8           HB1      LEU   8  25.963  36.978  26.011
   73    HG   LEU   8           HG       LEU   8  25.048  34.778  25.437
   74   HD11  LEU   8          HD11      LEU   8  26.061  34.266  23.349
   75   HD12  LEU   8          HD12      LEU   8  26.738  33.090  24.473
   76   HD13  LEU   8          HD13      LEU   8  27.687  34.496  23.991
   77   HD21  LEU   8          HD21      LEU   8  26.495  33.418  26.867
   78   HD22  LEU   8          HD22      LEU   8  26.404  35.056  27.515
   79   HD23  LEU   8          HD23      LEU   8  27.834  34.540  26.621
   80    H    THR   9           HN       THR   9  27.479  38.675  23.059
   81    HA   THR   9           HA       THR   9  26.168  40.958  24.324
   82    HB   THR   9           HB       THR   9  27.965  42.274  23.276
   83    HG1  THR   9           HG1      THR   9  29.533  40.786  22.109
   84   HG21  THR   9          HG21      THR   9  29.879  41.134  24.317
   85   HG22  THR   9          HG22      THR   9  28.956  39.632  24.383
   86   HG23  THR   9          HG23      THR   9  28.453  41.021  25.349
   87    H    GLY  10           HN       GLY  10  25.392  39.208  21.650
   88    HA2  GLY  10           HA3      GLY  10  23.657  39.745  20.097
   89    HA3  GLY  10           HA2      GLY  10  23.840  41.451  20.509
   90    H    LYS  11           HN       LYS  11  26.901  40.790  20.168
   91    HA   LYS  11           HA       LYS  11  27.232  41.985  17.622
   92    HB2  LYS  11           HB2      LYS  11  29.028  41.807  19.345
   93    HB3  LYS  11           HB1      LYS  11  29.148  40.081  19.005
   94    HG2  LYS  11           HG2      LYS  11  29.746  40.558  16.673
   95    HG3  LYS  11           HG1      LYS  11  29.573  42.288  16.968
   96    HD2  LYS  11           HD2      LYS  11  31.377  42.189  18.646
   97    HD3  LYS  11           HD1      LYS  11  31.552  40.457  18.358
   98    HE2  LYS  11           HE2      LYS  11  32.132  40.898  16.005
   99    HE3  LYS  11           HE1      LYS  11  31.945  42.631  16.279
  100    HZ1  LYS  11           HZ1      LYS  11  34.264  41.915  16.417
  101    HZ2  LYS  11           HZ2      LYS  11  33.872  40.873  17.701
  102    HZ3  LYS  11           HZ3      LYS  11  33.719  42.555  17.890
  103    H    THR  12           HN       THR  12  26.306  41.091  15.821
  104    HA   THR  12           HA       THR  12  26.344  38.147  15.453
  105    HB   THR  12           HB       THR  12  25.111  40.344  13.761
  106    HG1  THR  12           HG1      THR  12  24.217  39.991  15.883
  107   HG21  THR  12          HG21      THR  12  23.809  38.331  12.858
  108   HG22  THR  12          HG22      THR  12  25.043  37.326  13.616
  109   HG23  THR  12          HG23      THR  12  25.492  38.465  12.348
  110    H    ILE  13           HN       ILE  13  27.367  37.155  13.666
  111    HA   ILE  13           HA       ILE  13  29.095  38.841  11.928
  112    HB   ILE  13           HB       ILE  13  30.154  36.410  13.406
  113   HG12  ILE  13          HG12      ILE  13  30.595  39.364  13.958
  114   HG13  ILE  13          HG11      ILE  13  29.741  38.231  15.006
  115   HG21  ILE  13          HG21      ILE  13  31.618  38.583  11.884
  116   HG22  ILE  13          HG22      ILE  13  31.138  37.048  11.160
  117   HG23  ILE  13          HG23      ILE  13  32.286  37.072  12.497
  118   HD11  ILE  13          HD11      ILE  13  31.864  36.858  15.095
  119   HD12  ILE  13          HD12      ILE  13  31.975  38.438  15.870
  120   HD13  ILE  13          HD13      ILE  13  32.677  38.189  14.272
  121    H    THR  14           HN       THR  14  29.248  37.963   9.853
  122    HA   THR  14           HA       THR  14  27.904  35.309   9.414
  123    HB   THR  14           HB       THR  14  27.304  36.188   7.180
  124    HG1  THR  14           HG1      THR  14  27.897  38.778   7.897
  125   HG21  THR  14          HG21      THR  14  25.645  36.465   8.895
  126   HG22  THR  14          HG22      THR  14  25.709  37.979   7.992
  127   HG23  THR  14          HG23      THR  14  26.492  37.859   9.567
  128    H    LEU  15           HN       LEU  15  29.206  33.765   8.578
  129    HA   LEU  15           HA       LEU  15  31.755  34.605   7.219
  130    HB2  LEU  15           HB2      LEU  15  31.267  32.002   8.690
  131    HB3  LEU  15           HB1      LEU  15  32.807  32.644   8.120
  132    HG   LEU  15           HG       LEU  15  31.072  33.914  10.261
  133   HD11  LEU  15          HD11      LEU  15  32.654  33.100  11.852
  134   HD12  LEU  15          HD12      LEU  15  33.780  32.606  10.588
  135   HD13  LEU  15          HD13      LEU  15  32.273  31.721  10.819
  136   HD21  LEU  15          HD21      LEU  15  33.708  34.657   8.979
  137   HD22  LEU  15          HD22      LEU  15  33.292  35.217  10.599
  138   HD23  LEU  15          HD23      LEU  15  32.284  35.669   9.226
  139    H    GLU  16           HN       GLU  16  31.589  34.215   5.076
  140    HA   GLU  16           HA       GLU  16  29.756  32.084   4.099
  141    HB2  GLU  16           HB2      GLU  16  31.411  34.015   2.452
  142    HB3  GLU  16           HB1      GLU  16  29.994  33.099   1.937
  143    HG2  GLU  16           HG2      GLU  16  28.652  34.355   3.663
  144    HG3  GLU  16           HG1      GLU  16  30.069  35.369   3.942
  145    H    VAL  17           HN       VAL  17  30.693  30.081   4.001
  146    HA   VAL  17           HA       VAL  17  33.178  29.748   2.497
  147    HB   VAL  17           HB       VAL  17  34.123  30.330   4.650
  148   HG11  VAL  17          HG11      VAL  17  32.120  29.822   6.014
  149   HG12  VAL  17          HG12      VAL  17  33.561  29.051   6.677
  150   HG13  VAL  17          HG13      VAL  17  32.394  28.097   5.760
  151   HG21  VAL  17          HG21      VAL  17  35.482  28.398   5.013
  152   HG22  VAL  17          HG22      VAL  17  35.057  28.380   3.301
  153   HG23  VAL  17          HG23      VAL  17  34.216  27.318   4.430
  154    H    GLU  18           HN       GLU  18  33.532  27.565   1.896
  155    HA   GLU  18           HA       GLU  18  31.208  25.951   1.619
  156    HB2  GLU  18           HB2      GLU  18  34.123  25.173   1.389
  157    HB3  GLU  18           HB1      GLU  18  32.766  24.222   0.784
  158    HG2  GLU  18           HG2      GLU  18  32.105  26.087  -0.688
  159    HG3  GLU  18           HG1      GLU  18  33.456  27.046  -0.081
  160    HA   PRO  19           HA       PRO  19  31.001  24.303   5.871
  161    HB2  PRO  19           HB2      PRO  19  29.733  22.050   4.330
  162    HB3  PRO  19           HB1      PRO  19  29.212  22.805   5.852
  163    HG2  PRO  19           HG2      PRO  19  28.023  23.409   3.555
  164    HG3  PRO  19           HG1      PRO  19  28.321  24.650   4.787
  165    HD2  PRO  19           HD2      PRO  19  29.696  24.240   2.168
  166    HD3  PRO  19           HD1      PRO  19  29.469  25.734   3.105
  167    H    SER  20           HN       SER  20  32.586  22.816   3.158
  168    HA   SER  20           HA       SER  20  33.554  20.486   4.608
  169    HB2  SER  20           HB2      SER  20  35.090  20.233   2.667
  170    HB3  SER  20           HB1      SER  20  33.408  20.436   2.183
  171    HG   SER  20           HG       SER  20  35.396  22.467   2.298
  172    H    ASP  21           HN       ASP  21  34.403  23.769   4.517
  173    HA   ASP  21           HA       ASP  21  37.190  23.707   5.023
  174    HB2  ASP  21           HB2      ASP  21  34.948  25.558   5.786
  175    HB3  ASP  21           HB1      ASP  21  36.523  25.793   6.529
  176    H    THR  22           HN       THR  22  38.307  23.774   7.175
  177    HA   THR  22           HA       THR  22  37.177  21.770   8.961
  178    HB   THR  22           HB       THR  22  39.624  23.427   9.575
  179    HG1  THR  22           HG1      THR  22  40.752  22.382   8.074
  180   HG21  THR  22          HG21      THR  22  40.426  21.233  10.417
  181   HG22  THR  22          HG22      THR  22  38.893  20.507   9.939
  182   HG23  THR  22          HG23      THR  22  38.931  21.734  11.204
  183    H    ILE  23           HN       ILE  23  37.176  22.239  11.402
  184    HA   ILE  23           HA       ILE  23  35.500  24.566  11.896
  185    HB   ILE  23           HB       ILE  23  36.749  22.541  13.765
  186   HG12  ILE  23          HG12      ILE  23  33.898  22.855  12.783
  187   HG13  ILE  23          HG11      ILE  23  35.059  21.744  12.066
  188   HG21  ILE  23          HG21      ILE  23  34.939  23.439  15.327
  189   HG22  ILE  23          HG22      ILE  23  34.773  24.794  14.209
  190   HG23  ILE  23          HG23      ILE  23  36.303  24.521  15.043
  191   HD11  ILE  23          HD11      ILE  23  34.587  21.641  15.028
  192   HD12  ILE  23          HD12      ILE  23  35.097  20.362  13.931
  193   HD13  ILE  23          HD13      ILE  23  33.419  20.900  13.938
  194    H    GLU  24           HN       GLU  24  38.780  23.550  12.856
  195    HA   GLU  24           HA       GLU  24  39.457  25.854  14.367
  196    HB2  GLU  24           HB2      GLU  24  41.864  25.226  13.476
  197    HB3  GLU  24           HB1      GLU  24  41.020  24.123  14.562
  198    HG2  GLU  24           HG2      GLU  24  40.369  22.695  12.779
  199    HG3  GLU  24           HG1      GLU  24  40.775  23.903  11.559
  200    H    ASN  25           HN       ASN  25  39.085  25.397  10.943
  201    HA   ASN  25           HA       ASN  25  40.686  27.664  10.113
  202    HB2  ASN  25           HB2      ASN  25  39.895  25.733   8.630
  203    HB3  ASN  25           HB1      ASN  25  38.306  26.497   8.647
  204   HD21  ASN  25          HD21      ASN  25  38.307  27.175   6.424
  205   HD22  ASN  25          HD22      ASN  25  39.392  28.335   5.824
  206    H    VAL  26           HN       VAL  26  37.228  27.119  10.769
  207    HA   VAL  26           HA       VAL  26  36.376  29.797  10.209
  208    HB   VAL  26           HB       VAL  26  35.226  27.868  12.254
  209   HG11  VAL  26          HG11      VAL  26  34.042  30.185  10.698
  210   HG12  VAL  26          HG12      VAL  26  34.324  30.126  12.437
  211   HG13  VAL  26          HG13      VAL  26  33.111  29.077  11.706
  212   HG21  VAL  26          HG21      VAL  26  34.873  28.092   9.259
  213   HG22  VAL  26          HG22      VAL  26  33.687  27.291  10.291
  214   HG23  VAL  26          HG23      VAL  26  35.335  26.671  10.195
  215    H    LYS  27           HN       LYS  27  36.808  28.257  13.402
  216    HA   LYS  27           HA       LYS  27  36.742  30.412  15.090
  217    HB2  LYS  27           HB2      LYS  27  38.714  28.111  15.119
  218    HB3  LYS  27           HB1      LYS  27  38.485  29.223  16.469
  219    HG2  LYS  27           HG2      LYS  27  36.040  28.620  16.452
  220    HG3  LYS  27           HG1      LYS  27  36.411  27.382  15.254
  221    HD2  LYS  27           HD2      LYS  27  37.829  26.198  16.780
  222    HD3  LYS  27           HD1      LYS  27  37.807  27.530  17.935
  223    HE2  LYS  27           HE2      LYS  27  36.289  25.720  18.650
  224    HE3  LYS  27           HE1      LYS  27  35.390  27.192  18.287
  225    HZ1  LYS  27           HZ1      LYS  27  35.600  24.716  16.700
  226    HZ2  LYS  27           HZ2      LYS  27  35.183  26.186  15.956
  227    HZ3  LYS  27           HZ3      LYS  27  34.207  25.549  17.193
  228    H    ALA  28           HN       ALA  28  39.184  29.768  12.702
  229    HA   ALA  28           HA       ALA  28  41.211  31.537  13.756
  230    HB1  ALA  28           HB1      ALA  28  42.342  31.202  11.720
  231    HB2  ALA  28           HB2      ALA  28  40.846  30.995  10.810
  232    HB3  ALA  28           HB3      ALA  28  41.404  29.720  11.892
  233    H    LYS  29           HN       LYS  29  38.897  31.980  11.057
  234    HA   LYS  29           HA       LYS  29  39.369  34.701  10.575
  235    HB2  LYS  29           HB2      LYS  29  36.546  33.637  10.520
  236    HB3  LYS  29           HB1      LYS  29  37.337  34.740   9.397
  237    HG2  LYS  29           HG2      LYS  29  37.796  31.755   9.662
  238    HG3  LYS  29           HG1      LYS  29  37.109  32.613   8.289
  239    HD2  LYS  29           HD2      LYS  29  39.318  33.861   8.112
  240    HD3  LYS  29           HD1      LYS  29  39.971  32.705   9.266
  241    HE2  LYS  29           HE2      LYS  29  39.318  30.851   7.756
  242    HE3  LYS  29           HE1      LYS  29  38.726  32.031   6.587
  243    HZ1  LYS  29           HZ1      LYS  29  41.308  32.782   7.324
  244    HZ2  LYS  29           HZ2      LYS  29  40.775  32.217   5.813
  245    HZ3  LYS  29           HZ3      LYS  29  41.354  31.122   6.976
  246    H    ILE  30           HN       ILE  30  37.658  33.201  13.224
  247    HA   ILE  30           HA       ILE  30  36.471  35.730  14.130
  248    HB   ILE  30           HB       ILE  30  36.668  33.010  15.464
  249   HG12  ILE  30          HG12      ILE  30  34.344  34.351  14.040
  250   HG13  ILE  30          HG11      ILE  30  35.373  33.118  13.310
  251   HG21  ILE  30          HG21      ILE  30  34.803  33.927  16.880
  252   HG22  ILE  30          HG22      ILE  30  35.064  35.499  16.128
  253   HG23  ILE  30          HG23      ILE  30  36.330  34.777  17.119
  254   HD11  ILE  30          HD11      ILE  30  34.768  31.647  15.327
  255   HD12  ILE  30          HD12      ILE  30  33.491  31.931  14.146
  256   HD13  ILE  30          HD13      ILE  30  33.502  32.827  15.664
  257    H    GLN  31           HN       GLN  31  38.688  33.424  15.701
  258    HA   GLN  31           HA       GLN  31  39.643  34.838  17.819
  259    HB2  GLN  31           HB2      GLN  31  40.432  32.595  17.186
  260    HB3  GLN  31           HB1      GLN  31  41.350  33.289  15.853
  261    HG2  GLN  31           HG2      GLN  31  42.737  34.537  17.374
  262    HG3  GLN  31           HG1      GLN  31  41.758  34.051  18.754
  263   HE21  GLN  31          HE21      GLN  31  44.385  33.392  19.026
  264   HE22  GLN  31          HE22      GLN  31  44.651  31.742  18.732
  265    H    ASP  32           HN       ASP  32  40.837  35.254  14.494
  266    HA   ASP  32           HA       ASP  32  42.732  37.330  15.209
  267    HB2  ASP  32           HB2      ASP  32  42.959  35.997  13.141
  268    HB3  ASP  32           HB1      ASP  32  41.476  36.721  12.517
  269    H    LYS  33           HN       LYS  33  39.603  37.493  13.517
  270    HA   LYS  33           HA       LYS  33  39.429  40.315  13.402
  271    HB2  LYS  33           HB2      LYS  33  37.435  38.100  13.337
  272    HB3  LYS  33           HB1      LYS  33  36.861  39.759  13.379
  273    HG2  LYS  33           HG2      LYS  33  37.172  38.704  11.071
  274    HG3  LYS  33           HG1      LYS  33  37.902  40.285  11.309
  275    HD2  LYS  33           HD2      LYS  33  40.093  39.363  11.444
  276    HD3  LYS  33           HD1      LYS  33  39.482  37.737  11.717
  277    HE2  LYS  33           HE2      LYS  33  39.124  39.313   9.158
  278    HE3  LYS  33           HE1      LYS  33  40.316  38.037   9.403
  279    HZ1  LYS  33           HZ1      LYS  33  37.777  37.118  10.200
  280    HZ2  LYS  33           HZ2      LYS  33  38.782  36.524   8.965
  281    HZ3  LYS  33           HZ3      LYS  33  37.661  37.757   8.633
  282    H    GLU  34           HN       GLU  34  38.360  38.119  16.008
  283    HA   GLU  34           HA       GLU  34  37.431  40.464  17.577
  284    HB2  GLU  34           HB2      GLU  34  37.436  37.580  18.487
  285    HB3  GLU  34           HB1      GLU  34  36.436  38.909  19.065
  286    HG2  GLU  34           HG2      GLU  34  35.492  39.050  16.691
  287    HG3  GLU  34           HG1      GLU  34  36.269  37.493  16.403
  288    H    GLY  35           HN       GLY  35  40.085  38.151  17.462
  289    HA2  GLY  35           HA3      GLY  35  42.182  38.316  18.543
  290    HA3  GLY  35           HA2      GLY  35  41.635  39.820  19.287
  291    H    ILE  36           HN       ILE  36  39.631  37.008  19.549
  292    HA   ILE  36           HA       ILE  36  40.211  36.859  22.462
  293    HB   ILE  36           HB       ILE  36  37.808  35.856  20.947
  294   HG12  ILE  36          HG12      ILE  36  38.286  38.494  22.372
  295   HG13  ILE  36          HG11      ILE  36  38.057  38.286  20.637
  296   HG21  ILE  36          HG21      ILE  36  38.332  34.925  23.229
  297   HG22  ILE  36          HG22      ILE  36  36.797  35.786  23.140
  298   HG23  ILE  36          HG23      ILE  36  38.205  36.564  23.861
  299   HD11  ILE  36          HD11      ILE  36  35.946  38.957  21.562
  300   HD12  ILE  36          HD12      ILE  36  36.050  37.725  22.819
  301   HD13  ILE  36          HD13      ILE  36  35.825  37.250  21.134
  302    HA   PRO  37           HA       PRO  37  42.281  32.986  20.952
  303    HB2  PRO  37           HB2      PRO  37  42.518  32.799  23.944
  304    HB3  PRO  37           HB1      PRO  37  43.724  32.422  22.695
  305    HG2  PRO  37           HG2      PRO  37  43.872  34.688  24.050
  306    HG3  PRO  37           HG1      PRO  37  44.214  34.654  22.309
  307    HD2  PRO  37           HD2      PRO  37  41.798  35.708  23.732
  308    HD3  PRO  37           HD1      PRO  37  42.554  36.272  22.225
  309    HA   PRO  38           HA       PRO  38  38.402  30.599  21.288
  310    HB2  PRO  38           HB2      PRO  38  40.468  28.465  20.900
  311    HB3  PRO  38           HB1      PRO  38  38.832  28.573  20.214
  312    HG2  PRO  38           HG2      PRO  38  40.879  29.293  18.763
  313    HG3  PRO  38           HG1      PRO  38  39.422  30.290  18.758
  314    HD2  PRO  38           HD2      PRO  38  42.071  30.834  20.045
  315    HD3  PRO  38           HD1      PRO  38  40.875  31.979  19.395
  316    H    ASP  39           HN       ASP  39  41.226  30.259  23.255
  317    HA   ASP  39           HA       ASP  39  40.427  28.175  25.002
  318    HB2  ASP  39           HB2      ASP  39  42.131  30.627  25.463
  319    HB3  ASP  39           HB1      ASP  39  41.910  29.374  26.684
  320    H    GLN  40           HN       GLN  40  39.784  31.677  25.189
  321    HA   GLN  40           HA       GLN  40  38.124  31.313  27.581
  322    HB2  GLN  40           HB2      GLN  40  38.703  33.760  25.883
  323    HB3  GLN  40           HB1      GLN  40  37.874  33.761  27.439
  324    HG2  GLN  40           HG2      GLN  40  39.912  32.717  28.464
  325    HG3  GLN  40           HG1      GLN  40  40.734  32.915  26.917
  326   HE21  GLN  40          HE21      GLN  40  42.044  34.740  26.971
  327   HE22  GLN  40          HE22      GLN  40  41.651  36.204  27.734
  328    H    GLN  41           HN       GLN  41  37.473  30.420  24.589
  329    HA   GLN  41           HA       GLN  41  34.637  31.396  24.697
  330    HB2  GLN  41           HB2      GLN  41  36.296  31.073  22.180
  331    HB3  GLN  41           HB1      GLN  41  34.621  31.614  22.270
  332    HG2  GLN  41           HG2      GLN  41  35.298  33.587  23.556
  333    HG3  GLN  41           HG1      GLN  41  36.975  33.037  23.543
  334   HE21  GLN  41          HE21      GLN  41  34.908  35.135  21.969
  335   HE22  GLN  41          HE22      GLN  41  35.693  35.217  20.466
  336    H    ARG  42           HN       ARG  42  33.109  29.862  24.219
  337    HA   ARG  42           HA       ARG  42  34.016  27.170  23.283
  338    HB2  ARG  42           HB2      ARG  42  32.353  27.856  25.716
  339    HB3  ARG  42           HB1      ARG  42  32.188  26.291  24.923
  340    HG2  ARG  42           HG2      ARG  42  34.947  27.271  25.641
  341    HG3  ARG  42           HG1      ARG  42  33.920  26.609  26.910
  342    HD2  ARG  42           HD2      ARG  42  33.722  24.503  25.773
  343    HD3  ARG  42           HD1      ARG  42  34.473  25.144  24.315
  344    HE   ARG  42           HE       ARG  42  35.876  24.283  26.740
  345   HH11  ARG  42          HH11      ARG  42  38.132  24.326  26.598
  346   HH12  ARG  42          HH12      ARG  42  38.887  25.167  25.285
  347   HH21  ARG  42          HH21      ARG  42  35.892  26.166  23.852
  348   HH22  ARG  42          HH22      ARG  42  37.619  26.207  23.731
  349    H    LEU  43           HN       LEU  43  32.727  26.540  21.540
  350    HA   LEU  43           HA       LEU  43  30.430  28.261  20.885
  351    HB2  LEU  43           HB2      LEU  43  31.453  25.867  19.366
  352    HB3  LEU  43           HB1      LEU  43  30.458  27.196  18.751
  353    HG   LEU  43           HG       LEU  43  33.389  27.204  19.510
  354   HD11  LEU  43          HD11      LEU  43  32.787  26.679  17.196
  355   HD12  LEU  43          HD12      LEU  43  33.565  28.259  17.274
  356   HD13  LEU  43          HD13      LEU  43  31.813  28.145  17.105
  357   HD21  LEU  43          HD21      LEU  43  33.261  29.714  19.098
  358   HD22  LEU  43          HD22      LEU  43  32.560  29.163  20.617
  359   HD23  LEU  43          HD23      LEU  43  31.511  29.567  19.260
  360    H    ILE  44           HN       ILE  44  28.328  27.549  20.708
  361    HA   ILE  44           HA       ILE  44  27.677  24.830  21.828
  362    HB   ILE  44           HB       ILE  44  26.077  27.398  22.115
  363   HG12  ILE  44          HG12      ILE  44  28.067  27.498  23.517
  364   HG13  ILE  44          HG11      ILE  44  26.666  27.192  24.538
  365   HG21  ILE  44          HG21      ILE  44  24.733  25.988  23.716
  366   HG22  ILE  44          HG22      ILE  44  25.678  24.587  23.210
  367   HG23  ILE  44          HG23      ILE  44  24.642  25.414  22.047
  368   HD11  ILE  44          HD11      ILE  44  28.922  25.357  23.813
  369   HD12  ILE  44          HD12      ILE  44  27.345  24.646  24.143
  370   HD13  ILE  44          HD13      ILE  44  28.151  25.616  25.373
  371    H    PHE  45           HN       PHE  45  26.319  23.597  20.506
  372    HA   PHE  45           HA       PHE  45  24.715  24.979  18.442
  373    HB2  PHE  45           HB2      PHE  45  26.649  24.683  17.143
  374    HB3  PHE  45           HB1      PHE  45  27.057  23.157  17.918
  375    HD1  PHE  45           HD1      PHE  45  24.369  24.721  15.819
  376    HD2  PHE  45           HD2      PHE  45  26.531  21.153  16.826
  377    HE1  PHE  45           HE1      PHE  45  23.189  23.500  14.011
  378    HE2  PHE  45           HE2      PHE  45  25.353  19.927  15.017
  379    HZ   PHE  45           HZ       PHE  45  23.681  21.102  13.611
  380    H    ALA  46           HN       ALA  46  22.757  24.143  18.911
  381    HA   ALA  46           HA       ALA  46  21.053  22.585  19.250
  382    HB1  ALA  46           HB1      ALA  46  22.946  20.515  18.139
  383    HB2  ALA  46           HB2      ALA  46  22.181  21.726  17.110
  384    HB3  ALA  46           HB3      ALA  46  21.188  20.576  18.007
  385    H    GLY  47           HN       GLY  47  23.338  22.838  21.363
  386    HA2  GLY  47           HA3      GLY  47  23.233  21.916  23.567
  387    HA3  GLY  47           HA2      GLY  47  22.403  20.501  22.927
  388    H    LYS  48           HN       LYS  48  24.951  21.064  20.871
  389    HA   LYS  48           HA       LYS  48  26.827  19.341  22.462
  390    HB2  LYS  48           HB2      LYS  48  26.199  19.201  19.521
  391    HB3  LYS  48           HB1      LYS  48  27.445  18.258  20.327
  392    HG2  LYS  48           HG2      LYS  48  25.720  17.244  21.783
  393    HG3  LYS  48           HG1      LYS  48  24.476  18.170  20.942
  394    HD2  LYS  48           HD2      LYS  48  25.086  17.067  18.819
  395    HD3  LYS  48           HD1      LYS  48  26.324  16.135  19.660
  396    HE2  LYS  48           HE2      LYS  48  24.594  15.117  21.092
  397    HE3  LYS  48           HE1      LYS  48  23.352  16.050  20.257
  398    HZ1  LYS  48           HZ1      LYS  48  23.380  14.668  18.526
  399    HZ2  LYS  48           HZ2      LYS  48  24.203  13.584  19.544
  400    HZ3  LYS  48           HZ3      LYS  48  25.074  14.586  18.484
  401    H    GLN  49           HN       GLN  49  29.099  19.766  22.080
  402    HA   GLN  49           HA       GLN  49  29.624  22.484  21.089
  403    HB2  GLN  49           HB2      GLN  49  30.478  21.410  23.325
  404    HB3  GLN  49           HB1      GLN  49  31.666  20.615  22.296
  405    HG2  GLN  49           HG2      GLN  49  32.141  22.998  21.371
  406    HG3  GLN  49           HG1      GLN  49  31.285  23.564  22.802
  407   HE21  GLN  49          HE21      GLN  49  32.138  22.544  24.951
  408   HE22  GLN  49          HE22      GLN  49  33.819  22.336  25.074
  409    H    LEU  50           HN       LEU  50  31.683  22.709  19.699
  410    HA   LEU  50           HA       LEU  50  31.702  20.556  17.629
  411    HB2  LEU  50           HB2      LEU  50  32.963  23.306  17.471
  412    HB3  LEU  50           HB1      LEU  50  32.613  22.204  16.141
  413    HG   LEU  50           HG       LEU  50  30.576  23.602  17.896
  414   HD11  LEU  50          HD11      LEU  50  30.036  24.883  15.962
  415   HD12  LEU  50          HD12      LEU  50  30.975  23.827  14.907
  416   HD13  LEU  50          HD13      LEU  50  31.797  24.894  16.045
  417   HD21  LEU  50          HD21      LEU  50  29.591  21.512  17.392
  418   HD22  LEU  50          HD22      LEU  50  30.330  21.445  15.792
  419   HD23  LEU  50          HD23      LEU  50  29.000  22.559  16.103
  420    H    GLU  51           HN       GLU  51  33.537  19.335  17.309
  421    HA   GLU  51           HA       GLU  51  35.770  19.729  19.225
  422    HB2  GLU  51           HB2      GLU  51  35.217  17.480  17.266
  423    HB3  GLU  51           HB1      GLU  51  36.478  17.487  18.500
  424    HG2  GLU  51           HG2      GLU  51  34.722  17.740  20.249
  425    HG3  GLU  51           HG1      GLU  51  33.488  17.623  18.992
  426    H    ASP  52           HN       ASP  52  37.998  19.684  18.467
  427    HA   ASP  52           HA       ASP  52  38.455  21.386  16.190
  428    HB2  ASP  52           HB2      ASP  52  40.312  19.706  17.894
  429    HB3  ASP  52           HB1      ASP  52  40.885  20.754  16.596
  430    H    GLY  53           HN       GLY  53  39.621  20.792  14.218
  431    HA2  GLY  53           HA3      GLY  53  40.193  19.344  12.440
  432    HA3  GLY  53           HA2      GLY  53  39.974  17.979  13.537
  433    H    ARG  54           HN       ARG  54  38.895  17.228  11.343
  434    HA   ARG  54           HA       ARG  54  36.951  16.678  10.200
  435    HB2  ARG  54           HB2      ARG  54  35.845  17.359  12.933
  436    HB3  ARG  54           HB1      ARG  54  34.826  16.769  11.622
  437    HG2  ARG  54           HG2      ARG  54  36.192  14.748  11.429
  438    HG3  ARG  54           HG1      ARG  54  37.284  15.343  12.681
  439    HD2  ARG  54           HD2      ARG  54  35.473  15.305  14.323
  440    HD3  ARG  54           HD1      ARG  54  34.327  14.800  13.081
  441    HE   ARG  54           HE       ARG  54  35.205  12.605  13.228
  442   HH11  ARG  54          HH11      ARG  54  36.548  11.054  14.180
  443   HH12  ARG  54          HH12      ARG  54  37.871  11.566  15.175
  444   HH21  ARG  54          HH21      ARG  54  37.209  14.946  14.774
  445   HH22  ARG  54          HH22      ARG  54  38.245  13.770  15.512
  446    H    THR  55           HN       THR  55  34.999  17.597   9.188
  447    HA   THR  55           HA       THR  55  34.990  20.597   9.212
  448    HB   THR  55           HB       THR  55  34.531  20.548   6.859
  449    HG1  THR  55           HG1      THR  55  33.191  18.637   7.042
  450   HG21  THR  55          HG21      THR  55  36.737  18.634   7.648
  451   HG22  THR  55          HG22      THR  55  36.878  20.321   7.164
  452   HG23  THR  55          HG23      THR  55  36.458  19.094   5.973
  453    H    LEU  56           HN       LEU  56  32.769  21.400   8.307
  454    HA   LEU  56           HA       LEU  56  30.689  20.291   9.959
  455    HB2  LEU  56           HB2      LEU  56  30.608  22.267   7.658
  456    HB3  LEU  56           HB1      LEU  56  29.196  21.836   8.616
  457    HG   LEU  56           HG       LEU  56  30.600  22.497  10.680
  458   HD11  LEU  56          HD11      LEU  56  32.296  24.340  10.038
  459   HD12  LEU  56          HD12      LEU  56  32.305  23.606   8.436
  460   HD13  LEU  56          HD13      LEU  56  32.811  22.668   9.842
  461   HD21  LEU  56          HD21      LEU  56  29.607  24.456   8.606
  462   HD22  LEU  56          HD22      LEU  56  30.166  24.982  10.194
  463   HD23  LEU  56          HD23      LEU  56  28.783  23.897  10.061
  464    H    SER  57           HN       SER  57  31.259  20.206   6.415
  465    HA   SER  57           HA       SER  57  28.997  18.527   5.845
  466    HB2  SER  57           HB2      SER  57  30.217  19.752   4.075
  467    HB3  SER  57           HB1      SER  57  31.645  18.764   4.373
  468    HG   SER  57           HG       SER  57  29.087  17.794   3.598
  469    H    ASP  58           HN       ASP  58  32.440  17.790   6.336
  470    HA   ASP  58           HA       ASP  58  32.349  14.998   6.124
  471    HB2  ASP  58           HB2      ASP  58  34.448  16.243   6.439
  472    HB3  ASP  58           HB1      ASP  58  33.975  16.630   8.094
  473    H    TYR  59           HN       TYR  59  31.199  17.043   8.774
  474    HA   TYR  59           HA       TYR  59  30.909  14.817  10.627
  475    HB2  TYR  59           HB2      TYR  59  30.219  17.710  10.575
  476    HB3  TYR  59           HB1      TYR  59  29.108  16.726  11.521
  477    HD1  TYR  59           HD1      TYR  59  31.958  18.670  11.818
  478    HD2  TYR  59           HD2      TYR  59  30.474  14.795  12.937
  479    HE1  TYR  59           HE1      TYR  59  33.581  18.587  13.688
  480    HE2  TYR  59           HE2      TYR  59  32.098  14.716  14.810
  481    HH   TYR  59           HH       TYR  59  33.421  16.979  16.188
  482    H    ASN  60           HN       ASN  60  29.059  16.079   7.965
  483    HA   ASN  60           HA       ASN  60  27.149  15.201   6.940
  484    HB2  ASN  60           HB2      ASN  60  26.921  13.028   9.011
  485    HB3  ASN  60           HB1      ASN  60  26.597  12.963   7.280
  486   HD21  ASN  60          HD21      ASN  60  28.771  13.563   5.944
  487   HD22  ASN  60          HD22      ASN  60  30.155  12.732   6.469
  488    H    ILE  61           HN       ILE  61  26.510  17.322   8.236
  489    HA   ILE  61           HA       ILE  61  24.904  17.119  10.584
  490    HB   ILE  61           HB       ILE  61  24.494  19.120   8.347
  491   HG12  ILE  61          HG12      ILE  61  26.865  19.129   8.809
  492   HG13  ILE  61          HG11      ILE  61  26.166  20.516   9.641
  493   HG21  ILE  61          HG21      ILE  61  22.826  19.125  10.166
  494   HG22  ILE  61          HG22      ILE  61  23.811  20.588  10.203
  495   HG23  ILE  61          HG23      ILE  61  24.121  19.287  11.352
  496   HD11  ILE  61          HD11      ILE  61  27.569  19.540  11.268
  497   HD12  ILE  61          HD12      ILE  61  27.102  17.901  10.817
  498   HD13  ILE  61          HD13      ILE  61  25.967  18.934  11.687
  499    H    GLN  62           HN       GLN  62  22.599  16.998  10.797
  500    HA   GLN  62           HA       GLN  62  21.340  15.205   8.913
  501    HB2  GLN  62           HB2      GLN  62  20.271  16.759  11.281
  502    HB3  GLN  62           HB1      GLN  62  19.293  15.628  10.344
  503    HG2  GLN  62           HG2      GLN  62  20.765  13.792  10.897
  504    HG3  GLN  62           HG1      GLN  62  21.923  14.886  11.656
  505   HE21  GLN  62          HE21      GLN  62  20.427  12.620  12.931
  506   HE22  GLN  62          HE22      GLN  62  19.552  13.313  14.210
  507    H    LYS  63           HN       LYS  63  20.503  18.579   9.841
  508    HA   LYS  63           HA       LYS  63  18.669  18.821   7.593
  509    HB2  LYS  63           HB2      LYS  63  19.829  21.099   9.209
  510    HB3  LYS  63           HB1      LYS  63  18.282  21.045   8.366
  511    HG2  LYS  63           HG2      LYS  63  19.039  19.348  10.766
  512    HG3  LYS  63           HG1      LYS  63  17.973  20.752  10.797
  513    HD2  LYS  63           HD2      LYS  63  16.567  19.513   9.031
  514    HD3  LYS  63           HD1      LYS  63  17.501  18.080   9.466
  515    HE2  LYS  63           HE2      LYS  63  16.826  18.382  11.836
  516    HE3  LYS  63           HE1      LYS  63  15.843  19.768  11.363
  517    HZ1  LYS  63           HZ1      LYS  63  14.262  18.198  11.178
  518    HZ2  LYS  63           HZ2      LYS  63  15.372  16.931  10.957
  519    HZ3  LYS  63           HZ3      LYS  63  14.960  17.940   9.654
  520    H    GLU  64           HN       GLU  64  22.038  19.653   8.177
  521    HA   GLU  64           HA       GLU  64  23.648  20.612   6.749
  522    HB2  GLU  64           HB2      GLU  64  21.919  19.451   4.551
  523    HB3  GLU  64           HB1      GLU  64  23.660  19.736   4.513
  524    HG2  GLU  64           HG2      GLU  64  23.962  18.069   6.320
  525    HG3  GLU  64           HG1      GLU  64  22.225  17.762   6.312
  526    H    SEP  65           HN       SEP  65  20.736  21.902   7.095
  527    HA   SEP  65           HA       SEP  65  20.756  23.720   4.758
  528    HB2  SEP  65           HB1      SEP  65  18.938  23.770   7.182
  529    HB3  SEP  65           HB2      SEP  65  18.619  22.803   5.746
  530    H    TPO  66           HN       TPO  66  19.659  25.925   6.462
  531    HA   TPO  66           HA       TPO  66  22.024  27.431   6.838
  532    HB   TPO  66           HB       TPO  66  19.478  27.833   8.425
  533   HG21  TPO  66          HG21      TPO  66  21.531  29.237   8.887
  534   HG22  TPO  66          HG22      TPO  66  20.111  30.153   8.384
  535   HG23  TPO  66          HG23      TPO  66  21.407  29.836   7.232
  536    H    LEU  67           HN       LEU  67  23.642  26.842   8.209
  537    HA   LEU  67           HA       LEU  67  23.038  25.375  10.694
  538    HB2  LEU  67           HB2      LEU  67  25.734  26.395   9.773
  539    HB3  LEU  67           HB1      LEU  67  25.400  25.064  10.881
  540    HG   LEU  67           HG       LEU  67  24.696  25.128   7.931
  541   HD11  LEU  67          HD11      LEU  67  27.151  24.831   8.640
  542   HD12  LEU  67          HD12      LEU  67  26.466  23.578   7.606
  543   HD13  LEU  67          HD13      LEU  67  26.641  23.293   9.337
  544   HD21  LEU  67          HD21      LEU  67  23.033  23.799   8.977
  545   HD22  LEU  67          HD22      LEU  67  24.175  23.140  10.149
  546   HD23  LEU  67          HD23      LEU  67  24.246  22.629   8.463
  547    H    HIS  68           HN       HIS  68  22.708  26.378  12.593
  548    HA   HIS  68           HA       HIS  68  23.503  29.252  12.878
  549    HB2  HIS  68           HB2      HIS  68  21.104  28.755  13.179
  550    HB3  HIS  68           HB1      HIS  68  21.502  27.598  14.450
  551    HD1  HIS  68           HD1      HIS  68  22.016  31.302  13.682
  552    HD2  HIS  68           HD2      HIS  68  21.681  28.748  16.964
  553    HE1  HIS  68           HE1      HIS  68  22.025  32.776  15.744
  554    HE2  HIS  68           HE2      HIS  68  21.821  31.232  17.746
  555    H    LEU  69           HN       LEU  69  25.069  29.771  14.317
  556    HA   LEU  69           HA       LEU  69  25.814  27.800  16.454
  557    HB2  LEU  69           HB2      LEU  69  27.779  29.449  14.830
  558    HB3  LEU  69           HB1      LEU  69  28.170  28.244  16.052
  559    HG   LEU  69           HG       LEU  69  26.639  27.599  13.516
  560   HD11  LEU  69          HD11      LEU  69  28.952  28.456  13.057
  561   HD12  LEU  69          HD12      LEU  69  28.734  26.764  12.603
  562   HD13  LEU  69          HD13      LEU  69  29.587  27.176  14.091
  563   HD21  LEU  69          HD21      LEU  69  27.963  25.959  15.694
  564   HD22  LEU  69          HD22      LEU  69  27.534  25.275  14.127
  565   HD23  LEU  69          HD23      LEU  69  26.277  25.916  15.181
  566    H    VAL  70           HN       VAL  70  26.581  28.813  18.407
  567    HA   VAL  70           HA       VAL  70  26.435  31.803  18.474
  568    HB   VAL  70           HB       VAL  70  25.153  31.697  20.560
  569   HG11  VAL  70          HG11      VAL  70  23.885  31.830  18.474
  570   HG12  VAL  70          HG12      VAL  70  23.018  30.815  19.626
  571   HG13  VAL  70          HG13      VAL  70  23.927  30.075  18.308
  572   HG21  VAL  70          HG21      VAL  70  25.451  28.720  20.128
  573   HG22  VAL  70          HG22      VAL  70  24.123  29.367  21.093
  574   HG23  VAL  70          HG23      VAL  70  25.791  29.662  21.580
  575    H    LEU  71           HN       LEU  71  28.259  32.581  19.387
  576    HA   LEU  71           HA       LEU  71  30.121  30.746  20.709
  577    HB2  LEU  71           HB2      LEU  71  30.802  32.577  19.108
  578    HB3  LEU  71           HB1      LEU  71  30.342  33.750  20.336
  579    HG   LEU  71           HG       LEU  71  32.218  31.577  21.220
  580   HD11  LEU  71          HD11      LEU  71  34.174  32.848  20.326
  581   HD12  LEU  71          HD12      LEU  71  33.059  33.835  19.380
  582   HD13  LEU  71          HD13      LEU  71  33.196  32.106  19.060
  583   HD21  LEU  71          HD21      LEU  71  33.260  33.522  22.403
  584   HD22  LEU  71          HD22      LEU  71  31.555  33.328  22.797
  585   HD23  LEU  71          HD23      LEU  71  32.060  34.580  21.665
  586    H    ARG  72           HN       ARG  72  30.716  30.816  22.905
  587    HA   ARG  72           HA       ARG  72  29.006  32.527  24.686
  588    HB2  ARG  72           HB2      ARG  72  28.594  29.969  24.640
  589    HB3  ARG  72           HB1      ARG  72  30.154  29.833  25.448
  590    HG2  ARG  72           HG2      ARG  72  29.365  31.292  27.261
  591    HG3  ARG  72           HG1      ARG  72  27.814  31.488  26.445
  592    HD2  ARG  72           HD2      ARG  72  27.536  28.978  26.562
  593    HD3  ARG  72           HD1      ARG  72  28.972  28.933  27.586
  594    HE   ARG  72           HE       ARG  72  26.320  29.880  28.384
  595   HH11  ARG  72          HH11      ARG  72  26.140  30.507  30.548
  596   HH12  ARG  72          HH12      ARG  72  27.574  30.748  31.489
  597   HH21  ARG  72          HH21      ARG  72  29.730  29.957  28.890
  598   HH22  ARG  72          HH22      ARG  72  29.607  30.435  30.550
  599    H    LEU  73           HN       LEU  73  30.094  32.995  26.810
  600    HA   LEU  73           HA       LEU  73  32.982  33.545  26.354
  601    HB2  LEU  73           HB2      LEU  73  31.283  34.457  28.686
  602    HB3  LEU  73           HB1      LEU  73  32.796  35.155  28.108
  603    HG   LEU  73           HG       LEU  73  30.172  35.129  26.585
  604   HD11  LEU  73          HD11      LEU  73  31.692  37.430  27.848
  605   HD12  LEU  73          HD12      LEU  73  30.259  36.676  28.548
  606   HD13  LEU  73          HD13      LEU  73  30.145  37.530  27.008
  607   HD21  LEU  73          HD21      LEU  73  31.906  35.082  24.963
  608   HD22  LEU  73          HD22      LEU  73  32.955  36.118  25.931
  609   HD23  LEU  73          HD23      LEU  73  31.529  36.795  25.143
  610    H    ARG  74           HN       ARG  74  34.438  33.226  28.267
  611    HA   ARG  74           HA       ARG  74  33.827  30.620  29.620
  612    HB2  ARG  74           HB2      ARG  74  35.892  30.873  28.145
  613    HB3  ARG  74           HB1      ARG  74  36.527  31.967  29.368
  614    HG2  ARG  74           HG2      ARG  74  35.605  29.135  29.953
  615    HG3  ARG  74           HG1      ARG  74  37.278  29.562  29.612
  616    HD2  ARG  74           HD2      ARG  74  36.840  31.347  31.570
  617    HD3  ARG  74           HD1      ARG  74  35.635  30.150  32.043
  618    HE   ARG  74           HE       ARG  74  37.890  28.628  31.629
  619   HH11  ARG  74          HH11      ARG  74  39.429  28.228  33.236
  620   HH12  ARG  74          HH12      ARG  74  39.610  29.351  34.542
  621   HH21  ARG  74          HH21      ARG  74  37.139  31.494  33.392
  622   HH22  ARG  74          HH22      ARG  74  38.313  31.200  34.631
  623    H    GLY  75           HN       GLY  75  33.234  30.804  31.718
  624    HA2  GLY  75           HA3      GLY  75  33.430  31.471  33.987
  625    HA3  GLY  75           HA2      GLY  75  34.668  32.634  33.510
  626    H    GLY  76           HN       GLY  76  33.189  33.894  35.131
  627    HA2  GLY  76           HA3      GLY  76  31.924  36.011  33.847
  628    HA3  GLY  76           HA2      GLY  76  30.636  34.839  34.127
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1  28.520  27.735   2.661
    2    H2   MET   1           HT2      MET   1  28.366  29.078   1.632
    3    H3   MET   1           HT3      MET   1  27.582  27.619   1.251
    4    HA   MET   1           HA       MET   1  25.949  29.109   2.104
    5    HB2  MET   1           HB2      MET   1  26.727  27.186   4.315
    6    HB3  MET   1           HB1      MET   1  25.109  27.783   3.938
    7    HG2  MET   1           HG2      MET   1  26.813  26.071   2.102
    8    HG3  MET   1           HG1      MET   1  25.448  25.494   3.059
    9    HE1  MET   1           HE1      MET   1  25.704  25.410  -0.412
   10    HE2  MET   1           HE2      MET   1  23.948  25.261  -0.382
   11    HE3  MET   1           HE3      MET   1  24.911  24.496   0.879
   12    H    GLN   2           HN       GLN   2  25.416  30.795   3.505
   13    HA   GLN   2           HA       GLN   2  27.656  32.052   4.913
   14    HB2  GLN   2           HB2      GLN   2  24.746  32.819   4.563
   15    HB3  GLN   2           HB1      GLN   2  25.904  33.795   5.468
   16    HG2  GLN   2           HG2      GLN   2  27.285  34.096   3.508
   17    HG3  GLN   2           HG1      GLN   2  26.314  32.947   2.588
   18   HE21  GLN   2          HE21      GLN   2  26.772  35.857   2.006
   19   HE22  GLN   2          HE22      GLN   2  25.228  36.561   1.970
   20    H    ILE   3           HN       ILE   3  28.193  31.113   6.842
   21    HA   ILE   3           HA       ILE   3  26.114  29.965   8.586
   22    HB   ILE   3           HB       ILE   3  28.166  29.610  10.119
   23   HG12  ILE   3          HG12      ILE   3  29.638  30.281   7.555
   24   HG13  ILE   3          HG11      ILE   3  29.499  31.409   8.904
   25   HG21  ILE   3          HG21      ILE   3  27.932  28.411   7.349
   26   HG22  ILE   3          HG22      ILE   3  27.303  27.761   8.862
   27   HG23  ILE   3          HG23      ILE   3  29.043  27.787   8.568
   28   HD11  ILE   3          HD11      ILE   3  31.610  29.953   8.852
   29   HD12  ILE   3          HD12      ILE   3  30.557  28.603   9.273
   30   HD13  ILE   3          HD13      ILE   3  30.709  29.977  10.367
   31    H    PHE   4           HN       PHE   4  25.198  31.005  10.297
   32    HA   PHE   4           HA       PHE   4  25.969  33.820  10.792
   33    HB2  PHE   4           HB2      PHE   4  23.672  32.118  11.800
   34    HB3  PHE   4           HB1      PHE   4  23.914  33.812  12.234
   35    HD1  PHE   4           HD1      PHE   4  22.996  31.475   9.549
   36    HD2  PHE   4           HD2      PHE   4  23.673  35.595  10.563
   37    HE1  PHE   4           HE1      PHE   4  21.888  32.177   7.443
   38    HE2  PHE   4           HE2      PHE   4  22.564  36.295   8.459
   39    HZ   PHE   4           HZ       PHE   4  21.672  34.586   6.898
   40    H    VAL   5           HN       VAL   5  26.472  34.590  12.932
   41    HA   VAL   5           HA       VAL   5  27.127  32.532  14.984
   42    HB   VAL   5           HB       VAL   5  29.069  34.650  13.996
   43   HG11  VAL   5          HG11      VAL   5  29.234  32.573  16.198
   44   HG12  VAL   5          HG12      VAL   5  29.313  34.325  16.382
   45   HG13  VAL   5          HG13      VAL   5  30.628  33.462  15.583
   46   HG21  VAL   5          HG21      VAL   5  30.434  32.557  13.452
   47   HG22  VAL   5          HG22      VAL   5  29.041  32.854  12.412
   48   HG23  VAL   5          HG23      VAL   5  28.947  31.640  13.689
   49    H    LYS   6           HN       LYS   6  25.768  33.264  16.583
   50    HA   LYS   6           HA       LYS   6  25.587  36.202  17.092
   51    HB2  LYS   6           HB2      LYS   6  23.513  34.704  16.833
   52    HB3  LYS   6           HB1      LYS   6  23.950  34.015  18.393
   53    HG2  LYS   6           HG2      LYS   6  22.524  35.725  19.082
   54    HG3  LYS   6           HG1      LYS   6  24.074  36.556  19.146
   55    HD2  LYS   6           HD2      LYS   6  22.802  38.094  17.936
   56    HD3  LYS   6           HD1      LYS   6  23.522  37.164  16.625
   57    HE2  LYS   6           HE2      LYS   6  21.495  35.795  16.444
   58    HE3  LYS   6           HE1      LYS   6  20.781  36.641  17.817
   59    HZ1  LYS   6           HZ1      LYS   6  20.899  38.701  16.559
   60    HZ2  LYS   6           HZ2      LYS   6  19.983  37.538  15.727
   61    HZ3  LYS   6           HZ3      LYS   6  21.574  37.880  15.238
   62    H    THR   7           HN       THR   7  26.691  37.048  18.788
   63    HA   THR   7           HA       THR   7  28.022  35.201  20.696
   64    HB   THR   7           HB       THR   7  29.360  37.115  21.330
   65    HG1  THR   7           HG1      THR   7  27.230  38.445  20.193
   66   HG21  THR   7          HG21      THR   7  30.275  37.785  19.109
   67   HG22  THR   7          HG22      THR   7  28.879  37.029  18.339
   68   HG23  THR   7          HG23      THR   7  30.027  36.044  19.247
   69    H    LEU   8           HN       LEU   8  28.087  36.139  23.045
   70    HA   LEU   8           HA       LEU   8  25.418  36.127  24.069
   71    HB2  LEU   8           HB2      LEU   8  27.388  35.402  25.388
   72    HB3  LEU   8           HB1      LEU   8  27.975  37.064  25.411
   73    HG   LEU   8           HG       LEU   8  25.927  37.767  26.614
   74   HD11  LEU   8          HD11      LEU   8  25.222  34.867  26.207
   75   HD12  LEU   8          HD12      LEU   8  24.204  36.298  26.031
   76   HD13  LEU   8          HD13      LEU   8  24.621  35.709  27.636
   77   HD21  LEU   8          HD21      LEU   8  27.809  37.227  27.993
   78   HD22  LEU   8          HD22      LEU   8  27.552  35.496  27.783
   79   HD23  LEU   8          HD23      LEU   8  26.418  36.447  28.743
   80    H    THR   9           HN       THR   9  27.666  38.739  23.281
   81    HA   THR   9           HA       THR   9  25.958  40.809  24.434
   82    HB   THR   9           HB       THR   9  27.539  42.373  23.361
   83    HG1  THR   9           HG1      THR   9  27.867  41.142  21.464
   84   HG21  THR   9          HG21      THR   9  28.187  41.404  25.501
   85   HG22  THR   9          HG22      THR   9  29.613  41.550  24.472
   86   HG23  THR   9          HG23      THR   9  28.838  39.981  24.690
   87    H    GLY  10           HN       GLY  10  25.624  38.893  21.754
   88    HA2  GLY  10           HA3      GLY  10  23.836  39.084  20.168
   89    HA3  GLY  10           HA2      GLY  10  23.726  40.808  20.525
   90    H    LYS  11           HN       LYS  11  26.886  40.564  20.249
   91    HA   LYS  11           HA       LYS  11  27.176  41.848  17.783
   92    HB2  LYS  11           HB2      LYS  11  28.985  41.450  19.535
   93    HB3  LYS  11           HB1      LYS  11  29.195  39.848  18.827
   94    HG2  LYS  11           HG2      LYS  11  29.706  40.843  16.651
   95    HG3  LYS  11           HG1      LYS  11  29.422  42.459  17.302
   96    HD2  LYS  11           HD2      LYS  11  31.259  42.071  18.950
   97    HD3  LYS  11           HD1      LYS  11  31.588  40.523  18.170
   98    HE2  LYS  11           HE2      LYS  11  31.670  43.216  16.776
   99    HE3  LYS  11           HE1      LYS  11  33.086  42.324  17.333
  100    HZ1  LYS  11           HZ1      LYS  11  31.634  41.998  14.947
  101    HZ2  LYS  11           HZ2      LYS  11  31.527  40.563  15.850
  102    HZ3  LYS  11           HZ3      LYS  11  33.047  41.203  15.442
  103    H    THR  12           HN       THR  12  26.347  41.124  15.877
  104    HA   THR  12           HA       THR  12  26.291  38.216  15.302
  105    HB   THR  12           HB       THR  12  25.191  40.577  13.747
  106    HG1  THR  12           HG1      THR  12  23.521  40.357  14.981
  107   HG21  THR  12          HG21      THR  12  25.023  37.585  13.364
  108   HG22  THR  12          HG22      THR  12  25.542  38.804  12.200
  109   HG23  THR  12          HG23      THR  12  23.842  38.689  12.658
  110    H    ILE  13           HN       ILE  13  27.479  37.261  13.665
  111    HA   ILE  13           HA       ILE  13  29.193  38.967  11.931
  112    HB   ILE  13           HB       ILE  13  30.281  36.600  13.487
  113   HG12  ILE  13          HG12      ILE  13  30.623  39.575  13.994
  114   HG13  ILE  13          HG11      ILE  13  29.763  38.441  15.037
  115   HG21  ILE  13          HG21      ILE  13  31.312  37.224  11.260
  116   HG22  ILE  13          HG22      ILE  13  32.419  37.311  12.629
  117   HG23  ILE  13          HG23      ILE  13  31.721  38.788  11.964
  118   HD11  ILE  13          HD11      ILE  13  32.723  38.485  14.408
  119   HD12  ILE  13          HD12      ILE  13  31.929  37.122  15.196
  120   HD13  ILE  13          HD13      ILE  13  31.952  38.701  15.979
  121    H    THR  14           HN       THR  14  29.374  38.078   9.873
  122    HA   THR  14           HA       THR  14  28.207  35.337   9.465
  123    HB   THR  14           HB       THR  14  26.802  37.176   8.551
  124    HG1  THR  14           HG1      THR  14  27.911  35.128   7.169
  125   HG21  THR  14          HG21      THR  14  27.615  38.647   6.858
  126   HG22  THR  14          HG22      THR  14  29.107  37.726   6.676
  127   HG23  THR  14          HG23      THR  14  28.831  38.674   8.136
  128    H    LEU  15           HN       LEU  15  29.450  33.906   8.345
  129    HA   LEU  15           HA       LEU  15  31.963  34.910   7.035
  130    HB2  LEU  15           HB2      LEU  15  31.635  32.271   8.493
  131    HB3  LEU  15           HB1      LEU  15  33.126  32.951   7.847
  132    HG   LEU  15           HG       LEU  15  31.473  34.259  10.031
  133   HD11  LEU  15          HD11      LEU  15  33.863  32.413  10.146
  134   HD12  LEU  15          HD12      LEU  15  32.324  32.256  10.991
  135   HD13  LEU  15          HD13      LEU  15  33.465  33.514  11.464
  136   HD21  LEU  15          HD21      LEU  15  34.152  34.837   8.749
  137   HD22  LEU  15          HD22      LEU  15  33.750  35.445  10.354
  138   HD23  LEU  15          HD23      LEU  15  32.784  35.928   8.964
  139    H    GLU  16           HN       GLU  16  31.771  34.544   4.882
  140    HA   GLU  16           HA       GLU  16  29.959  32.413   3.906
  141    HB2  GLU  16           HB2      GLU  16  29.930  34.682   2.869
  142    HB3  GLU  16           HB1      GLU  16  31.599  34.439   2.352
  143    HG2  GLU  16           HG2      GLU  16  30.935  32.495   1.018
  144    HG3  GLU  16           HG1      GLU  16  29.271  32.656   1.580
  145    H    VAL  17           HN       VAL  17  30.824  30.407   3.737
  146    HA   VAL  17           HA       VAL  17  33.265  30.008   2.189
  147    HB   VAL  17           HB       VAL  17  34.284  30.455   4.351
  148   HG11  VAL  17          HG11      VAL  17  32.516  28.232   5.415
  149   HG12  VAL  17          HG12      VAL  17  32.247  29.951   5.706
  150   HG13  VAL  17          HG13      VAL  17  33.694  29.166   6.339
  151   HG21  VAL  17          HG21      VAL  17  34.223  27.453   3.968
  152   HG22  VAL  17          HG22      VAL  17  35.549  28.431   4.596
  153   HG23  VAL  17          HG23      VAL  17  35.103  28.538   2.893
  154    H    GLU  18           HN       GLU  18  33.501  27.784   1.561
  155    HA   GLU  18           HA       GLU  18  31.216  26.348   0.992
  156    HB2  GLU  18           HB2      GLU  18  34.031  25.395   1.533
  157    HB3  GLU  18           HB1      GLU  18  32.768  24.280   1.016
  158    HG2  GLU  18           HG2      GLU  18  33.444  26.820  -0.487
  159    HG3  GLU  18           HG1      GLU  18  34.168  25.257  -0.864
  160    HA   PRO  19           HA       PRO  19  29.777  24.720   4.872
  161    HB2  PRO  19           HB2      PRO  19  28.428  22.483   4.068
  162    HB3  PRO  19           HB1      PRO  19  27.842  24.127   3.733
  163    HG2  PRO  19           HG2      PRO  19  29.336  22.256   1.940
  164    HG3  PRO  19           HG1      PRO  19  27.927  23.272   1.578
  165    HD2  PRO  19           HD2      PRO  19  30.461  24.009   0.887
  166    HD3  PRO  19           HD1      PRO  19  29.210  25.197   1.317
  167    H    SER  20           HN       SER  20  32.046  22.992   2.973
  168    HA   SER  20           HA       SER  20  32.331  20.791   4.946
  169    HB2  SER  20           HB2      SER  20  34.224  20.131   3.327
  170    HB3  SER  20           HB1      SER  20  32.574  20.027   2.720
  171    HG   SER  20           HG       SER  20  32.916  21.725   1.462
  172    H    ASP  21           HN       ASP  21  33.138  23.869   5.114
  173    HA   ASP  21           HA       ASP  21  35.926  24.079   5.413
  174    HB2  ASP  21           HB2      ASP  21  34.071  25.888   5.704
  175    HB3  ASP  21           HB1      ASP  21  34.033  25.368   7.386
  176    H    THR  22           HN       THR  22  37.127  24.166   7.593
  177    HA   THR  22           HA       THR  22  36.449  21.710   9.127
  178    HB   THR  22           HB       THR  22  38.720  21.774   9.919
  179    HG1  THR  22           HG1      THR  22  39.332  24.102   8.544
  180   HG21  THR  22          HG21      THR  22  39.928  21.582   7.867
  181   HG22  THR  22          HG22      THR  22  38.845  22.708   7.047
  182   HG23  THR  22          HG23      THR  22  38.269  21.104   7.503
  183    H    ILE  23           HN       ILE  23  37.067  21.974  11.614
  184    HA   ILE  23           HA       ILE  23  35.359  24.103  12.645
  185    HB   ILE  23           HB       ILE  23  37.099  22.038  14.012
  186   HG12  ILE  23          HG12      ILE  23  34.094  22.154  13.717
  187   HG13  ILE  23          HG11      ILE  23  35.125  21.279  12.591
  188   HG21  ILE  23          HG21      ILE  23  36.768  23.877  15.536
  189   HG22  ILE  23          HG22      ILE  23  35.630  22.610  15.994
  190   HG23  ILE  23          HG23      ILE  23  35.067  24.014  15.086
  191   HD11  ILE  23          HD11      ILE  23  36.043  19.966  14.458
  192   HD12  ILE  23          HD12      ILE  23  34.300  19.769  14.314
  193   HD13  ILE  23          HD13      ILE  23  34.967  20.808  15.570
  194    H    GLU  24           HN       GLU  24  38.803  23.223  12.947
  195    HA   GLU  24           HA       GLU  24  39.672  25.437  14.458
  196    HB2  GLU  24           HB2      GLU  24  41.885  25.016  13.121
  197    HB3  GLU  24           HB1      GLU  24  41.273  23.741  14.174
  198    HG2  GLU  24           HG2      GLU  24  40.357  22.528  12.340
  199    HG3  GLU  24           HG1      GLU  24  40.543  23.899  11.246
  200    H    ASN  25           HN       ASN  25  38.723  25.237  11.114
  201    HA   ASN  25           HA       ASN  25  40.049  27.672  10.261
  202    HB2  ASN  25           HB2      ASN  25  39.265  25.943   8.649
  203    HB3  ASN  25           HB1      ASN  25  37.598  26.305   9.098
  204   HD21  ASN  25          HD21      ASN  25  36.794  28.529   8.582
  205   HD22  ASN  25          HD22      ASN  25  37.526  29.416   7.335
  206    H    VAL  26           HN       VAL  26  36.744  26.853  11.332
  207    HA   VAL  26           HA       VAL  26  35.664  29.486  11.145
  208    HB   VAL  26           HB       VAL  26  35.018  27.354  13.209
  209   HG11  VAL  26          HG11      VAL  26  33.419  29.683  12.106
  210   HG12  VAL  26          HG12      VAL  26  34.073  29.553  13.739
  211   HG13  VAL  26          HG13      VAL  26  32.794  28.458  13.211
  212   HG21  VAL  26          HG21      VAL  26  33.354  26.555  11.631
  213   HG22  VAL  26          HG22      VAL  26  34.925  26.565  10.831
  214   HG23  VAL  26          HG23      VAL  26  33.757  27.843  10.495
  215    H    LYS  27           HN       LYS  27  36.742  27.817  14.108
  216    HA   LYS  27           HA       LYS  27  36.834  29.861  15.929
  217    HB2  LYS  27           HB2      LYS  27  38.940  27.731  15.454
  218    HB3  LYS  27           HB1      LYS  27  38.842  28.717  16.913
  219    HG2  LYS  27           HG2      LYS  27  36.514  27.890  17.265
  220    HG3  LYS  27           HG1      LYS  27  36.711  26.833  15.869
  221    HD2  LYS  27           HD2      LYS  27  38.586  25.691  16.958
  222    HD3  LYS  27           HD1      LYS  27  38.469  26.781  18.340
  223    HE2  LYS  27           HE2      LYS  27  36.135  25.084  17.443
  224    HE3  LYS  27           HE1      LYS  27  37.337  24.489  18.588
  225    HZ1  LYS  27           HZ1      LYS  27  36.768  26.092  20.144
  226    HZ2  LYS  27           HZ2      LYS  27  35.263  25.632  19.503
  227    HZ3  LYS  27           HZ3      LYS  27  35.994  27.082  19.005
  228    H    ALA  28           HN       ALA  28  39.074  29.380  13.257
  229    HA   ALA  28           HA       ALA  28  41.023  31.335  14.061
  230    HB1  ALA  28           HB1      ALA  28  40.335  30.703  11.188
  231    HB2  ALA  28           HB2      ALA  28  41.195  29.547  12.203
  232    HB3  ALA  28           HB3      ALA  28  41.906  31.126  11.869
  233    H    LYS  29           HN       LYS  29  38.454  31.608  11.585
  234    HA   LYS  29           HA       LYS  29  38.659  34.354  11.090
  235    HB2  LYS  29           HB2      LYS  29  36.273  32.512  11.112
  236    HB3  LYS  29           HB1      LYS  29  36.119  34.207  10.654
  237    HG2  LYS  29           HG2      LYS  29  37.476  33.962   8.754
  238    HG3  LYS  29           HG1      LYS  29  38.254  32.505   9.370
  239    HD2  LYS  29           HD2      LYS  29  36.096  31.295   9.135
  240    HD3  LYS  29           HD1      LYS  29  35.391  32.738   8.407
  241    HE2  LYS  29           HE2      LYS  29  37.861  31.358   7.326
  242    HE3  LYS  29           HE1      LYS  29  36.231  31.038   6.735
  243    HZ1  LYS  29           HZ1      LYS  29  37.229  32.684   5.351
  244    HZ2  LYS  29           HZ2      LYS  29  37.667  33.635   6.689
  245    HZ3  LYS  29           HZ3      LYS  29  36.029  33.445   6.278
  246    H    ILE  30           HN       ILE  30  37.282  32.736  13.849
  247    HA   ILE  30           HA       ILE  30  36.026  35.166  14.919
  248    HB   ILE  30           HB       ILE  30  36.451  32.346  15.913
  249   HG12  ILE  30          HG12      ILE  30  34.035  32.338  16.032
  250   HG13  ILE  30          HG11      ILE  30  33.964  34.082  15.791
  251   HG21  ILE  30          HG21      ILE  30  35.234  33.135  18.038
  252   HG22  ILE  30          HG22      ILE  30  35.699  34.769  17.568
  253   HG23  ILE  30          HG23      ILE  30  36.940  33.566  17.914
  254   HD11  ILE  30          HD11      ILE  30  35.233  32.273  13.736
  255   HD12  ILE  30          HD12      ILE  30  34.620  33.912  13.525
  256   HD13  ILE  30          HD13      ILE  30  33.496  32.571  13.743
  257    H    GLN  31           HN       GLN  31  38.635  33.098  16.171
  258    HA   GLN  31           HA       GLN  31  39.752  34.644  18.112
  259    HB2  GLN  31           HB2      GLN  31  40.658  32.474  17.473
  260    HB3  GLN  31           HB1      GLN  31  41.245  33.137  15.952
  261    HG2  GLN  31           HG2      GLN  31  42.808  34.545  17.063
  262    HG3  GLN  31           HG1      GLN  31  42.101  34.215  18.642
  263   HE21  GLN  31          HE21      GLN  31  44.799  33.695  18.448
  264   HE22  GLN  31          HE22      GLN  31  45.089  32.025  18.360
  265    H    ASP  32           HN       ASP  32  40.553  35.025  14.647
  266    HA   ASP  32           HA       ASP  32  42.261  37.316  15.119
  267    HB2  ASP  32           HB2      ASP  32  40.899  36.492  12.541
  268    HB3  ASP  32           HB1      ASP  32  42.300  37.552  12.695
  269    H    LYS  33           HN       LYS  33  39.022  37.113  13.621
  270    HA   LYS  33           HA       LYS  33  38.619  39.889  13.367
  271    HB2  LYS  33           HB2      LYS  33  36.534  37.784  13.892
  272    HB3  LYS  33           HB1      LYS  33  36.220  39.382  13.239
  273    HG2  LYS  33           HG2      LYS  33  38.197  37.558  11.871
  274    HG3  LYS  33           HG1      LYS  33  36.471  37.341  11.592
  275    HD2  LYS  33           HD2      LYS  33  37.680  40.080  11.317
  276    HD3  LYS  33           HD1      LYS  33  37.861  38.921  10.009
  277    HE2  LYS  33           HE2      LYS  33  35.137  39.431  11.193
  278    HE3  LYS  33           HE1      LYS  33  35.800  40.526   9.984
  279    HZ1  LYS  33           HZ1      LYS  33  35.294  37.620   9.711
  280    HZ2  LYS  33           HZ2      LYS  33  36.219  38.507   8.594
  281    HZ3  LYS  33           HZ3      LYS  33  34.580  38.885   8.836
  282    H    GLU  34           HN       GLU  34  37.779  37.799  16.135
  283    HA   GLU  34           HA       GLU  34  36.841  40.165  17.640
  284    HB2  GLU  34           HB2      GLU  34  37.164  37.350  18.702
  285    HB3  GLU  34           HB1      GLU  34  36.114  38.629  19.307
  286    HG2  GLU  34           HG2      GLU  34  34.934  38.566  17.053
  287    HG3  GLU  34           HG1      GLU  34  35.832  37.083  16.726
  288    H    GLY  35           HN       GLY  35  39.708  38.267  17.252
  289    HA2  GLY  35           HA3      GLY  35  41.853  38.599  18.156
  290    HA3  GLY  35           HA2      GLY  35  41.249  40.079  18.900
  291    H    ILE  36           HN       ILE  36  39.347  37.365  19.588
  292    HA   ILE  36           HA       ILE  36  40.305  37.335  22.373
  293    HB   ILE  36           HB       ILE  36  37.895  36.027  21.108
  294   HG12  ILE  36          HG12      ILE  36  38.198  38.682  22.548
  295   HG13  ILE  36          HG11      ILE  36  37.894  38.482  20.823
  296   HG21  ILE  36          HG21      ILE  36  38.499  36.742  23.986
  297   HG22  ILE  36          HG22      ILE  36  38.668  35.121  23.312
  298   HG23  ILE  36          HG23      ILE  36  37.083  35.882  23.392
  299   HD11  ILE  36          HD11      ILE  36  36.085  37.651  23.091
  300   HD12  ILE  36          HD12      ILE  36  35.809  37.226  21.403
  301   HD13  ILE  36          HD13      ILE  36  35.783  38.916  21.903
  302    HA   PRO  37           HA       PRO  37  42.372  33.439  21.428
  303    HB2  PRO  37           HB2      PRO  37  42.942  32.575  23.956
  304    HB3  PRO  37           HB1      PRO  37  43.815  33.912  23.177
  305    HG2  PRO  37           HG2      PRO  37  41.580  34.019  25.158
  306    HG3  PRO  37           HG1      PRO  37  43.069  34.981  25.091
  307    HD2  PRO  37           HD2      PRO  37  40.670  35.932  24.198
  308    HD3  PRO  37           HD1      PRO  37  42.216  36.432  23.483
  309    HA   PRO  38           HA       PRO  38  38.697  30.737  21.373
  310    HB2  PRO  38           HB2      PRO  38  40.964  28.789  21.173
  311    HB3  PRO  38           HB1      PRO  38  39.396  28.767  20.336
  312    HG2  PRO  38           HG2      PRO  38  41.496  29.680  19.088
  313    HG3  PRO  38           HG1      PRO  38  39.967  30.552  18.957
  314    HD2  PRO  38           HD2      PRO  38  42.431  31.294  20.489
  315    HD3  PRO  38           HD1      PRO  38  41.206  32.347  19.742
  316    H    ASP  39           HN       ASP  39  41.471  30.233  23.494
  317    HA   ASP  39           HA       ASP  39  40.457  28.196  25.157
  318    HB2  ASP  39           HB2      ASP  39  42.765  29.121  25.308
  319    HB3  ASP  39           HB1      ASP  39  42.101  30.589  26.028
  320    H    GLN  40           HN       GLN  40  39.894  31.685  25.284
  321    HA   GLN  40           HA       GLN  40  38.111  31.412  27.607
  322    HB2  GLN  40           HB2      GLN  40  38.828  33.802  25.883
  323    HB3  GLN  40           HB1      GLN  40  37.884  33.864  27.370
  324    HG2  GLN  40           HG2      GLN  40  39.825  32.807  28.569
  325    HG3  GLN  40           HG1      GLN  40  40.764  32.976  27.088
  326   HE21  GLN  40          HE21      GLN  40  42.138  34.745  27.361
  327   HE22  GLN  40          HE22      GLN  40  41.674  36.243  28.010
  328    H    GLN  41           HN       GLN  41  37.684  30.625  24.479
  329    HA   GLN  41           HA       GLN  41  34.788  31.396  24.536
  330    HB2  GLN  41           HB2      GLN  41  36.674  31.610  22.173
  331    HB3  GLN  41           HB1      GLN  41  34.922  31.776  22.071
  332    HG2  GLN  41           HG2      GLN  41  35.132  33.609  23.841
  333    HG3  GLN  41           HG1      GLN  41  36.871  33.557  23.541
  334   HE21  GLN  41          HE21      GLN  41  37.179  33.390  20.861
  335   HE22  GLN  41          HE22      GLN  41  36.376  34.643  20.046
  336    H    ARG  42           HN       ARG  42  33.418  29.784  23.913
  337    HA   ARG  42           HA       ARG  42  34.561  27.335  22.624
  338    HB2  ARG  42           HB2      ARG  42  32.835  27.542  25.106
  339    HB3  ARG  42           HB1      ARG  42  32.841  26.082  24.119
  340    HG2  ARG  42           HG2      ARG  42  35.467  27.255  25.025
  341    HG3  ARG  42           HG1      ARG  42  34.511  26.305  26.160
  342    HD2  ARG  42           HD2      ARG  42  34.457  24.438  24.505
  343    HD3  ARG  42           HD1      ARG  42  35.506  25.379  23.447
  344    HE   ARG  42           HE       ARG  42  36.817  25.263  25.928
  345   HH11  ARG  42          HH11      ARG  42  38.394  23.689  26.314
  346   HH12  ARG  42          HH12      ARG  42  38.387  22.230  25.382
  347   HH21  ARG  42          HH21      ARG  42  35.613  23.125  23.506
  348   HH22  ARG  42          HH22      ARG  42  36.813  21.912  23.791
  349    H    LEU  43           HN       LEU  43  33.259  26.573  20.984
  350    HA   LEU  43           HA       LEU  43  30.936  28.250  20.306
  351    HB2  LEU  43           HB2      LEU  43  32.459  26.067  18.874
  352    HB3  LEU  43           HB1      LEU  43  30.945  26.734  18.230
  353    HG   LEU  43           HG       LEU  43  31.922  28.989  18.244
  354   HD11  LEU  43          HD11      LEU  43  34.244  27.529  19.505
  355   HD12  LEU  43          HD12      LEU  43  33.465  29.023  20.026
  356   HD13  LEU  43          HD13      LEU  43  34.507  29.023  18.605
  357   HD21  LEU  43          HD21      LEU  43  33.424  28.666  16.396
  358   HD22  LEU  43          HD22      LEU  43  32.220  27.379  16.315
  359   HD23  LEU  43          HD23      LEU  43  33.833  27.041  16.945
  360    H    ILE  44           HN       ILE  44  28.842  27.586  20.354
  361    HA   ILE  44           HA       ILE  44  28.248  24.800  21.315
  362    HB   ILE  44           HB       ILE  44  27.056  27.491  22.020
  363   HG12  ILE  44          HG12      ILE  44  27.168  26.654  24.272
  364   HG13  ILE  44          HG11      ILE  44  27.432  25.004  23.715
  365   HG21  ILE  44          HG21      ILE  44  25.087  26.132  23.015
  366   HG22  ILE  44          HG22      ILE  44  25.596  24.826  21.943
  367   HG23  ILE  44          HG23      ILE  44  25.064  26.366  21.265
  368   HD11  ILE  44          HD11      ILE  44  29.472  26.402  24.550
  369   HD12  ILE  44          HD12      ILE  44  29.381  27.171  22.967
  370   HD13  ILE  44          HD13      ILE  44  29.640  25.429  23.092
  371    H    PHE  45           HN       PHE  45  26.895  23.644  19.930
  372    HA   PHE  45           HA       PHE  45  25.282  25.130  17.939
  373    HB2  PHE  45           HB2      PHE  45  27.323  24.823  16.728
  374    HB3  PHE  45           HB1      PHE  45  27.511  23.175  17.321
  375    HD1  PHE  45           HD1      PHE  45  25.531  25.367  15.077
  376    HD2  PHE  45           HD2      PHE  45  26.374  21.339  16.295
  377    HE1  PHE  45           HE1      PHE  45  24.282  24.514  13.110
  378    HE2  PHE  45           HE2      PHE  45  25.125  20.482  14.329
  379    HZ   PHE  45           HZ       PHE  45  24.082  22.070  12.737
  380    H    ALA  46           HN       ALA  46  23.342  24.312  18.633
  381    HA   ALA  46           HA       ALA  46  21.603  22.773  18.830
  382    HB1  ALA  46           HB1      ALA  46  22.785  21.965  16.649
  383    HB2  ALA  46           HB2      ALA  46  21.632  20.891  17.442
  384    HB3  ALA  46           HB3      ALA  46  23.362  20.635  17.650
  385    H    GLY  47           HN       GLY  47  23.638  22.995  21.032
  386    HA2  GLY  47           HA3      GLY  47  23.598  21.945  23.167
  387    HA3  GLY  47           HA2      GLY  47  22.805  20.546  22.446
  388    H    LYS  48           HN       LYS  48  25.351  21.307  20.480
  389    HA   LYS  48           HA       LYS  48  27.275  19.545  21.967
  390    HB2  LYS  48           HB2      LYS  48  26.656  19.525  19.021
  391    HB3  LYS  48           HB1      LYS  48  27.911  18.566  19.795
  392    HG2  LYS  48           HG2      LYS  48  26.191  17.464  21.192
  393    HG3  LYS  48           HG1      LYS  48  24.938  18.403  20.378
  394    HD2  LYS  48           HD2      LYS  48  25.566  17.396  18.221
  395    HD3  LYS  48           HD1      LYS  48  26.838  16.469  19.018
  396    HE2  LYS  48           HE2      LYS  48  24.856  15.062  18.728
  397    HE3  LYS  48           HE1      LYS  48  25.113  15.379  20.444
  398    HZ1  LYS  48           HZ1      LYS  48  23.245  16.580  20.588
  399    HZ2  LYS  48           HZ2      LYS  48  22.794  15.774  19.161
  400    HZ3  LYS  48           HZ3      LYS  48  23.472  17.331  19.084
  401    H    GLN  49           HN       GLN  49  29.526  20.045  21.565
  402    HA   GLN  49           HA       GLN  49  29.953  22.798  20.561
  403    HB2  GLN  49           HB2      GLN  49  31.877  21.112  22.114
  404    HB3  GLN  49           HB1      GLN  49  31.929  22.853  21.880
  405    HG2  GLN  49           HG2      GLN  49  29.818  23.074  23.154
  406    HG3  GLN  49           HG1      GLN  49  29.802  21.329  23.416
  407   HE21  GLN  49          HE21      GLN  49  30.621  24.151  24.957
  408   HE22  GLN  49          HE22      GLN  49  31.847  23.572  25.979
  409    H    LEU  50           HN       LEU  50  32.166  23.058  19.381
  410    HA   LEU  50           HA       LEU  50  32.420  20.815  17.429
  411    HB2  LEU  50           HB2      LEU  50  33.674  23.556  17.202
  412    HB3  LEU  50           HB1      LEU  50  33.299  22.411  15.913
  413    HG   LEU  50           HG       LEU  50  31.289  23.921  17.609
  414   HD11  LEU  50          HD11      LEU  50  30.795  25.159  15.635
  415   HD12  LEU  50          HD12      LEU  50  31.718  24.052  14.618
  416   HD13  LEU  50          HD13      LEU  50  32.555  25.132  15.732
  417   HD21  LEU  50          HD21      LEU  50  30.315  21.797  17.141
  418   HD22  LEU  50          HD22      LEU  50  30.997  21.754  15.516
  419   HD23  LEU  50          HD23      LEU  50  29.683  22.870  15.892
  420    H    GLU  51           HN       GLU  51  34.001  19.390  18.006
  421    HA   GLU  51           HA       GLU  51  36.337  20.336  19.575
  422    HB2  GLU  51           HB2      GLU  51  35.541  17.542  18.701
  423    HB3  GLU  51           HB1      GLU  51  36.850  17.942  19.815
  424    HG2  GLU  51           HG2      GLU  51  35.190  19.024  21.327
  425    HG3  GLU  51           HG1      GLU  51  33.900  18.510  20.237
  426    H    ASP  52           HN       ASP  52  38.400  20.432  18.740
  427    HA   ASP  52           HA       ASP  52  38.817  20.699  15.953
  428    HB2  ASP  52           HB2      ASP  52  41.215  20.645  16.478
  429    HB3  ASP  52           HB1      ASP  52  40.352  21.601  17.685
  430    H    GLY  53           HN       GLY  53  40.015  19.289  14.484
  431    HA2  GLY  53           HA3      GLY  53  40.815  17.172  13.719
  432    HA3  GLY  53           HA2      GLY  53  40.305  16.449  15.246
  433    H    ARG  54           HN       ARG  54  38.394  18.431  13.009
  434    HA   ARG  54           HA       ARG  54  36.967  16.196  11.864
  435    HB2  ARG  54           HB2      ARG  54  36.137  16.188  14.263
  436    HB3  ARG  54           HB1      ARG  54  35.409  17.757  13.936
  437    HG2  ARG  54           HG2      ARG  54  34.018  16.828  12.192
  438    HG3  ARG  54           HG1      ARG  54  34.855  15.277  12.289
  439    HD2  ARG  54           HD2      ARG  54  33.379  16.488  14.635
  440    HD3  ARG  54           HD1      ARG  54  32.616  15.380  13.495
  441    HE   ARG  54           HE       ARG  54  35.026  14.181  14.427
  442   HH11  ARG  54          HH11      ARG  54  34.895  12.596  16.036
  443   HH12  ARG  54          HH12      ARG  54  33.483  12.513  17.037
  444   HH21  ARG  54          HH21      ARG  54  31.907  15.188  15.494
  445   HH22  ARG  54          HH22      ARG  54  31.792  13.980  16.729
  446    H    THR  55           HN       THR  55  35.272  16.881  10.404
  447    HA   THR  55           HA       THR  55  35.299  19.813   9.766
  448    HB   THR  55           HB       THR  55  34.898  17.570   7.772
  449    HG1  THR  55           HG1      THR  55  36.939  17.242   8.378
  450   HG21  THR  55          HG21      THR  55  34.195  20.027   7.352
  451   HG22  THR  55          HG22      THR  55  35.194  19.240   6.131
  452   HG23  THR  55          HG23      THR  55  35.925  20.361   7.280
  453    H    LEU  56           HN       LEU  56  33.214  20.663   9.016
  454    HA   LEU  56           HA       LEU  56  30.953  19.832  10.365
  455    HB2  LEU  56           HB2      LEU  56  30.901  20.986   7.567
  456    HB3  LEU  56           HB1      LEU  56  29.665  21.153   8.813
  457    HG   LEU  56           HG       LEU  56  32.469  22.316   8.855
  458   HD11  LEU  56          HD11      LEU  56  31.077  24.449   9.160
  459   HD12  LEU  56          HD12      LEU  56  29.691  23.483   8.658
  460   HD13  LEU  56          HD13      LEU  56  31.051  23.709   7.561
  461   HD21  LEU  56          HD21      LEU  56  30.383  22.037  11.022
  462   HD22  LEU  56          HD22      LEU  56  31.534  23.371  11.049
  463   HD23  LEU  56          HD23      LEU  56  32.113  21.709  11.110
  464    H    SER  57           HN       SER  57  31.990  18.722   7.130
  465    HA   SER  57           HA       SER  57  29.741  17.092   6.542
  466    HB2  SER  57           HB2      SER  57  31.291  15.750   5.155
  467    HB3  SER  57           HB1      SER  57  31.586  17.472   4.933
  468    HG   SER  57           HG       SER  57  33.538  16.399   5.271
  469    H    ASP  58           HN       ASP  58  32.803  16.102   8.044
  470    HA   ASP  58           HA       ASP  58  32.052  13.520   8.875
  471    HB2  ASP  58           HB2      ASP  58  33.895  15.540  10.173
  472    HB3  ASP  58           HB1      ASP  58  33.721  13.890  10.774
  473    H    TYR  59           HN       TYR  59  31.388  16.648  10.411
  474    HA   TYR  59           HA       TYR  59  30.180  15.466  12.780
  475    HB2  TYR  59           HB2      TYR  59  30.905  18.091  11.863
  476    HB3  TYR  59           HB1      TYR  59  29.208  18.157  12.314
  477    HD1  TYR  59           HD1      TYR  59  32.229  18.957  13.583
  478    HD2  TYR  59           HD2      TYR  59  28.921  16.393  14.561
  479    HE1  TYR  59           HE1      TYR  59  32.872  19.041  15.973
  480    HE2  TYR  59           HE2      TYR  59  29.566  16.478  16.955
  481    HH   TYR  59           HH       TYR  59  31.275  17.023  18.378
  482    H    ASN  60           HN       ASN  60  29.277  15.335   9.688
  483    HA   ASN  60           HA       ASN  60  27.208  15.227   8.522
  484    HB2  ASN  60           HB2      ASN  60  26.859  13.601  11.046
  485    HB3  ASN  60           HB1      ASN  60  25.707  13.558   9.712
  486   HD21  ASN  60          HD21      ASN  60  27.328  11.271  10.535
  487   HD22  ASN  60          HD22      ASN  60  28.356  10.892   9.239
  488    H    ILE  61           HN       ILE  61  26.919  17.714   9.260
  489    HA   ILE  61           HA       ILE  61  25.017  18.314  11.307
  490    HB   ILE  61           HB       ILE  61  25.682  19.764   8.726
  491   HG12  ILE  61          HG12      ILE  61  26.383  20.424  11.601
  492   HG13  ILE  61          HG11      ILE  61  27.446  19.510  10.532
  493   HG21  ILE  61          HG21      ILE  61  23.853  20.502  11.018
  494   HG22  ILE  61          HG22      ILE  61  23.503  20.531   9.291
  495   HG23  ILE  61          HG23      ILE  61  24.591  21.729   9.990
  496   HD11  ILE  61          HD11      ILE  61  27.340  21.431   8.907
  497   HD12  ILE  61          HD12      ILE  61  28.117  21.832  10.438
  498   HD13  ILE  61          HD13      ILE  61  26.459  22.346  10.129
  499    H    GLN  62           HN       GLN  62  22.941  17.618  11.399
  500    HA   GLN  62           HA       GLN  62  21.543  16.872   8.863
  501    HB2  GLN  62           HB2      GLN  62  20.916  16.234  11.761
  502    HB3  GLN  62           HB1      GLN  62  19.957  15.700  10.381
  503    HG2  GLN  62           HG2      GLN  62  21.978  14.561   9.463
  504    HG3  GLN  62           HG1      GLN  62  22.859  15.017  10.919
  505   HE21  GLN  62          HE21      GLN  62  22.970  13.266  12.319
  506   HE22  GLN  62          HE22      GLN  62  21.714  12.159  12.600
  507    H    LYS  63           HN       LYS  63  21.698  19.607   9.186
  508    HA   LYS  63           HA       LYS  63  19.015  20.411  10.269
  509    HB2  LYS  63           HB2      LYS  63  21.549  21.988   9.752
  510    HB3  LYS  63           HB1      LYS  63  19.996  22.754  10.087
  511    HG2  LYS  63           HG2      LYS  63  19.881  21.359  12.206
  512    HG3  LYS  63           HG1      LYS  63  21.554  20.892  11.895
  513    HD2  LYS  63           HD2      LYS  63  22.235  23.254  11.927
  514    HD3  LYS  63           HD1      LYS  63  20.563  23.740  12.204
  515    HE2  LYS  63           HE2      LYS  63  22.113  21.908  14.052
  516    HE3  LYS  63           HE1      LYS  63  21.941  23.644  14.305
  517    HZ1  LYS  63           HZ1      LYS  63  19.939  21.522  14.523
  518    HZ2  LYS  63           HZ2      LYS  63  19.420  23.047  13.980
  519    HZ3  LYS  63           HZ3      LYS  63  20.174  22.892  15.494
  520    H    GLU  64           HN       GLU  64  20.168  19.330   7.499
  521    HA   GLU  64           HA       GLU  64  19.516  19.565   5.266
  522    HB2  GLU  64           HB2      GLU  64  17.241  19.841   6.499
  523    HB3  GLU  64           HB1      GLU  64  17.428  21.560   6.154
  524    HG2  GLU  64           HG2      GLU  64  17.654  21.059   3.750
  525    HG3  GLU  64           HG1      GLU  64  17.463  19.338   4.091
  526    H    SEP  65           HN       SEP  65  18.817  22.838   6.553
  527    HA   SEP  65           HA       SEP  65  21.166  23.917   5.121
  528    HB2  SEP  65           HB1      SEP  65  19.535  23.943   3.337
  529    HB3  SEP  65           HB2      SEP  65  19.713  25.596   3.922
  530    H    TPO  66           HN       TPO  66  20.778  26.559   5.326
  531    HA   TPO  66           HA       TPO  66  20.851  28.316   6.882
  532    HB   TPO  66           HB       TPO  66  18.638  26.839   8.317
  533   HG21  TPO  66          HG21      TPO  66  17.904  29.077   8.899
  534   HG22  TPO  66          HG22      TPO  66  19.131  29.793   7.856
  535   HG23  TPO  66          HG23      TPO  66  19.610  28.926   9.315
  536    H    LEU  67           HN       LEU  67  22.963  27.283   7.554
  537    HA   LEU  67           HA       LEU  67  22.917  25.726  10.052
  538    HB2  LEU  67           HB2      LEU  67  25.099  26.759   8.234
  539    HB3  LEU  67           HB1      LEU  67  25.478  26.069   9.812
  540    HG   LEU  67           HG       LEU  67  24.417  23.970   9.211
  541   HD11  LEU  67          HD11      LEU  67  23.579  25.511   6.749
  542   HD12  LEU  67          HD12      LEU  67  22.561  24.623   7.882
  543   HD13  LEU  67          HD13      LEU  67  23.611  23.748   6.771
  544   HD21  LEU  67          HD21      LEU  67  25.850  23.332   7.250
  545   HD22  LEU  67          HD22      LEU  67  26.735  24.199   8.505
  546   HD23  LEU  67          HD23      LEU  67  26.241  25.039   7.034
  547    H    HIS  68           HN       HIS  68  22.686  26.742  11.964
  548    HA   HIS  68           HA       HIS  68  23.673  29.566  12.255
  549    HB2  HIS  68           HB2      HIS  68  22.005  29.811  14.023
  550    HB3  HIS  68           HB1      HIS  68  21.218  29.251  12.548
  551    HD1  HIS  68           HD1      HIS  68  20.540  26.694  12.455
  552    HD2  HIS  68           HD2      HIS  68  21.896  28.000  16.179
  553    HE1  HIS  68           HE1      HIS  68  19.885  24.904  14.126
  554    HE2  HIS  68           HE2      HIS  68  20.708  25.687  16.393
  555    H    LEU  69           HN       LEU  69  25.180  29.965  13.827
  556    HA   LEU  69           HA       LEU  69  25.855  27.768  15.761
  557    HB2  LEU  69           HB2      LEU  69  27.638  29.399  13.951
  558    HB3  LEU  69           HB1      LEU  69  28.258  28.889  15.517
  559    HG   LEU  69           HG       LEU  69  27.605  26.516  14.905
  560   HD11  LEU  69          HD11      LEU  69  26.094  26.562  13.144
  561   HD12  LEU  69          HD12      LEU  69  27.582  26.315  12.244
  562   HD13  LEU  69          HD13      LEU  69  26.876  27.926  12.350
  563   HD21  LEU  69          HD21      LEU  69  29.917  27.406  14.753
  564   HD22  LEU  69          HD22      LEU  69  29.601  27.904  13.091
  565   HD23  LEU  69          HD23      LEU  69  29.598  26.192  13.513
  566    H    VAL  70           HN       VAL  70  26.628  28.585  17.844
  567    HA   VAL  70           HA       VAL  70  26.259  31.525  18.279
  568    HB   VAL  70           HB       VAL  70  25.159  29.298  20.029
  569   HG11  VAL  70          HG11      VAL  70  25.882  31.198  21.364
  570   HG12  VAL  70          HG12      VAL  70  24.123  31.224  21.259
  571   HG13  VAL  70          HG13      VAL  70  25.082  32.321  20.266
  572   HG21  VAL  70          HG21      VAL  70  23.784  31.346  18.257
  573   HG22  VAL  70          HG22      VAL  70  22.955  30.263  19.374
  574   HG23  VAL  70          HG23      VAL  70  23.828  29.602  17.992
  575    H    LEU  71           HN       LEU  71  28.167  32.266  19.093
  576    HA   LEU  71           HA       LEU  71  30.046  30.400  20.366
  577    HB2  LEU  71           HB2      LEU  71  30.772  32.135  18.721
  578    HB3  LEU  71           HB1      LEU  71  30.281  33.383  19.860
  579    HG   LEU  71           HG       LEU  71  32.125  31.292  20.959
  580   HD11  LEU  71          HD11      LEU  71  33.005  33.312  18.883
  581   HD12  LEU  71          HD12      LEU  71  33.197  31.559  18.821
  582   HD13  LEU  71          HD13      LEU  71  34.112  32.506  19.994
  583   HD21  LEU  71          HD21      LEU  71  31.453  33.203  22.333
  584   HD22  LEU  71          HD22      LEU  71  32.017  34.327  21.098
  585   HD23  LEU  71          HD23      LEU  71  33.172  33.325  21.973
  586    H    ARG  72           HN       ARG  72  30.791  30.627  22.551
  587    HA   ARG  72           HA       ARG  72  29.019  32.278  24.326
  588    HB2  ARG  72           HB2      ARG  72  28.915  29.693  24.465
  589    HB3  ARG  72           HB1      ARG  72  30.529  29.794  25.164
  590    HG2  ARG  72           HG2      ARG  72  29.598  31.419  26.860
  591    HG3  ARG  72           HG1      ARG  72  27.990  31.056  26.232
  592    HD2  ARG  72           HD2      ARG  72  28.444  28.620  26.700
  593    HD3  ARG  72           HD1      ARG  72  29.931  29.112  27.507
  594    HE   ARG  72           HE       ARG  72  28.637  29.964  29.310
  595   HH11  ARG  72          HH11      ARG  72  26.681  30.144  30.422
  596   HH12  ARG  72          HH12      ARG  72  25.193  29.826  29.593
  597   HH21  ARG  72          HH21      ARG  72  26.724  29.107  26.567
  598   HH22  ARG  72          HH22      ARG  72  25.219  29.238  27.412
  599    H    LEU  73           HN       LEU  73  30.123  33.336  26.113
  600    HA   LEU  73           HA       LEU  73  33.024  33.797  25.574
  601    HB2  LEU  73           HB2      LEU  73  30.909  35.345  27.090
  602    HB3  LEU  73           HB1      LEU  73  32.625  35.713  27.248
  603    HG   LEU  73           HG       LEU  73  32.730  35.947  24.735
  604   HD11  LEU  73          HD11      LEU  73  30.832  34.757  23.962
  605   HD12  LEU  73          HD12      LEU  73  30.411  36.447  23.711
  606   HD13  LEU  73          HD13      LEU  73  29.751  35.569  25.090
  607   HD21  LEU  73          HD21      LEU  73  31.524  38.166  24.741
  608   HD22  LEU  73          HD22      LEU  73  32.626  37.938  26.097
  609   HD23  LEU  73          HD23      LEU  73  30.889  37.749  26.333
  610    H    ARG  74           HN       ARG  74  34.547  33.619  27.301
  611    HA   ARG  74           HA       ARG  74  35.468  32.427  29.111
  612    HB2  ARG  74           HB2      ARG  74  32.932  33.613  30.260
  613    HB3  ARG  74           HB1      ARG  74  34.133  32.786  31.253
  614    HG2  ARG  74           HG2      ARG  74  35.856  34.366  30.560
  615    HG3  ARG  74           HG1      ARG  74  34.731  35.151  29.452
  616    HD2  ARG  74           HD2      ARG  74  34.231  34.946  32.431
  617    HD3  ARG  74           HD1      ARG  74  35.040  36.324  31.686
  618    HE   ARG  74           HE       ARG  74  32.577  35.858  30.317
  619   HH11  ARG  74          HH11      ARG  74  30.820  37.199  30.790
  620   HH12  ARG  74          HH12      ARG  74  30.806  38.095  32.272
  621   HH21  ARG  74          HH21      ARG  74  33.877  36.887  33.340
  622   HH22  ARG  74          HH22      ARG  74  32.536  37.919  33.716
  623    H    GLY  75           HN       GLY  75  34.463  30.571  27.475
  624    HA2  GLY  75           HA3      GLY  75  32.313  28.970  28.441
  625    HA3  GLY  75           HA2      GLY  75  33.625  28.379  27.417
  626    H    GLY  76           HN       GLY  76  35.781  28.958  29.207
  627    HA2  GLY  76           HA3      GLY  76  35.219  27.642  31.762
  628    HA3  GLY  76           HA2      GLY  76  36.147  26.648  30.638
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1  28.578  27.453   3.608
    2    H2   MET   1           HT2      MET   1  29.749  28.666   3.829
    3    H3   MET   1           HT3      MET   1  29.611  27.877   2.331
    4    HA   MET   1           HA       MET   1  28.379  29.617   1.715
    5    HB2  MET   1           HB2      MET   1  26.430  28.312   3.641
    6    HB3  MET   1           HB1      MET   1  25.997  29.396   2.319
    7    HG2  MET   1           HG2      MET   1  26.932  27.820   0.689
    8    HG3  MET   1           HG1      MET   1  27.437  26.746   1.994
    9    HE1  MET   1           HE1      MET   1  25.693  25.649  -0.375
   10    HE2  MET   1           HE2      MET   1  24.634  24.615   0.581
   11    HE3  MET   1           HE3      MET   1  26.331  24.779   1.027
   12    H    GLN   2           HN       GLN   2  26.439  31.188   2.919
   13    HA   GLN   2           HA       GLN   2  28.089  32.870   4.651
   14    HB2  GLN   2           HB2      GLN   2  26.513  33.795   2.931
   15    HB3  GLN   2           HB1      GLN   2  25.170  33.195   3.901
   16    HG2  GLN   2           HG2      GLN   2  25.854  34.586   5.785
   17    HG3  GLN   2           HG1      GLN   2  27.281  35.128   4.900
   18   HE21  GLN   2          HE21      GLN   2  26.542  37.381   4.932
   19   HE22  GLN   2          HE22      GLN   2  25.249  37.894   3.959
   20    H    ILE   3           HN       ILE   3  28.280  31.222   6.411
   21    HA   ILE   3           HA       ILE   3  25.896  30.456   7.883
   22    HB   ILE   3           HB       ILE   3  27.539  29.700   9.627
   23   HG12  ILE   3          HG12      ILE   3  29.605  30.669   7.629
   24   HG13  ILE   3          HG11      ILE   3  29.219  31.511   9.128
   25   HG21  ILE   3          HG21      ILE   3  26.854  28.340   7.587
   26   HG22  ILE   3          HG22      ILE   3  28.396  27.888   8.314
   27   HG23  ILE   3          HG23      ILE   3  28.365  28.857   6.841
   28   HD11  ILE   3          HD11      ILE   3  29.857  29.529  10.429
   29   HD12  ILE   3          HD12      ILE   3  31.193  30.040   9.396
   30   HD13  ILE   3          HD13      ILE   3  30.207  28.651   8.939
   31    H    PHE   4           HN       PHE   4  25.040  31.383   9.743
   32    HA   PHE   4           HA       PHE   4  26.075  34.118  10.446
   33    HB2  PHE   4           HB2      PHE   4  23.324  32.865  10.690
   34    HB3  PHE   4           HB1      PHE   4  23.750  34.435  11.376
   35    HD1  PHE   4           HD1      PHE   4  23.614  32.511   8.182
   36    HD2  PHE   4           HD2      PHE   4  23.796  36.387  10.025
   37    HE1  PHE   4           HE1      PHE   4  23.222  33.578   5.978
   38    HE2  PHE   4           HE2      PHE   4  23.404  37.453   7.821
   39    HZ   PHE   4           HZ       PHE   4  23.117  36.048   5.798
   40    H    VAL   5           HN       VAL   5  26.748  34.477  12.567
   41    HA   VAL   5           HA       VAL   5  26.098  32.406  14.619
   42    HB   VAL   5           HB       VAL   5  28.826  33.661  14.176
   43   HG11  VAL   5          HG11      VAL   5  28.285  33.071  16.523
   44   HG12  VAL   5          HG12      VAL   5  29.555  32.038  15.869
   45   HG13  VAL   5          HG13      VAL   5  27.909  31.428  16.010
   46   HG21  VAL   5          HG21      VAL   5  28.540  32.128  12.384
   47   HG22  VAL   5          HG22      VAL   5  27.678  30.973  13.400
   48   HG23  VAL   5          HG23      VAL   5  29.412  31.211  13.613
   49    H    LYS   6           HN       LYS   6  25.528  33.336  16.563
   50    HA   LYS   6           HA       LYS   6  25.950  36.302  16.863
   51    HB2  LYS   6           HB2      LYS   6  23.622  34.552  17.689
   52    HB3  LYS   6           HB1      LYS   6  23.841  36.207  18.258
   53    HG2  LYS   6           HG2      LYS   6  23.841  37.016  15.930
   54    HG3  LYS   6           HG1      LYS   6  23.628  35.362  15.354
   55    HD2  LYS   6           HD2      LYS   6  21.489  35.211  16.584
   56    HD3  LYS   6           HD1      LYS   6  21.696  36.872  17.138
   57    HE2  LYS   6           HE2      LYS   6  21.526  36.020  14.233
   58    HE3  LYS   6           HE1      LYS   6  20.209  36.745  15.156
   59    HZ1  LYS   6           HZ1      LYS   6  22.814  37.976  14.457
   60    HZ2  LYS   6           HZ2      LYS   6  21.737  38.651  15.585
   61    HZ3  LYS   6           HZ3      LYS   6  21.269  38.473  13.961
   62    H    THR   7           HN       THR   7  26.521  37.055  18.919
   63    HA   THR   7           HA       THR   7  27.530  34.962  20.814
   64    HB   THR   7           HB       THR   7  29.078  36.651  21.614
   65    HG1  THR   7           HG1      THR   7  28.742  38.697  21.270
   66   HG21  THR   7          HG21      THR   7  29.028  36.901  18.603
   67   HG22  THR   7          HG22      THR   7  29.524  35.420  19.421
   68   HG23  THR   7          HG23      THR   7  30.434  36.911  19.669
   69    H    LEU   8           HN       LEU   8  27.649  36.186  23.161
   70    HA   LEU   8           HA       LEU   8  24.880  36.442  23.967
   71    HB2  LEU   8           HB2      LEU   8  27.519  36.808  25.393
   72    HB3  LEU   8           HB1      LEU   8  25.985  37.136  26.196
   73    HG   LEU   8           HG       LEU   8  25.232  34.852  25.776
   74   HD11  LEU   8          HD11      LEU   8  26.185  34.263  23.697
   75   HD12  LEU   8          HD12      LEU   8  27.044  33.242  24.849
   76   HD13  LEU   8          HD13      LEU   8  27.813  34.699  24.217
   77   HD21  LEU   8          HD21      LEU   8  26.517  35.205  27.816
   78   HD22  LEU   8          HD22      LEU   8  28.032  35.023  26.932
   79   HD23  LEU   8          HD23      LEU   8  26.957  33.639  27.134
   80    H    THR   9           HN       THR   9  27.416  38.706  23.117
   81    HA   THR   9           HA       THR   9  26.041  41.019  24.250
   82    HB   THR   9           HB       THR   9  27.772  42.324  23.077
   83    HG1  THR   9           HG1      THR   9  28.992  40.006  22.158
   84   HG21  THR   9          HG21      THR   9  29.742  41.320  24.171
   85   HG22  THR   9          HG22      THR   9  28.853  39.811  24.385
   86   HG23  THR   9          HG23      THR   9  28.334  41.268  25.232
   87    H    GLY  10           HN       GLY  10  25.356  39.079  21.653
   88    HA2  GLY  10           HA3      GLY  10  23.614  39.427  20.064
   89    HA3  GLY  10           HA2      GLY  10  23.628  41.147  20.456
   90    H    LYS  11           HN       LYS  11  26.763  40.641  20.123
   91    HA   LYS  11           HA       LYS  11  27.087  41.960  17.663
   92    HB2  LYS  11           HB2      LYS  11  28.891  41.547  19.377
   93    HB3  LYS  11           HB1      LYS  11  28.995  39.888  18.787
   94    HG2  LYS  11           HG2      LYS  11  29.548  40.704  16.536
   95    HG3  LYS  11           HG1      LYS  11  29.409  42.371  17.095
   96    HD2  LYS  11           HD2      LYS  11  31.238  41.980  18.710
   97    HD3  LYS  11           HD1      LYS  11  31.390  40.320  18.130
   98    HE2  LYS  11           HE2      LYS  11  31.929  41.151  15.873
   99    HE3  LYS  11           HE1      LYS  11  31.767  42.812  16.442
  100    HZ1  LYS  11           HZ1      LYS  11  33.649  42.641  17.744
  101    HZ2  LYS  11           HZ2      LYS  11  34.088  41.752  16.364
  102    HZ3  LYS  11           HZ3      LYS  11  33.612  40.947  17.782
  103    H    THR  12           HN       THR  12  26.453  41.299  15.672
  104    HA   THR  12           HA       THR  12  26.157  38.384  15.132
  105    HB   THR  12           HB       THR  12  25.259  40.797  13.527
  106    HG1  THR  12           HG1      THR  12  23.407  40.575  14.544
  107   HG21  THR  12          HG21      THR  12  25.539  38.988  12.008
  108   HG22  THR  12          HG22      THR  12  23.823  38.985  12.419
  109   HG23  THR  12          HG23      THR  12  24.912  37.817  13.168
  110    H    ILE  13           HN       ILE  13  27.503  37.328  13.767
  111    HA   ILE  13           HA       ILE  13  29.208  38.865  11.875
  112    HB   ILE  13           HB       ILE  13  31.189  37.470  12.598
  113   HG12  ILE  13          HG12      ILE  13  29.398  36.907  14.983
  114   HG13  ILE  13          HG11      ILE  13  29.885  35.719  13.775
  115   HG21  ILE  13          HG21      ILE  13  31.738  38.903  14.482
  116   HG22  ILE  13          HG22      ILE  13  30.031  39.245  14.765
  117   HG23  ILE  13          HG23      ILE  13  30.822  39.847  13.306
  118   HD11  ILE  13          HD11      ILE  13  31.707  37.228  15.669
  119   HD12  ILE  13          HD12      ILE  13  32.279  36.195  14.359
  120   HD13  ILE  13          HD13      ILE  13  31.356  35.499  15.691
  121    H    THR  14           HN       THR  14  29.561  37.707   9.965
  122    HA   THR  14           HA       THR  14  28.643  34.852   9.904
  123    HB   THR  14           HB       THR  14  27.344  35.231   7.991
  124    HG1  THR  14           HG1      THR  14  28.515  37.784   7.674
  125   HG21  THR  14          HG21      THR  14  25.887  37.101   8.491
  126   HG22  THR  14          HG22      THR  14  27.151  37.889   9.432
  127   HG23  THR  14          HG23      THR  14  26.419  36.396  10.017
  128    H    LEU  15           HN       LEU  15  29.840  33.517   8.530
  129    HA   LEU  15           HA       LEU  15  32.275  34.754   7.265
  130    HB2  LEU  15           HB2      LEU  15  32.134  31.881   8.197
  131    HB3  LEU  15           HB1      LEU  15  33.556  32.887   7.921
  132    HG   LEU  15           HG       LEU  15  31.538  33.325  10.149
  133   HD11  LEU  15          HD11      LEU  15  32.704  31.316  10.660
  134   HD12  LEU  15          HD12      LEU  15  33.539  32.582  11.560
  135   HD13  LEU  15          HD13      LEU  15  34.232  31.962  10.062
  136   HD21  LEU  15          HD21      LEU  15  33.492  34.766  10.999
  137   HD22  LEU  15          HD22      LEU  15  32.581  35.410   9.631
  138   HD23  LEU  15          HD23      LEU  15  34.147  34.644   9.365
  139    H    GLU  16           HN       GLU  16  31.998  34.690   5.050
  140    HA   GLU  16           HA       GLU  16  30.274  32.594   3.872
  141    HB2  GLU  16           HB2      GLU  16  31.732  34.970   2.679
  142    HB3  GLU  16           HB1      GLU  16  30.741  33.851   1.742
  143    HG2  GLU  16           HG2      GLU  16  28.770  34.422   3.026
  144    HG3  GLU  16           HG1      GLU  16  29.726  35.399   4.141
  145    H    VAL  17           HN       VAL  17  31.249  30.665   3.568
  146    HA   VAL  17           HA       VAL  17  33.563  30.463   1.833
  147    HB   VAL  17           HB       VAL  17  34.769  30.924   3.902
  148   HG11  VAL  17          HG11      VAL  17  34.428  29.713   5.923
  149   HG12  VAL  17          HG12      VAL  17  33.446  28.491   5.115
  150   HG13  VAL  17          HG13      VAL  17  32.808  30.116   5.356
  151   HG21  VAL  17          HG21      VAL  17  36.196  29.009   3.905
  152   HG22  VAL  17          HG22      VAL  17  35.520  29.092   2.278
  153   HG23  VAL  17          HG23      VAL  17  34.873  27.937   3.444
  154    H    GLU  18           HN       GLU  18  33.927  28.200   1.206
  155    HA   GLU  18           HA       GLU  18  31.665  26.669   0.794
  156    HB2  GLU  18           HB2      GLU  18  34.535  25.801   1.177
  157    HB3  GLU  18           HB1      GLU  18  33.270  24.671   0.697
  158    HG2  GLU  18           HG2      GLU  18  32.758  26.044  -1.273
  159    HG3  GLU  18           HG1      GLU  18  33.977  27.223  -0.782
  160    HA   PRO  19           HA       PRO  19  30.567  25.086   4.801
  161    HB2  PRO  19           HB2      PRO  19  29.190  22.823   4.147
  162    HB3  PRO  19           HB1      PRO  19  28.560  24.451   3.819
  163    HG2  PRO  19           HG2      PRO  19  29.947  22.558   1.962
  164    HG3  PRO  19           HG1      PRO  19  28.497  23.543   1.685
  165    HD2  PRO  19           HD2      PRO  19  30.962  24.302   0.791
  166    HD3  PRO  19           HD1      PRO  19  29.723  25.480   1.283
  167    H    SER  20           HN       SER  20  32.589  23.197   2.703
  168    HA   SER  20           HA       SER  20  33.001  21.021   4.595
  169    HB2  SER  20           HB2      SER  20  35.020  20.579   3.030
  170    HB3  SER  20           HB1      SER  20  33.400  20.414   2.359
  171    HG   SER  20           HG       SER  20  34.669  21.678   0.992
  172    H    ASP  21           HN       ASP  21  33.597  24.003   5.269
  173    HA   ASP  21           HA       ASP  21  36.428  24.166   5.719
  174    HB2  ASP  21           HB2      ASP  21  33.988  25.670   6.574
  175    HB3  ASP  21           HB1      ASP  21  35.431  25.888   7.553
  176    H    THR  22           HN       THR  22  37.620  23.619   7.553
  177    HA   THR  22           HA       THR  22  36.424  21.596   9.310
  178    HB   THR  22           HB       THR  22  38.708  21.404  10.235
  179    HG1  THR  22           HG1      THR  22  39.035  23.719   8.674
  180   HG21  THR  22          HG21      THR  22  37.995  20.328   8.030
  181   HG22  THR  22          HG22      THR  22  39.731  20.506   8.277
  182   HG23  THR  22          HG23      THR  22  38.870  21.629   7.226
  183    H    ILE  23           HN       ILE  23  36.117  21.822  11.556
  184    HA   ILE  23           HA       ILE  23  35.123  24.179  12.601
  185    HB   ILE  23           HB       ILE  23  36.612  21.970  14.028
  186   HG12  ILE  23          HG12      ILE  23  33.650  22.582  13.893
  187   HG13  ILE  23          HG11      ILE  23  34.453  21.510  12.746
  188   HG21  ILE  23          HG21      ILE  23  35.055  24.336  15.097
  189   HG22  ILE  23          HG22      ILE  23  36.687  23.830  15.531
  190   HG23  ILE  23          HG23      ILE  23  35.300  22.866  16.040
  191   HD11  ILE  23          HD11      ILE  23  34.692  21.121  15.725
  192   HD12  ILE  23          HD12      ILE  23  35.055  19.970  14.442
  193   HD13  ILE  23          HD13      ILE  23  33.384  20.404  14.791
  194    H    GLU  24           HN       GLU  24  38.487  23.055  13.090
  195    HA   GLU  24           HA       GLU  24  39.523  25.218  14.492
  196    HB2  GLU  24           HB2      GLU  24  41.680  24.733  13.199
  197    HB3  GLU  24           HB1      GLU  24  40.965  23.366  14.054
  198    HG2  GLU  24           HG2      GLU  24  39.892  22.606  11.974
  199    HG3  GLU  24           HG1      GLU  24  40.566  23.993  11.112
  200    H    ASN  25           HN       ASN  25  38.661  25.057  11.088
  201    HA   ASN  25           HA       ASN  25  39.990  27.477  10.276
  202    HB2  ASN  25           HB2      ASN  25  38.977  25.648   8.772
  203    HB3  ASN  25           HB1      ASN  25  37.419  26.416   9.079
  204   HD21  ASN  25          HD21      ASN  25  36.884  28.112   7.691
  205   HD22  ASN  25          HD22      ASN  25  37.993  28.965   6.729
  206    H    VAL  26           HN       VAL  26  36.649  26.790  11.327
  207    HA   VAL  26           HA       VAL  26  35.627  29.421  11.162
  208    HB   VAL  26           HB       VAL  26  35.027  27.383  13.329
  209   HG11  VAL  26          HG11      VAL  26  32.738  28.493  13.122
  210   HG12  VAL  26          HG12      VAL  26  33.544  29.753  12.187
  211   HG13  VAL  26          HG13      VAL  26  34.006  29.467  13.865
  212   HG21  VAL  26          HG21      VAL  26  34.047  27.652  10.481
  213   HG22  VAL  26          HG22      VAL  26  33.147  26.760  11.706
  214   HG23  VAL  26          HG23      VAL  26  34.770  26.239  11.251
  215    H    LYS  27           HN       LYS  27  36.810  27.814  14.118
  216    HA   LYS  27           HA       LYS  27  36.978  29.892  15.889
  217    HB2  LYS  27           HB2      LYS  27  39.013  27.709  15.360
  218    HB3  LYS  27           HB1      LYS  27  39.048  28.747  16.786
  219    HG2  LYS  27           HG2      LYS  27  36.703  28.013  17.297
  220    HG3  LYS  27           HG1      LYS  27  36.821  26.869  15.962
  221    HD2  LYS  27           HD2      LYS  27  38.671  25.720  17.023
  222    HD3  LYS  27           HD1      LYS  27  38.748  26.935  18.298
  223    HE2  LYS  27           HE2      LYS  27  36.242  25.326  17.799
  224    HE3  LYS  27           HE1      LYS  27  37.526  24.739  18.855
  225    HZ1  LYS  27           HZ1      LYS  27  35.870  25.934  20.118
  226    HZ2  LYS  27           HZ2      LYS  27  36.069  27.311  19.141
  227    HZ3  LYS  27           HZ3      LYS  27  37.336  26.786  20.141
  228    H    ALA  28           HN       ALA  28  39.119  29.364  13.127
  229    HA   ALA  28           HA       ALA  28  41.081  31.337  13.873
  230    HB1  ALA  28           HB1      ALA  28  41.268  29.452  12.124
  231    HB2  ALA  28           HB2      ALA  28  41.978  31.010  11.701
  232    HB3  ALA  28           HB3      ALA  28  40.412  30.544  11.035
  233    H    LYS  29           HN       LYS  29  38.523  31.512  11.358
  234    HA   LYS  29           HA       LYS  29  38.809  34.245  10.750
  235    HB2  LYS  29           HB2      LYS  29  36.456  32.362  10.681
  236    HB3  LYS  29           HB1      LYS  29  36.225  34.064  10.285
  237    HG2  LYS  29           HG2      LYS  29  36.656  32.845   8.232
  238    HG3  LYS  29           HG1      LYS  29  38.051  33.863   8.578
  239    HD2  LYS  29           HD2      LYS  29  39.301  31.989   9.433
  240    HD3  LYS  29           HD1      LYS  29  37.875  30.952   9.393
  241    HE2  LYS  29           HE2      LYS  29  37.802  31.074   6.961
  242    HE3  LYS  29           HE1      LYS  29  39.140  32.222   6.949
  243    HZ1  LYS  29           HZ1      LYS  29  39.319  29.480   6.859
  244    HZ2  LYS  29           HZ2      LYS  29  39.801  29.894   8.434
  245    HZ3  LYS  29           HZ3      LYS  29  40.593  30.574   7.093
  246    H    ILE  30           HN       ILE  30  37.359  32.752  13.536
  247    HA   ILE  30           HA       ILE  30  36.071  35.246  14.427
  248    HB   ILE  30           HB       ILE  30  36.409  32.506  15.675
  249   HG12  ILE  30          HG12      ILE  30  33.914  33.999  14.820
  250   HG13  ILE  30          HG11      ILE  30  34.800  32.926  13.738
  251   HG21  ILE  30          HG21      ILE  30  36.386  34.031  17.533
  252   HG22  ILE  30          HG22      ILE  30  34.734  33.433  17.376
  253   HG23  ILE  30          HG23      ILE  30  35.152  35.037  16.773
  254   HD11  ILE  30          HD11      ILE  30  33.021  31.646  14.748
  255   HD12  ILE  30          HD12      ILE  30  33.481  32.188  16.362
  256   HD13  ILE  30          HD13      ILE  30  34.541  31.105  15.459
  257    H    GLN  31           HN       GLN  31  38.489  33.118  15.952
  258    HA   GLN  31           HA       GLN  31  39.483  34.656  17.961
  259    HB2  GLN  31           HB2      GLN  31  40.406  32.485  17.499
  260    HB3  GLN  31           HB1      GLN  31  41.033  33.014  15.943
  261    HG2  GLN  31           HG2      GLN  31  41.901  34.464  18.422
  262    HG3  GLN  31           HG1      GLN  31  42.630  32.901  18.065
  263   HE21  GLN  31          HE21      GLN  31  43.184  32.817  15.466
  264   HE22  GLN  31          HE22      GLN  31  44.064  34.166  14.926
  265    H    ASP  32           HN       ASP  32  40.516  34.985  14.583
  266    HA   ASP  32           HA       ASP  32  42.320  37.191  15.107
  267    HB2  ASP  32           HB2      ASP  32  40.997  36.349  12.511
  268    HB3  ASP  32           HB1      ASP  32  42.350  37.472  12.650
  269    H    LYS  33           HN       LYS  33  39.124  37.118  13.533
  270    HA   LYS  33           HA       LYS  33  38.812  39.920  13.277
  271    HB2  LYS  33           HB2      LYS  33  36.898  37.640  13.466
  272    HB3  LYS  33           HB1      LYS  33  36.273  39.281  13.433
  273    HG2  LYS  33           HG2      LYS  33  36.494  38.079  11.184
  274    HG3  LYS  33           HG1      LYS  33  37.166  39.698  11.276
  275    HD2  LYS  33           HD2      LYS  33  39.402  38.873  11.347
  276    HD3  LYS  33           HD1      LYS  33  38.872  37.241  11.744
  277    HE2  LYS  33           HE2      LYS  33  37.899  36.969   9.532
  278    HE3  LYS  33           HE1      LYS  33  38.270  38.645   9.131
  279    HZ1  LYS  33           HZ1      LYS  33  39.865  36.721   8.430
  280    HZ2  LYS  33           HZ2      LYS  33  40.448  36.892  10.016
  281    HZ3  LYS  33           HZ3      LYS  33  40.488  38.211   8.947
  282    H    GLU  34           HN       GLU  34  37.983  37.824  16.041
  283    HA   GLU  34           HA       GLU  34  37.064  40.198  17.565
  284    HB2  GLU  34           HB2      GLU  34  37.333  37.380  18.633
  285    HB3  GLU  34           HB1      GLU  34  36.273  38.670  19.195
  286    HG2  GLU  34           HG2      GLU  34  36.065  37.201  16.555
  287    HG3  GLU  34           HG1      GLU  34  34.954  37.071  17.920
  288    H    GLY  35           HN       GLY  35  39.857  38.198  17.153
  289    HA2  GLY  35           HA3      GLY  35  42.028  38.441  18.030
  290    HA3  GLY  35           HA2      GLY  35  41.494  39.951  18.772
  291    H    ILE  36           HN       ILE  36  39.459  37.370  19.519
  292    HA   ILE  36           HA       ILE  36  40.461  37.299  22.283
  293    HB   ILE  36           HB       ILE  36  37.983  36.081  21.056
  294   HG12  ILE  36          HG12      ILE  36  38.403  38.720  22.498
  295   HG13  ILE  36          HG11      ILE  36  38.092  38.540  20.772
  296   HG21  ILE  36          HG21      ILE  36  38.754  35.148  23.249
  297   HG22  ILE  36          HG22      ILE  36  37.204  35.977  23.355
  298   HG23  ILE  36          HG23      ILE  36  38.666  36.773  23.923
  299   HD11  ILE  36          HD11      ILE  36  35.947  37.426  21.299
  300   HD12  ILE  36          HD12      ILE  36  36.015  39.073  21.919
  301   HD13  ILE  36          HD13      ILE  36  36.243  37.712  23.012
  302    HA   PRO  37           HA       PRO  37  42.361  33.323  21.322
  303    HB2  PRO  37           HB2      PRO  37  43.024  32.495  23.830
  304    HB3  PRO  37           HB1      PRO  37  43.882  33.810  23.002
  305    HG2  PRO  37           HG2      PRO  37  41.730  33.972  25.069
  306    HG3  PRO  37           HG1      PRO  37  43.231  34.908  24.933
  307    HD2  PRO  37           HD2      PRO  37  40.804  35.880  24.116
  308    HD3  PRO  37           HD1      PRO  37  42.335  36.365  23.356
  309    HA   PRO  38           HA       PRO  38  38.627  30.710  21.484
  310    HB2  PRO  38           HB2      PRO  38  40.841  28.702  21.275
  311    HB3  PRO  38           HB1      PRO  38  39.244  28.688  20.492
  312    HG2  PRO  38           HG2      PRO  38  41.321  29.508  19.143
  313    HG3  PRO  38           HG1      PRO  38  39.808  30.409  19.031
  314    HD2  PRO  38           HD2      PRO  38  42.338  31.151  20.448
  315    HD3  PRO  38           HD1      PRO  38  41.107  32.203  19.711
  316    H    ASP  39           HN       ASP  39  41.439  30.314  23.537
  317    HA   ASP  39           HA       ASP  39  40.532  28.327  25.314
  318    HB2  ASP  39           HB2      ASP  39  42.224  30.785  25.814
  319    HB3  ASP  39           HB1      ASP  39  41.959  29.535  27.031
  320    H    GLN  40           HN       GLN  40  39.835  31.793  25.287
  321    HA   GLN  40           HA       GLN  40  38.095  31.545  27.656
  322    HB2  GLN  40           HB2      GLN  40  38.719  33.918  25.873
  323    HB3  GLN  40           HB1      GLN  40  37.838  33.977  27.397
  324    HG2  GLN  40           HG2      GLN  40  39.845  33.001  28.536
  325    HG3  GLN  40           HG1      GLN  40  40.719  33.133  27.012
  326   HE21  GLN  40          HE21      GLN  40  40.460  34.715  29.865
  327   HE22  GLN  40          HE22      GLN  40  40.688  36.317  29.351
  328    H    GLN  41           HN       GLN  41  37.656  30.655  24.571
  329    HA   GLN  41           HA       GLN  41  34.749  31.389  24.616
  330    HB2  GLN  41           HB2      GLN  41  36.500  31.417  22.143
  331    HB3  GLN  41           HB1      GLN  41  34.790  31.829  22.228
  332    HG2  GLN  41           HG2      GLN  41  35.280  33.738  23.665
  333    HG3  GLN  41           HG1      GLN  41  36.990  33.303  23.702
  334   HE21  GLN  41          HE21      GLN  41  34.802  35.312  22.127
  335   HE22  GLN  41          HE22      GLN  41  35.674  35.578  20.696
  336    H    ARG  42           HN       ARG  42  33.385  29.744  23.961
  337    HA   ARG  42           HA       ARG  42  34.597  27.275  22.790
  338    HB2  ARG  42           HB2      ARG  42  32.805  27.500  25.228
  339    HB3  ARG  42           HB1      ARG  42  32.911  26.011  24.291
  340    HG2  ARG  42           HG2      ARG  42  35.456  27.328  25.225
  341    HG3  ARG  42           HG1      ARG  42  34.507  26.392  26.376
  342    HD2  ARG  42           HD2      ARG  42  34.763  24.390  25.148
  343    HD3  ARG  42           HD1      ARG  42  35.244  25.242  23.684
  344    HE   ARG  42           HE       ARG  42  37.454  25.399  24.543
  345   HH11  ARG  42          HH11      ARG  42  39.036  24.832  26.050
  346   HH12  ARG  42          HH12      ARG  42  38.563  24.179  27.582
  347   HH21  ARG  42          HH21      ARG  42  35.167  24.342  26.902
  348   HH22  ARG  42          HH22      ARG  42  36.374  23.902  28.063
  349    H    LEU  43           HN       LEU  43  33.316  26.420  21.170
  350    HA   LEU  43           HA       LEU  43  30.982  28.051  20.399
  351    HB2  LEU  43           HB2      LEU  43  32.524  25.802  19.081
  352    HB3  LEU  43           HB1      LEU  43  31.009  26.429  18.399
  353    HG   LEU  43           HG       LEU  43  31.971  28.682  18.292
  354   HD11  LEU  43          HD11      LEU  43  34.549  28.770  18.680
  355   HD12  LEU  43          HD12      LEU  43  34.294  27.318  19.652
  356   HD13  LEU  43          HD13      LEU  43  33.491  28.824  20.090
  357   HD21  LEU  43          HD21      LEU  43  32.294  27.383  16.325
  358   HD22  LEU  43          HD22      LEU  43  33.583  26.439  17.075
  359   HD23  LEU  43          HD23      LEU  43  33.857  28.130  16.658
  360    H    ILE  44           HN       ILE  44  28.893  27.348  20.449
  361    HA   ILE  44           HA       ILE  44  28.326  24.574  21.468
  362    HB   ILE  44           HB       ILE  44  26.913  27.171  22.167
  363   HG12  ILE  44          HG12      ILE  44  29.042  26.936  23.352
  364   HG13  ILE  44          HG11      ILE  44  27.710  26.684  24.472
  365   HG21  ILE  44          HG21      ILE  44  25.645  25.651  23.773
  366   HG22  ILE  44          HG22      ILE  44  26.354  24.280  22.921
  367   HG23  ILE  44          HG23      ILE  44  25.279  25.383  22.065
  368   HD11  ILE  44          HD11      ILE  44  28.097  24.119  23.760
  369   HD12  ILE  44          HD12      ILE  44  29.024  24.877  25.049
  370   HD13  ILE  44          HD13      ILE  44  29.718  24.731  23.438
  371    H    PHE  45           HN       PHE  45  26.776  23.472  20.242
  372    HA   PHE  45           HA       PHE  45  24.911  25.026  18.574
  373    HB2  PHE  45           HB2      PHE  45  26.775  24.872  17.062
  374    HB3  PHE  45           HB1      PHE  45  27.033  23.174  17.458
  375    HD1  PHE  45           HD1      PHE  45  24.695  25.560  15.828
  376    HD2  PHE  45           HD2      PHE  45  25.777  21.448  16.410
  377    HE1  PHE  45           HE1      PHE  45  23.131  24.896  14.019
  378    HE2  PHE  45           HE2      PHE  45  24.213  20.778  14.600
  379    HZ   PHE  45           HZ       PHE  45  22.889  22.505  13.407
  380    H    ALA  46           HN       ALA  46  23.117  24.078  19.487
  381    HA   ALA  46           HA       ALA  46  21.463  22.433  19.699
  382    HB1  ALA  46           HB1      ALA  46  23.225  20.297  18.542
  383    HB2  ALA  46           HB2      ALA  46  22.707  21.615  17.492
  384    HB3  ALA  46           HB3      ALA  46  21.506  20.600  18.285
  385    H    GLY  47           HN       GLY  47  23.810  22.822  21.657
  386    HA2  GLY  47           HA3      GLY  47  23.993  21.916  23.853
  387    HA3  GLY  47           HA2      GLY  47  23.102  20.490  23.323
  388    H    LYS  48           HN       LYS  48  25.526  21.235  21.113
  389    HA   LYS  48           HA       LYS  48  27.481  19.372  22.424
  390    HB2  LYS  48           HB2      LYS  48  26.725  19.500  19.512
  391    HB3  LYS  48           HB1      LYS  48  27.972  18.462  20.191
  392    HG2  LYS  48           HG2      LYS  48  26.275  17.353  21.602
  393    HG3  LYS  48           HG1      LYS  48  25.025  18.387  20.909
  394    HD2  LYS  48           HD2      LYS  48  25.571  17.487  18.652
  395    HD3  LYS  48           HD1      LYS  48  26.744  16.398  19.396
  396    HE2  LYS  48           HE2      LYS  48  23.781  16.466  20.040
  397    HE3  LYS  48           HE1      LYS  48  24.567  15.274  19.004
  398    HZ1  LYS  48           HZ1      LYS  48  24.264  15.108  21.712
  399    HZ2  LYS  48           HZ2      LYS  48  25.890  15.559  21.517
  400    HZ3  LYS  48           HZ3      LYS  48  25.298  14.158  20.762
  401    H    GLN  49           HN       GLN  49  29.723  19.897  22.047
  402    HA   GLN  49           HA       GLN  49  30.157  22.668  21.154
  403    HB2  GLN  49           HB2      GLN  49  31.051  21.557  23.360
  404    HB3  GLN  49           HB1      GLN  49  32.264  20.837  22.305
  405    HG2  GLN  49           HG2      GLN  49  32.626  23.279  21.447
  406    HG3  GLN  49           HG1      GLN  49  31.787  23.750  22.924
  407   HE21  GLN  49          HE21      GLN  49  32.727  22.203  24.904
  408   HE22  GLN  49          HE22      GLN  49  34.421  22.251  25.016
  409    H    LEU  50           HN       LEU  50  32.181  23.005  19.752
  410    HA   LEU  50           HA       LEU  50  32.341  20.845  17.684
  411    HB2  LEU  50           HB2      LEU  50  33.254  23.718  17.412
  412    HB3  LEU  50           HB1      LEU  50  32.923  22.558  16.126
  413    HG   LEU  50           HG       LEU  50  30.893  23.794  18.005
  414   HD11  LEU  50          HD11      LEU  50  30.077  24.948  16.094
  415   HD12  LEU  50          HD12      LEU  50  31.006  23.938  14.987
  416   HD13  LEU  50          HD13      LEU  50  31.828  25.119  16.007
  417   HD21  LEU  50          HD21      LEU  50  29.289  22.527  16.414
  418   HD22  LEU  50          HD22      LEU  50  30.122  21.578  17.643
  419   HD23  LEU  50          HD23      LEU  50  30.697  21.560  15.976
  420    H    GLU  51           HN       GLU  51  34.171  19.635  17.806
  421    HA   GLU  51           HA       GLU  51  36.509  20.677  19.312
  422    HB2  GLU  51           HB2      GLU  51  36.017  17.939  18.103
  423    HB3  GLU  51           HB1      GLU  51  37.334  18.372  19.194
  424    HG2  GLU  51           HG2      GLU  51  34.401  18.641  19.908
  425    HG3  GLU  51           HG1      GLU  51  35.392  17.248  20.339
  426    H    ASP  52           HN       ASP  52  38.487  21.103  18.365
  427    HA   ASP  52           HA       ASP  52  38.725  21.974  15.741
  428    HB2  ASP  52           HB2      ASP  52  40.817  20.708  17.528
  429    HB3  ASP  52           HB1      ASP  52  41.201  21.481  15.989
  430    H    GLY  53           HN       GLY  53  39.516  21.016  13.787
  431    HA2  GLY  53           HA3      GLY  53  40.086  19.213  12.335
  432    HA3  GLY  53           HA2      GLY  53  39.898  18.093  13.685
  433    H    ARG  54           HN       ARG  54  38.708  16.964  11.782
  434    HA   ARG  54           HA       ARG  54  36.687  16.211  10.881
  435    HB2  ARG  54           HB2      ARG  54  36.121  16.137  13.340
  436    HB3  ARG  54           HB1      ARG  54  35.411  17.741  13.168
  437    HG2  ARG  54           HG2      ARG  54  33.738  16.957  11.663
  438    HG3  ARG  54           HG1      ARG  54  34.567  15.417  11.429
  439    HD2  ARG  54           HD2      ARG  54  32.615  15.217  12.965
  440    HD3  ARG  54           HD1      ARG  54  34.136  14.788  13.749
  441    HE   ARG  54           HE       ARG  54  33.467  17.591  14.123
  442   HH11  ARG  54          HH11      ARG  54  32.880  18.191  16.222
  443   HH12  ARG  54          HH12      ARG  54  32.437  16.969  17.366
  444   HH21  ARG  54          HH21      ARG  54  32.910  14.347  15.147
  445   HH22  ARG  54          HH22      ARG  54  32.455  14.792  16.758
  446    H    THR  55           HN       THR  55  34.898  16.929   9.558
  447    HA   THR  55           HA       THR  55  34.859  19.881   9.021
  448    HB   THR  55           HB       THR  55  34.547  17.574   7.067
  449    HG1  THR  55           HG1      THR  55  36.692  18.068   7.869
  450   HG21  THR  55          HG21      THR  55  34.824  19.616   5.447
  451   HG22  THR  55          HG22      THR  55  34.250  20.560   6.822
  452   HG23  THR  55          HG23      THR  55  33.241  19.280   6.143
  453    H    LEU  56           HN       LEU  56  32.689  20.365   7.720
  454    HA   LEU  56           HA       LEU  56  30.510  19.653   9.463
  455    HB2  LEU  56           HB2      LEU  56  30.682  21.048   6.790
  456    HB3  LEU  56           HB1      LEU  56  29.120  20.678   7.514
  457    HG   LEU  56           HG       LEU  56  29.853  21.885   9.588
  458   HD11  LEU  56          HD11      LEU  56  32.259  22.427   7.839
  459   HD12  LEU  56          HD12      LEU  56  32.226  21.784   9.480
  460   HD13  LEU  56          HD13      LEU  56  31.833  23.478   9.190
  461   HD21  LEU  56          HD21      LEU  56  29.773  23.326   6.930
  462   HD22  LEU  56          HD22      LEU  56  29.823  24.195   8.464
  463   HD23  LEU  56          HD23      LEU  56  28.468  23.126   8.100
  464    H    SER  57           HN       SER  57  31.399  18.607   6.155
  465    HA   SER  57           HA       SER  57  29.195  16.830   5.782
  466    HB2  SER  57           HB2      SER  57  32.042  16.650   4.745
  467    HB3  SER  57           HB1      SER  57  30.712  15.647   4.173
  468    HG   SER  57           HG       SER  57  30.805  17.385   2.821
  469    H    ASP  58           HN       ASP  58  32.482  16.193   6.981
  470    HA   ASP  58           HA       ASP  58  32.143  13.472   7.667
  471    HB2  ASP  58           HB2      ASP  58  33.810  15.640   8.968
  472    HB3  ASP  58           HB1      ASP  58  33.903  13.944   9.445
  473    H    TYR  59           HN       TYR  59  30.985  16.375   9.231
  474    HA   TYR  59           HA       TYR  59  30.288  15.094  11.747
  475    HB2  TYR  59           HB2      TYR  59  30.459  17.719  10.833
  476    HB3  TYR  59           HB1      TYR  59  28.720  17.496  10.965
  477    HD1  TYR  59           HD1      TYR  59  31.470  18.645  12.722
  478    HD2  TYR  59           HD2      TYR  59  28.093  16.036  13.233
  479    HE1  TYR  59           HE1      TYR  59  31.609  18.945  15.176
  480    HE2  TYR  59           HE2      TYR  59  28.236  16.336  15.689
  481    HH   TYR  59           HH       TYR  59  30.936  17.814  17.207
  482    H    ASN  60           HN       ASN  60  28.968  15.169   8.603
  483    HA   ASN  60           HA       ASN  60  26.973  14.313   7.698
  484    HB2  ASN  60           HB2      ASN  60  27.853  12.325   9.038
  485    HB3  ASN  60           HB1      ASN  60  26.731  12.804  10.311
  486   HD21  ASN  60          HD21      ASN  60  26.481  10.301   8.885
  487   HD22  ASN  60          HD22      ASN  60  25.041  10.354   7.989
  488    H    ILE  61           HN       ILE  61  26.647  16.809   8.832
  489    HA   ILE  61           HA       ILE  61  24.669  17.016  10.848
  490    HB   ILE  61           HB       ILE  61  26.143  18.857   9.836
  491   HG12  ILE  61          HG12      ILE  61  23.181  19.424  10.134
  492   HG13  ILE  61          HG11      ILE  61  24.321  19.240  11.467
  493   HG21  ILE  61          HG21      ILE  61  25.384  20.012   7.896
  494   HG22  ILE  61          HG22      ILE  61  23.855  19.135   7.880
  495   HG23  ILE  61          HG23      ILE  61  25.352  18.302   7.463
  496   HD11  ILE  61          HD11      ILE  61  25.671  21.120  10.501
  497   HD12  ILE  61          HD12      ILE  61  24.056  21.611  11.015
  498   HD13  ILE  61          HD13      ILE  61  24.399  21.357   9.302
  499    H    GLN  62           HN       GLN  62  22.378  17.306  10.677
  500    HA   GLN  62           HA       GLN  62  21.075  16.900   8.066
  501    HB2  GLN  62           HB2      GLN  62  21.653  14.593   9.027
  502    HB3  GLN  62           HB1      GLN  62  20.484  14.948  10.301
  503    HG2  GLN  62           HG2      GLN  62  18.742  15.329   8.575
  504    HG3  GLN  62           HG1      GLN  62  19.913  14.917   7.322
  505   HE21  GLN  62          HE21      GLN  62  19.669  12.790   6.646
  506   HE22  GLN  62          HE22      GLN  62  19.206  11.493   7.639
  507    H    LYS  63           HN       LYS  63  20.810  19.178   9.358
  508    HA   LYS  63           HA       LYS  63  18.407  19.026  11.127
  509    HB2  LYS  63           HB2      LYS  63  20.203  21.380  10.457
  510    HB3  LYS  63           HB1      LYS  63  18.905  21.377  11.648
  511    HG2  LYS  63           HG2      LYS  63  21.151  19.368  11.835
  512    HG3  LYS  63           HG1      LYS  63  21.361  20.999  12.463
  513    HD2  LYS  63           HD2      LYS  63  19.284  20.681  13.837
  514    HD3  LYS  63           HD1      LYS  63  19.237  19.002  13.298
  515    HE2  LYS  63           HE2      LYS  63  20.350  19.128  15.470
  516    HE3  LYS  63           HE1      LYS  63  21.519  18.666  14.233
  517    HZ1  LYS  63           HZ1      LYS  63  22.243  20.957  14.095
  518    HZ2  LYS  63           HZ2      LYS  63  22.388  20.391  15.690
  519    HZ3  LYS  63           HZ3      LYS  63  21.104  21.420  15.264
  520    H    GLU  64           HN       GLU  64  19.364  19.736   7.908
  521    HA   GLU  64           HA       GLU  64  18.184  20.618   6.080
  522    HB2  GLU  64           HB2      GLU  64  16.646  18.753   6.834
  523    HB3  GLU  64           HB1      GLU  64  15.737  19.961   7.740
  524    HG2  GLU  64           HG2      GLU  64  15.295  21.215   5.684
  525    HG3  GLU  64           HG1      GLU  64  16.264  20.071   4.756
  526    H    SEP  65           HN       SEP  65  19.111  22.732   7.098
  527    HA   SEP  65           HA       SEP  65  17.175  24.795   6.854
  528    HB2  SEP  65           HB1      SEP  65  17.711  23.813   9.645
  529    HB3  SEP  65           HB2      SEP  65  16.188  24.324   8.924
  530    H    TPO  66           HN       TPO  66  18.148  26.960   7.653
  531    HA   TPO  66           HA       TPO  66  20.749  27.289   6.603
  532    HB   TPO  66           HB       TPO  66  19.138  29.151   6.964
  533   HG21  TPO  66          HG21      TPO  66  18.686  30.017   9.135
  534   HG22  TPO  66          HG22      TPO  66  19.957  29.042   9.870
  535   HG23  TPO  66          HG23      TPO  66  18.486  28.270   9.279
  536    H    LEU  67           HN       LEU  67  22.807  27.450   7.602
  537    HA   LEU  67           HA       LEU  67  23.065  25.905  10.103
  538    HB2  LEU  67           HB2      LEU  67  25.005  26.981   8.054
  539    HB3  LEU  67           HB1      LEU  67  25.578  26.353   9.599
  540    HG   LEU  67           HG       LEU  67  24.481  24.202   9.157
  541   HD11  LEU  67          HD11      LEU  67  22.569  24.784   7.875
  542   HD12  LEU  67          HD12      LEU  67  23.596  23.889   6.755
  543   HD13  LEU  67          HD13      LEU  67  23.534  25.649   6.678
  544   HD21  LEU  67          HD21      LEU  67  25.991  23.424   7.478
  545   HD22  LEU  67          HD22      LEU  67  26.809  24.781   8.251
  546   HD23  LEU  67          HD23      LEU  67  26.031  24.997   6.683
  547    H    HIS  68           HN       HIS  68  22.958  26.952  12.015
  548    HA   HIS  68           HA       HIS  68  24.148  29.699  12.236
  549    HB2  HIS  68           HB2      HIS  68  21.574  29.589  12.211
  550    HB3  HIS  68           HB1      HIS  68  21.707  28.781  13.771
  551    HD1  HIS  68           HD1      HIS  68  22.442  32.073  12.072
  552    HD2  HIS  68           HD2      HIS  68  22.402  30.472  15.924
  553    HE1  HIS  68           HE1      HIS  68  22.709  34.027  13.664
  554    HE2  HIS  68           HE2      HIS  68  22.689  33.065  16.010
  555    H    LEU  69           HN       LEU  69  25.655  29.804  13.798
  556    HA   LEU  69           HA       LEU  69  25.718  27.675  15.921
  557    HB2  LEU  69           HB2      LEU  69  28.087  29.317  14.999
  558    HB3  LEU  69           HB1      LEU  69  28.093  27.813  15.917
  559    HG   LEU  69           HG       LEU  69  27.189  28.118  13.037
  560   HD11  LEU  69          HD11      LEU  69  29.680  28.279  13.522
  561   HD12  LEU  69          HD12      LEU  69  29.210  26.959  12.450
  562   HD13  LEU  69          HD13      LEU  69  29.586  26.631  14.141
  563   HD21  LEU  69          HD21      LEU  69  27.280  25.780  14.956
  564   HD22  LEU  69          HD22      LEU  69  27.275  25.547  13.208
  565   HD23  LEU  69          HD23      LEU  69  25.917  26.350  13.994
  566    H    VAL  70           HN       VAL  70  26.756  28.521  18.021
  567    HA   VAL  70           HA       VAL  70  26.347  31.452  18.402
  568    HB   VAL  70           HB       VAL  70  25.233  30.809  20.646
  569   HG11  VAL  70          HG11      VAL  70  22.995  30.500  19.488
  570   HG12  VAL  70          HG12      VAL  70  23.882  30.401  17.966
  571   HG13  VAL  70          HG13      VAL  70  23.939  31.880  18.925
  572   HG21  VAL  70          HG21      VAL  70  25.792  28.392  20.513
  573   HG22  VAL  70          HG22      VAL  70  24.771  28.246  19.084
  574   HG23  VAL  70          HG23      VAL  70  24.053  28.652  20.642
  575    H    LEU  71           HN       LEU  71  28.119  32.257  19.403
  576    HA   LEU  71           HA       LEU  71  30.120  30.449  20.518
  577    HB2  LEU  71           HB2      LEU  71  30.538  32.613  19.177
  578    HB3  LEU  71           HB1      LEU  71  30.105  33.473  20.651
  579    HG   LEU  71           HG       LEU  71  31.903  31.839  21.753
  580   HD11  LEU  71          HD11      LEU  71  33.661  31.152  20.300
  581   HD12  LEU  71          HD12      LEU  71  33.040  32.118  18.963
  582   HD13  LEU  71          HD13      LEU  71  32.180  30.671  19.478
  583   HD21  LEU  71          HD21      LEU  71  32.216  34.205  21.851
  584   HD22  LEU  71          HD22      LEU  71  32.455  34.321  20.108
  585   HD23  LEU  71          HD23      LEU  71  33.688  33.570  21.118
  586    H    ARG  72           HN       ARG  72  30.796  30.423  22.758
  587    HA   ARG  72           HA       ARG  72  28.840  31.649  24.676
  588    HB2  ARG  72           HB2      ARG  72  28.962  29.043  24.373
  589    HB3  ARG  72           HB1      ARG  72  30.485  29.177  25.245
  590    HG2  ARG  72           HG2      ARG  72  29.102  28.921  27.079
  591    HG3  ARG  72           HG1      ARG  72  28.930  30.664  26.900
  592    HD2  ARG  72           HD2      ARG  72  27.067  28.612  25.659
  593    HD3  ARG  72           HD1      ARG  72  26.739  29.495  27.148
  594    HE   ARG  72           HE       ARG  72  27.207  31.531  25.391
  595   HH11  ARG  72          HH11      ARG  72  25.652  32.432  24.022
  596   HH12  ARG  72          HH12      ARG  72  24.302  31.471  23.514
  597   HH21  ARG  72          HH21      ARG  72  25.304  28.657  25.272
  598   HH22  ARG  72          HH22      ARG  72  24.106  29.335  24.222
  599    H    LEU  73           HN       LEU  73  29.926  32.160  26.829
  600    HA   LEU  73           HA       LEU  73  32.809  32.906  26.422
  601    HB2  LEU  73           HB2      LEU  73  30.823  34.246  28.274
  602    HB3  LEU  73           HB1      LEU  73  32.425  34.821  27.816
  603    HG   LEU  73           HG       LEU  73  30.080  34.478  25.922
  604   HD11  LEU  73          HD11      LEU  73  31.390  37.013  26.948
  605   HD12  LEU  73          HD12      LEU  73  29.875  36.361  27.571
  606   HD13  LEU  73          HD13      LEU  73  29.978  36.903  25.896
  607   HD21  LEU  73          HD21      LEU  73  32.950  35.367  25.570
  608   HD22  LEU  73          HD22      LEU  73  31.691  35.898  24.455
  609   HD23  LEU  73          HD23      LEU  73  32.044  34.182  24.630
  610    H    ARG  74           HN       ARG  74  34.241  32.277  28.019
  611    HA   ARG  74           HA       ARG  74  33.242  30.334  29.997
  612    HB2  ARG  74           HB2      ARG  74  35.975  31.232  29.082
  613    HB3  ARG  74           HB1      ARG  74  35.795  30.253  30.536
  614    HG2  ARG  74           HG2      ARG  74  34.432  29.361  27.999
  615    HG3  ARG  74           HG1      ARG  74  36.162  29.087  28.183
  616    HD2  ARG  74           HD2      ARG  74  35.874  27.661  30.024
  617    HD3  ARG  74           HD1      ARG  74  34.265  28.281  30.385
  618    HE   ARG  74           HE       ARG  74  34.913  26.213  28.412
  619   HH11  ARG  74          HH11      ARG  74  33.124  25.270  27.403
  620   HH12  ARG  74          HH12      ARG  74  31.569  26.019  27.551
  621   HH21  ARG  74          HH21      ARG  74  32.720  28.637  29.511
  622   HH22  ARG  74          HH22      ARG  74  31.340  27.924  28.744
  623    H    GLY  75           HN       GLY  75  33.170  30.698  32.205
  624    HA2  GLY  75           HA3      GLY  75  34.475  33.024  33.405
  625    HA3  GLY  75           HA2      GLY  75  32.717  33.159  33.332
  626    H    GLY  76           HN       GLY  76  33.665  29.929  33.569
  627    HA2  GLY  76           HA3      GLY  76  32.435  29.525  36.098
  628    HA3  GLY  76           HA2      GLY  76  33.527  28.377  35.323
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1  29.222  28.963   2.822
    2    H2   MET   1           HT2      MET   1  28.326  28.140   1.636
    3    H3   MET   1           HT3      MET   1  28.114  27.764   3.279
    4    HA   MET   1           HA       MET   1  27.175  30.108   1.771
    5    HB2  MET   1           HB2      MET   1  25.967  28.260   3.853
    6    HB3  MET   1           HB1      MET   1  25.125  29.619   3.107
    7    HG2  MET   1           HG2      MET   1  25.334  28.611   0.908
    8    HG3  MET   1           HG1      MET   1  26.337  27.314   1.557
    9    HE1  MET   1           HE1      MET   1  23.005  28.795   0.896
   10    HE2  MET   1           HE2      MET   1  22.897  29.091   2.630
   11    HE3  MET   1           HE3      MET   1  21.823  27.917   1.875
   12    H    GLN   2           HN       GLN   2  25.975  31.657   3.428
   13    HA   GLN   2           HA       GLN   2  28.059  32.715   5.179
   14    HB2  GLN   2           HB2      GLN   2  25.210  33.569   4.604
   15    HB3  GLN   2           HB1      GLN   2  26.266  34.430   5.723
   16    HG2  GLN   2           HG2      GLN   2  27.854  34.910   3.972
   17    HG3  GLN   2           HG1      GLN   2  27.001  33.858   2.841
   18   HE21  GLN   2          HE21      GLN   2  27.510  36.791   2.557
   19   HE22  GLN   2          HE22      GLN   2  25.980  37.515   2.425
   20    H    ILE   3           HN       ILE   3  28.276  31.010   6.761
   21    HA   ILE   3           HA       ILE   3  26.072  29.969   8.263
   22    HB   ILE   3           HB       ILE   3  29.016  30.213   8.950
   23   HG12  ILE   3          HG12      ILE   3  27.394  27.801   8.092
   24   HG13  ILE   3          HG11      ILE   3  28.300  28.803   6.961
   25   HG21  ILE   3          HG21      ILE   3  28.402  28.335  10.587
   26   HG22  ILE   3          HG22      ILE   3  26.726  28.825  10.356
   27   HG23  ILE   3          HG23      ILE   3  27.890  29.962  11.036
   28   HD11  ILE   3          HD11      ILE   3  30.382  28.282   8.035
   29   HD12  ILE   3          HD12      ILE   3  29.537  26.752   7.801
   30   HD13  ILE   3          HD13      ILE   3  29.557  27.514   9.391
   31    H    PHE   4           HN       PHE   4  25.013  30.779  10.029
   32    HA   PHE   4           HA       PHE   4  25.472  33.574  10.748
   33    HB2  PHE   4           HB2      PHE   4  23.544  31.466  11.751
   34    HB3  PHE   4           HB1      PHE   4  23.582  33.114  12.381
   35    HD1  PHE   4           HD1      PHE   4  22.776  30.997   9.487
   36    HD2  PHE   4           HD2      PHE   4  22.952  35.024  10.973
   37    HE1  PHE   4           HE1      PHE   4  21.404  31.765   7.569
   38    HE2  PHE   4           HE2      PHE   4  21.579  35.791   9.055
   39    HZ   PHE   4           HZ       PHE   4  20.807  34.162   7.353
   40    H    VAL   5           HN       VAL   5  26.491  34.334  12.549
   41    HA   VAL   5           HA       VAL   5  27.239  32.437  14.726
   42    HB   VAL   5           HB       VAL   5  29.199  34.271  13.306
   43   HG11  VAL   5          HG11      VAL   5  29.744  34.161  15.646
   44   HG12  VAL   5          HG12      VAL   5  30.840  33.058  14.814
   45   HG13  VAL   5          HG13      VAL   5  29.449  32.422  15.692
   46   HG21  VAL   5          HG21      VAL   5  30.319  32.016  12.830
   47   HG22  VAL   5          HG22      VAL   5  28.846  32.352  11.922
   48   HG23  VAL   5          HG23      VAL   5  28.796  31.271  13.315
   49    H    LYS   6           HN       LYS   6  26.024  33.458  16.290
   50    HA   LYS   6           HA       LYS   6  26.486  36.400  16.718
   51    HB2  LYS   6           HB2      LYS   6  24.268  36.273  17.950
   52    HB3  LYS   6           HB1      LYS   6  24.173  36.042  16.204
   53    HG2  LYS   6           HG2      LYS   6  23.927  33.687  16.419
   54    HG3  LYS   6           HG1      LYS   6  24.436  33.709  18.107
   55    HD2  LYS   6           HD2      LYS   6  22.026  33.446  18.043
   56    HD3  LYS   6           HD1      LYS   6  22.389  35.064  18.643
   57    HE2  LYS   6           HE2      LYS   6  21.860  36.067  16.540
   58    HE3  LYS   6           HE1      LYS   6  21.843  34.505  15.720
   59    HZ1  LYS   6           HZ1      LYS   6  19.654  34.603  16.080
   60    HZ2  LYS   6           HZ2      LYS   6  19.791  35.788  17.290
   61    HZ3  LYS   6           HZ3      LYS   6  20.029  34.149  17.671
   62    H    THR   7           HN       THR   7  26.762  37.093  18.895
   63    HA   THR   7           HA       THR   7  27.694  34.938  20.761
   64    HB   THR   7           HB       THR   7  29.063  36.662  21.805
   65    HG1  THR   7           HG1      THR   7  27.722  38.426  21.560
   66   HG21  THR   7          HG21      THR   7  29.211  36.662  18.781
   67   HG22  THR   7          HG22      THR   7  30.072  35.591  19.884
   68   HG23  THR   7          HG23      THR   7  30.476  37.307  19.828
   69    H    LEU   8           HN       LEU   8  27.549  36.079  23.169
   70    HA   LEU   8           HA       LEU   8  24.687  36.197  23.687
   71    HB2  LEU   8           HB2      LEU   8  26.946  36.831  25.604
   72    HB3  LEU   8           HB1      LEU   8  25.305  36.341  26.017
   73    HG   LEU   8           HG       LEU   8  27.298  34.633  24.494
   74   HD11  LEU   8          HD11      LEU   8  26.430  34.702  27.390
   75   HD12  LEU   8          HD12      LEU   8  28.069  34.745  26.741
   76   HD13  LEU   8          HD13      LEU   8  27.128  33.255  26.662
   77   HD21  LEU   8          HD21      LEU   8  24.443  34.237  25.405
   78   HD22  LEU   8          HD22      LEU   8  25.515  32.855  25.174
   79   HD23  LEU   8          HD23      LEU   8  25.148  33.920  23.819
   80    H    THR   9           HN       THR   9  27.093  38.502  22.903
   81    HA   THR   9           HA       THR   9  25.744  40.759  24.227
   82    HB   THR   9           HB       THR   9  27.475  42.124  23.114
   83    HG1  THR   9           HG1      THR   9  28.709  39.843  22.121
   84   HG21  THR   9          HG21      THR   9  29.431  41.116  24.206
   85   HG22  THR   9          HG22      THR   9  28.582  39.574  24.322
   86   HG23  THR   9          HG23      THR   9  28.007  40.967  25.238
   87    H    GLY  10           HN       GLY  10  25.129  38.948  21.503
   88    HA2  GLY  10           HA3      GLY  10  23.345  39.372  19.962
   89    HA3  GLY  10           HA2      GLY  10  23.407  41.084  20.386
   90    H    LYS  11           HN       LYS  11  26.498  40.702  20.056
   91    HA   LYS  11           HA       LYS  11  26.799  41.944  17.560
   92    HB2  LYS  11           HB2      LYS  11  28.689  40.090  19.035
   93    HB3  LYS  11           HB1      LYS  11  29.155  41.011  17.606
   94    HG2  LYS  11           HG2      LYS  11  28.564  43.110  18.756
   95    HG3  LYS  11           HG1      LYS  11  28.089  42.194  20.186
   96    HD2  LYS  11           HD2      LYS  11  30.383  41.316  20.395
   97    HD3  LYS  11           HD1      LYS  11  30.864  42.230  18.964
   98    HE2  LYS  11           HE2      LYS  11  30.279  44.336  20.105
   99    HE3  LYS  11           HE1      LYS  11  29.790  43.427  21.536
  100    HZ1  LYS  11           HZ1      LYS  11  32.058  42.539  21.661
  101    HZ2  LYS  11           HZ2      LYS  11  32.023  44.231  21.807
  102    HZ3  LYS  11           HZ3      LYS  11  32.509  43.511  20.347
  103    H    THR  12           HN       THR  12  26.069  41.175  15.632
  104    HA   THR  12           HA       THR  12  25.976  38.246  15.160
  105    HB   THR  12           HB       THR  12  24.988  40.554  13.456
  106    HG1  THR  12           HG1      THR  12  23.612  38.725  15.132
  107   HG21  THR  12          HG21      THR  12  24.774  37.548  13.221
  108   HG22  THR  12          HG22      THR  12  25.357  38.696  12.017
  109   HG23  THR  12          HG23      THR  12  23.640  38.634  12.416
  110    H    ILE  13           HN       ILE  13  27.203  37.223  13.600
  111    HA   ILE  13           HA       ILE  13  29.026  38.833  11.891
  112    HB   ILE  13           HB       ILE  13  30.004  36.501  13.570
  113   HG12  ILE  13          HG12      ILE  13  30.376  39.485  13.997
  114   HG13  ILE  13          HG11      ILE  13  29.457  38.398  15.038
  115   HG21  ILE  13          HG21      ILE  13  31.135  37.040  11.368
  116   HG22  ILE  13          HG22      ILE  13  32.187  37.144  12.779
  117   HG23  ILE  13          HG23      ILE  13  31.548  38.615  12.045
  118   HD11  ILE  13          HD11      ILE  13  31.602  38.641  16.070
  119   HD12  ILE  13          HD12      ILE  13  32.439  38.392  14.538
  120   HD13  ILE  13          HD13      ILE  13  31.599  37.049  15.313
  121    H    THR  14           HN       THR  14  29.345  37.825   9.884
  122    HA   THR  14           HA       THR  14  28.185  35.073   9.552
  123    HB   THR  14           HB       THR  14  27.386  35.796   7.332
  124    HG1  THR  14           HG1      THR  14  29.046  37.785   7.780
  125   HG21  THR  14          HG21      THR  14  25.594  37.316   8.113
  126   HG22  THR  14          HG22      THR  14  26.497  37.598   9.601
  127   HG23  THR  14          HG23      THR  14  25.863  35.991   9.245
  128    H    LEU  15           HN       LEU  15  29.464  33.665   8.454
  129    HA   LEU  15           HA       LEU  15  31.976  34.727   7.177
  130    HB2  LEU  15           HB2      LEU  15  31.606  31.984   8.412
  131    HB3  LEU  15           HB1      LEU  15  33.114  32.744   7.905
  132    HG   LEU  15           HG       LEU  15  31.325  33.741  10.146
  133   HD11  LEU  15          HD11      LEU  15  32.361  31.756  10.937
  134   HD12  LEU  15          HD12      LEU  15  33.396  33.062  11.519
  135   HD13  LEU  15          HD13      LEU  15  33.875  32.118  10.108
  136   HD21  LEU  15          HD21      LEU  15  33.490  35.100  10.607
  137   HD22  LEU  15          HD22      LEU  15  32.461  35.630   9.278
  138   HD23  LEU  15          HD23      LEU  15  33.925  34.708   8.944
  139    H    GLU  16           HN       GLU  16  31.794  34.523   4.995
  140    HA   GLU  16           HA       GLU  16  29.980  32.474   3.861
  141    HB2  GLU  16           HB2      GLU  16  29.977  34.809   2.982
  142    HB3  GLU  16           HB1      GLU  16  31.646  34.584   2.458
  143    HG2  GLU  16           HG2      GLU  16  30.967  32.737   0.996
  144    HG3  GLU  16           HG1      GLU  16  29.300  32.889   1.553
  145    H    VAL  17           HN       VAL  17  30.847  30.482   3.624
  146    HA   VAL  17           HA       VAL  17  33.269  30.142   2.029
  147    HB   VAL  17           HB       VAL  17  34.360  30.468   4.148
  148   HG11  VAL  17          HG11      VAL  17  32.471  30.206   5.641
  149   HG12  VAL  17          HG12      VAL  17  33.710  29.049   6.122
  150   HG13  VAL  17          HG13      VAL  17  32.305  28.507   5.203
  151   HG21  VAL  17          HG21      VAL  17  35.007  28.453   2.704
  152   HG22  VAL  17          HG22      VAL  17  34.112  27.467   3.860
  153   HG23  VAL  17          HG23      VAL  17  35.514  28.392   4.392
  154    H    GLU  18           HN       GLU  18  33.450  27.962   1.261
  155    HA   GLU  18           HA       GLU  18  31.136  26.577   0.693
  156    HB2  GLU  18           HB2      GLU  18  33.878  25.388   1.184
  157    HB3  GLU  18           HB1      GLU  18  32.562  24.567   0.345
  158    HG2  GLU  18           HG2      GLU  18  33.697  27.243  -0.516
  159    HG3  GLU  18           HG1      GLU  18  34.205  25.695  -1.196
  160    HA   PRO  19           HA       PRO  19  29.552  25.208   4.711
  161    HB2  PRO  19           HB2      PRO  19  28.808  22.830   3.019
  162    HB3  PRO  19           HB1      PRO  19  27.842  23.684   4.241
  163    HG2  PRO  19           HG2      PRO  19  27.464  24.123   1.641
  164    HG3  PRO  19           HG1      PRO  19  27.350  25.438   2.824
  165    HD2  PRO  19           HD2      PRO  19  29.473  24.927   0.800
  166    HD3  PRO  19           HD1      PRO  19  29.009  26.452   1.588
  167    H    SER  20           HN       SER  20  31.808  23.443   2.731
  168    HA   SER  20           HA       SER  20  32.298  21.336   4.680
  169    HB2  SER  20           HB2      SER  20  34.253  20.806   3.229
  170    HB3  SER  20           HB1      SER  20  32.751  20.927   2.315
  171    HG   SER  20           HG       SER  20  33.608  22.515   1.255
  172    H    ASP  21           HN       ASP  21  32.766  24.474   5.020
  173    HA   ASP  21           HA       ASP  21  35.448  25.014   5.606
  174    HB2  ASP  21           HB2      ASP  21  33.350  26.532   5.917
  175    HB3  ASP  21           HB1      ASP  21  33.292  25.855   7.544
  176    H    THR  22           HN       THR  22  36.599  24.955   7.738
  177    HA   THR  22           HA       THR  22  36.062  22.374   9.118
  178    HB   THR  22           HB       THR  22  38.324  22.496   9.907
  179    HG1  THR  22           HG1      THR  22  39.550  24.380   9.541
  180   HG21  THR  22          HG21      THR  22  39.524  22.477   7.848
  181   HG22  THR  22          HG22      THR  22  38.415  23.633   7.108
  182   HG23  THR  22          HG23      THR  22  37.879  21.986   7.441
  183    H    ILE  23           HN       ILE  23  36.701  22.515  11.609
  184    HA   ILE  23           HA       ILE  23  34.949  24.597  12.759
  185    HB   ILE  23           HB       ILE  23  36.597  22.542  14.252
  186   HG12  ILE  23          HG12      ILE  23  35.320  21.281  12.633
  187   HG13  ILE  23          HG11      ILE  23  34.492  21.144  14.183
  188   HG21  ILE  23          HG21      ILE  23  35.461  24.476  15.449
  189   HG22  ILE  23          HG22      ILE  23  34.993  22.867  16.000
  190   HG23  ILE  23          HG23      ILE  23  33.924  23.781  14.936
  191   HD11  ILE  23          HD11      ILE  23  33.731  22.834  11.800
  192   HD12  ILE  23          HD12      ILE  23  33.088  23.167  13.408
  193   HD13  ILE  23          HD13      ILE  23  32.766  21.618  12.634
  194    H    GLU  24           HN       GLU  24  38.356  23.640  12.755
  195    HA   GLU  24           HA       GLU  24  39.276  25.659  14.572
  196    HB2  GLU  24           HB2      GLU  24  41.500  25.239  13.294
  197    HB3  GLU  24           HB1      GLU  24  40.792  23.890  14.181
  198    HG2  GLU  24           HG2      GLU  24  39.913  22.912  12.195
  199    HG3  GLU  24           HG1      GLU  24  40.194  24.381  11.260
  200    H    ASN  25           HN       ASN  25  38.493  25.669  11.148
  201    HA   ASN  25           HA       ASN  25  39.880  28.111  10.499
  202    HB2  ASN  25           HB2      ASN  25  39.135  26.623   8.713
  203    HB3  ASN  25           HB1      ASN  25  37.455  26.800   9.224
  204   HD21  ASN  25          HD21      ASN  25  36.296  28.519   8.302
  205   HD22  ASN  25          HD22      ASN  25  36.998  29.786   7.417
  206    H    VAL  26           HN       VAL  26  36.498  27.376  11.412
  207    HA   VAL  26           HA       VAL  26  35.530  30.046  11.386
  208    HB   VAL  26           HB       VAL  26  34.824  27.835  13.349
  209   HG11  VAL  26          HG11      VAL  26  32.593  29.078  13.288
  210   HG12  VAL  26          HG12      VAL  26  33.460  30.396  12.501
  211   HG13  VAL  26          HG13      VAL  26  33.910  29.894  14.132
  212   HG21  VAL  26          HG21      VAL  26  33.175  27.121  11.774
  213   HG22  VAL  26          HG22      VAL  26  34.672  27.292  10.859
  214   HG23  VAL  26          HG23      VAL  26  33.430  28.541  10.758
  215    H    LYS  27           HN       LYS  27  36.541  28.208  14.263
  216    HA   LYS  27           HA       LYS  27  36.758  30.173  16.166
  217    HB2  LYS  27           HB2      LYS  27  38.719  27.933  15.588
  218    HB3  LYS  27           HB1      LYS  27  38.722  28.880  17.076
  219    HG2  LYS  27           HG2      LYS  27  36.323  28.207  17.425
  220    HG3  LYS  27           HG1      LYS  27  36.479  27.130  16.039
  221    HD2  LYS  27           HD2      LYS  27  38.286  25.909  17.144
  222    HD3  LYS  27           HD1      LYS  27  38.229  27.019  18.513
  223    HE2  LYS  27           HE2      LYS  27  35.916  26.324  18.992
  224    HE3  LYS  27           HE1      LYS  27  35.954  25.225  17.614
  225    HZ1  LYS  27           HZ1      LYS  27  36.584  24.490  20.085
  226    HZ2  LYS  27           HZ2      LYS  27  38.121  24.950  19.530
  227    HZ3  LYS  27           HZ3      LYS  27  37.239  23.755  18.704
  228    H    ALA  28           HN       ALA  28  38.969  29.632  13.475
  229    HA   ALA  28           HA       ALA  28  40.983  31.509  14.342
  230    HB1  ALA  28           HB1      ALA  28  40.422  30.820  11.456
  231    HB2  ALA  28           HB2      ALA  28  41.161  29.651  12.550
  232    HB3  ALA  28           HB3      ALA  28  41.971  31.182  12.219
  233    H    LYS  29           HN       LYS  29  38.489  31.802  11.776
  234    HA   LYS  29           HA       LYS  29  38.851  34.495  11.143
  235    HB2  LYS  29           HB2      LYS  29  36.369  32.786  11.262
  236    HB3  LYS  29           HB1      LYS  29  36.284  34.474  10.755
  237    HG2  LYS  29           HG2      LYS  29  37.596  34.111   8.843
  238    HG3  LYS  29           HG1      LYS  29  38.321  32.641   9.493
  239    HD2  LYS  29           HD2      LYS  29  36.130  31.506   9.319
  240    HD3  LYS  29           HD1      LYS  29  35.446  32.961   8.593
  241    HE2  LYS  29           HE2      LYS  29  37.797  31.414   7.463
  242    HE3  LYS  29           HE1      LYS  29  36.137  31.283   6.881
  243    HZ1  LYS  29           HZ1      LYS  29  36.187  33.694   6.452
  244    HZ2  LYS  29           HZ2      LYS  29  37.325  32.836   5.526
  245    HZ3  LYS  29           HZ3      LYS  29  37.826  33.724   6.884
  246    H    ILE  30           HN       ILE  30  37.363  33.122  13.995
  247    HA   ILE  30           HA       ILE  30  36.321  35.700  14.936
  248    HB   ILE  30           HB       ILE  30  36.757  33.160  16.531
  249   HG12  ILE  30          HG12      ILE  30  35.424  32.545  14.614
  250   HG13  ILE  30          HG11      ILE  30  34.328  32.711  15.979
  251   HG21  ILE  30          HG21      ILE  30  36.226  35.412  17.661
  252   HG22  ILE  30          HG22      ILE  30  35.154  34.069  18.044
  253   HG23  ILE  30          HG23      ILE  30  34.647  35.299  16.888
  254   HD11  ILE  30          HD11      ILE  30  33.224  33.872  14.254
  255   HD12  ILE  30          HD12      ILE  30  34.722  34.577  13.646
  256   HD13  ILE  30          HD13      ILE  30  34.021  35.160  15.156
  257    H    GLN  31           HN       GLN  31  38.783  33.443  16.155
  258    HA   GLN  31           HA       GLN  31  40.028  34.841  18.124
  259    HB2  GLN  31           HB2      GLN  31  40.828  32.675  17.399
  260    HB3  GLN  31           HB1      GLN  31  41.358  33.335  15.857
  261    HG2  GLN  31           HG2      GLN  31  42.425  34.535  18.392
  262    HG3  GLN  31           HG1      GLN  31  43.099  33.008  17.830
  263   HE21  GLN  31          HE21      GLN  31  44.237  35.882  17.870
  264   HE22  GLN  31          HE22      GLN  31  44.769  36.130  16.277
  265    H    ASP  32           HN       ASP  32  40.819  35.308  14.687
  266    HA   ASP  32           HA       ASP  32  42.626  37.512  15.206
  267    HB2  ASP  32           HB2      ASP  32  41.239  36.692  12.638
  268    HB3  ASP  32           HB1      ASP  32  42.569  37.845  12.752
  269    H    LYS  33           HN       LYS  33  39.363  37.467  13.738
  270    HA   LYS  33           HA       LYS  33  39.077  40.266  13.529
  271    HB2  LYS  33           HB2      LYS  33  36.901  38.249  14.026
  272    HB3  LYS  33           HB1      LYS  33  36.671  39.857  13.365
  273    HG2  LYS  33           HG2      LYS  33  38.564  37.933  12.016
  274    HG3  LYS  33           HG1      LYS  33  36.833  37.801  11.727
  275    HD2  LYS  33           HD2      LYS  33  38.182  40.476  11.452
  276    HD3  LYS  33           HD1      LYS  33  38.315  39.305  10.149
  277    HE2  LYS  33           HE2      LYS  33  35.723  40.367  11.320
  278    HE3  LYS  33           HE1      LYS  33  36.402  40.784   9.750
  279    HZ1  LYS  33           HZ1      LYS  33  36.373  38.213   9.439
  280    HZ2  LYS  33           HZ2      LYS  33  34.963  39.126   9.179
  281    HZ3  LYS  33           HZ3      LYS  33  35.171  38.272  10.633
  282    H    GLU  34           HN       GLU  34  38.105  38.157  16.242
  283    HA   GLU  34           HA       GLU  34  37.247  40.516  17.790
  284    HB2  GLU  34           HB2      GLU  34  37.470  37.678  18.816
  285    HB3  GLU  34           HB1      GLU  34  36.428  38.975  19.401
  286    HG2  GLU  34           HG2      GLU  34  36.211  37.571  16.724
  287    HG3  GLU  34           HG1      GLU  34  35.093  37.424  18.080
  288    H    GLY  35           HN       GLY  35  39.967  38.287  17.617
  289    HA2  GLY  35           HA3      GLY  35  42.148  38.686  18.458
  290    HA3  GLY  35           HA2      GLY  35  41.540  40.100  19.321
  291    H    ILE  36           HN       ILE  36  39.574  37.400  19.759
  292    HA   ILE  36           HA       ILE  36  40.465  37.114  22.540
  293    HB   ILE  36           HB       ILE  36  38.153  35.846  21.068
  294   HG12  ILE  36          HG12      ILE  36  38.297  38.343  22.788
  295   HG13  ILE  36          HG11      ILE  36  38.076  38.319  21.039
  296   HG21  ILE  36          HG21      ILE  36  38.895  34.753  23.209
  297   HG22  ILE  36          HG22      ILE  36  37.269  35.423  23.284
  298   HG23  ILE  36          HG23      ILE  36  38.612  36.287  24.027
  299   HD11  ILE  36          HD11      ILE  36  36.020  36.934  21.386
  300   HD12  ILE  36          HD12      ILE  36  35.905  38.559  22.060
  301   HD13  ILE  36          HD13      ILE  36  36.208  37.184  23.120
  302    HA   PRO  37           HA       PRO  37  42.695  33.383  21.339
  303    HB2  PRO  37           HB2      PRO  37  43.291  32.374  23.797
  304    HB3  PRO  37           HB1      PRO  37  44.092  33.817  23.138
  305    HG2  PRO  37           HG2      PRO  37  41.833  33.640  25.086
  306    HG3  PRO  37           HG1      PRO  37  43.265  34.682  25.121
  307    HD2  PRO  37           HD2      PRO  37  40.823  35.563  24.257
  308    HD3  PRO  37           HD1      PRO  37  42.352  36.216  23.631
  309    HA   PRO  38           HA       PRO  38  39.120  30.543  21.111
  310    HB2  PRO  38           HB2      PRO  38  41.449  28.700  20.716
  311    HB3  PRO  38           HB1      PRO  38  39.873  28.703  19.892
  312    HG2  PRO  38           HG2      PRO  38  41.933  29.782  18.712
  313    HG3  PRO  38           HG1      PRO  38  40.378  30.616  18.666
  314    HD2  PRO  38           HD2      PRO  38  42.833  31.291  20.247
  315    HD3  PRO  38           HD1      PRO  38  41.585  32.370  19.582
  316    H    ASP  39           HN       ASP  39  41.757  30.402  23.301
  317    HA   ASP  39           HA       ASP  39  41.015  28.056  24.787
  318    HB2  ASP  39           HB2      ASP  39  42.598  30.516  25.556
  319    HB3  ASP  39           HB1      ASP  39  42.397  29.124  26.619
  320    H    GLN  40           HN       GLN  40  40.161  31.480  25.094
  321    HA   GLN  40           HA       GLN  40  38.413  30.915  27.401
  322    HB2  GLN  40           HB2      GLN  40  39.074  33.498  25.953
  323    HB3  GLN  40           HB1      GLN  40  38.160  33.362  27.454
  324    HG2  GLN  40           HG2      GLN  40  40.146  32.226  28.491
  325    HG3  GLN  40           HG1      GLN  40  41.052  32.581  27.022
  326   HE21  GLN  40          HE21      GLN  40  40.986  33.698  30.011
  327   HE22  GLN  40          HE22      GLN  40  41.099  35.373  29.761
  328    H    GLN  41           HN       GLN  41  37.926  30.237  24.325
  329    HA   GLN  41           HA       GLN  41  35.129  31.341  24.279
  330    HB2  GLN  41           HB2      GLN  41  36.934  30.830  21.896
  331    HB3  GLN  41           HB1      GLN  41  35.286  31.455  21.842
  332    HG2  GLN  41           HG2      GLN  41  35.951  33.451  23.065
  333    HG3  GLN  41           HG1      GLN  41  37.583  32.814  23.277
  334   HE21  GLN  41          HE21      GLN  41  39.070  33.095  21.555
  335   HE22  GLN  41          HE22      GLN  41  38.669  33.828  20.078
  336    H    ARG  42           HN       ARG  42  33.537  29.853  23.864
  337    HA   ARG  42           HA       ARG  42  34.328  27.110  22.974
  338    HB2  ARG  42           HB2      ARG  42  32.407  27.731  25.238
  339    HB3  ARG  42           HB1      ARG  42  32.813  26.129  24.621
  340    HG2  ARG  42           HG2      ARG  42  35.309  26.924  25.157
  341    HG3  ARG  42           HG1      ARG  42  34.481  28.008  26.273
  342    HD2  ARG  42           HD2      ARG  42  33.201  25.781  26.959
  343    HD3  ARG  42           HD1      ARG  42  34.649  25.016  26.313
  344    HE   ARG  42           HE       ARG  42  35.399  27.133  28.096
  345   HH11  ARG  42          HH11      ARG  42  36.138  26.555  30.153
  346   HH12  ARG  42          HH12      ARG  42  35.776  24.981  30.778
  347   HH21  ARG  42          HH21      ARG  42  34.020  23.977  27.963
  348   HH22  ARG  42          HH22      ARG  42  34.578  23.521  29.538
  349    H    LEU  43           HN       LEU  43  32.994  26.426  21.326
  350    HA   LEU  43           HA       LEU  43  30.784  28.216  20.563
  351    HB2  LEU  43           HB2      LEU  43  32.147  25.845  19.270
  352    HB3  LEU  43           HB1      LEU  43  30.667  26.555  18.597
  353    HG   LEU  43           HG       LEU  43  31.758  28.710  18.352
  354   HD11  LEU  43          HD11      LEU  43  33.996  27.342  19.851
  355   HD12  LEU  43          HD12      LEU  43  33.211  28.880  20.216
  356   HD13  LEU  43          HD13      LEU  43  34.304  28.753  18.838
  357   HD21  LEU  43          HD21      LEU  43  33.354  26.343  17.351
  358   HD22  LEU  43          HD22      LEU  43  33.651  27.994  16.818
  359   HD23  LEU  43          HD23      LEU  43  32.095  27.233  16.495
  360    H    ILE  44           HN       ILE  44  28.625  27.581  20.466
  361    HA   ILE  44           HA       ILE  44  27.902  24.947  21.725
  362    HB   ILE  44           HB       ILE  44  26.433  27.601  21.940
  363   HG12  ILE  44          HG12      ILE  44  28.458  27.654  23.294
  364   HG13  ILE  44          HG11      ILE  44  27.066  27.468  24.354
  365   HG21  ILE  44          HG21      ILE  44  25.912  24.869  23.175
  366   HG22  ILE  44          HG22      ILE  44  24.902  25.685  21.981
  367   HG23  ILE  44          HG23      ILE  44  25.045  26.341  23.615
  368   HD11  ILE  44          HD11      ILE  44  29.213  25.495  23.681
  369   HD12  ILE  44          HD12      ILE  44  27.608  24.871  24.047
  370   HD13  ILE  44          HD13      ILE  44  28.466  25.847  25.235
  371    H    PHE  45           HN       PHE  45  26.484  23.723  20.458
  372    HA   PHE  45           HA       PHE  45  24.871  25.103  18.396
  373    HB2  PHE  45           HB2      PHE  45  26.779  24.713  17.072
  374    HB3  PHE  45           HB1      PHE  45  27.127  23.176  17.857
  375    HD1  PHE  45           HD1      PHE  45  24.494  24.856  15.783
  376    HD2  PHE  45           HD2      PHE  45  26.458  21.185  16.820
  377    HE1  PHE  45           HE1      PHE  45  23.214  23.676  14.016
  378    HE2  PHE  45           HE2      PHE  45  25.180  20.000  15.052
  379    HZ   PHE  45           HZ       PHE  45  23.556  21.247  13.651
  380    H    ALA  46           HN       ALA  46  22.889  24.273  18.553
  381    HA   ALA  46           HA       ALA  46  21.134  22.810  19.059
  382    HB1  ALA  46           HB1      ALA  46  22.162  21.851  16.954
  383    HB2  ALA  46           HB2      ALA  46  21.263  20.697  17.937
  384    HB3  ALA  46           HB3      ALA  46  23.024  20.711  17.985
  385    H    GLY  47           HN       GLY  47  23.352  23.082  21.209
  386    HA2  GLY  47           HA3      GLY  47  23.196  22.213  23.431
  387    HA3  GLY  47           HA2      GLY  47  22.369  20.788  22.809
  388    H    LYS  48           HN       LYS  48  24.929  21.242  20.769
  389    HA   LYS  48           HA       LYS  48  26.797  19.599  22.447
  390    HB2  LYS  48           HB2      LYS  48  26.170  19.295  19.519
  391    HB3  LYS  48           HB1      LYS  48  27.402  18.386  20.385
  392    HG2  LYS  48           HG2      LYS  48  25.665  17.469  21.882
  393    HG3  LYS  48           HG1      LYS  48  24.432  18.371  21.001
  394    HD2  LYS  48           HD2      LYS  48  25.015  17.154  18.933
  395    HD3  LYS  48           HD1      LYS  48  26.243  16.246  19.816
  396    HE2  LYS  48           HE2      LYS  48  24.507  15.323  21.300
  397    HE3  LYS  48           HE1      LYS  48  23.274  16.239  20.436
  398    HZ1  LYS  48           HZ1      LYS  48  23.214  14.151  19.459
  399    HZ2  LYS  48           HZ2      LYS  48  24.904  13.975  19.470
  400    HZ3  LYS  48           HZ3      LYS  48  24.167  15.050  18.380
  401    H    GLN  49           HN       GLN  49  29.064  19.981  22.012
  402    HA   GLN  49           HA       GLN  49  29.587  22.632  20.843
  403    HB2  GLN  49           HB2      GLN  49  31.373  20.819  22.425
  404    HB3  GLN  49           HB1      GLN  49  31.751  22.468  21.957
  405    HG2  GLN  49           HG2      GLN  49  29.794  23.267  23.249
  406    HG3  GLN  49           HG1      GLN  49  29.458  21.608  23.748
  407   HE21  GLN  49          HE21      GLN  49  30.877  24.384  24.872
  408   HE22  GLN  49          HE22      GLN  49  32.027  23.713  25.925
  409    H    LEU  50           HN       LEU  50  31.731  22.772  19.567
  410    HA   LEU  50           HA       LEU  50  31.793  20.521  17.604
  411    HB2  LEU  50           HB2      LEU  50  33.109  23.238  17.359
  412    HB3  LEU  50           HB1      LEU  50  32.773  22.082  16.071
  413    HG   LEU  50           HG       LEU  50  30.675  23.519  17.727
  414   HD11  LEU  50          HD11      LEU  50  31.314  23.869  14.789
  415   HD12  LEU  50          HD12      LEU  50  32.015  24.893  16.043
  416   HD13  LEU  50          HD13      LEU  50  30.268  24.870  15.795
  417   HD21  LEU  50          HD21      LEU  50  30.550  21.474  15.500
  418   HD22  LEU  50          HD22      LEU  50  29.207  22.576  15.806
  419   HD23  LEU  50          HD23      LEU  50  29.724  21.450  17.059
  420    H    GLU  51           HN       GLU  51  33.661  19.321  17.317
  421    HA   GLU  51           HA       GLU  51  35.814  19.727  19.323
  422    HB2  GLU  51           HB2      GLU  51  35.365  17.476  17.335
  423    HB3  GLU  51           HB1      GLU  51  36.565  17.491  18.629
  424    HG2  GLU  51           HG2      GLU  51  34.722  17.725  20.292
  425    HG3  GLU  51           HG1      GLU  51  33.555  17.591  18.975
  426    H    ASP  52           HN       ASP  52  38.073  19.719  18.629
  427    HA   ASP  52           HA       ASP  52  38.639  21.504  16.501
  428    HB2  ASP  52           HB2      ASP  52  40.982  20.867  16.810
  429    HB3  ASP  52           HB1      ASP  52  40.199  21.017  18.383
  430    H    GLY  53           HN       GLY  53  39.690  21.059  14.432
  431    HA2  GLY  53           HA3      GLY  53  39.951  19.874  12.420
  432    HA3  GLY  53           HA2      GLY  53  39.926  18.392  13.377
  433    H    ARG  54           HN       ARG  54  38.575  17.422  11.708
  434    HA   ARG  54           HA       ARG  54  36.532  16.782  10.786
  435    HB2  ARG  54           HB2      ARG  54  35.591  18.025  13.382
  436    HB3  ARG  54           HB1      ARG  54  34.516  17.183  12.268
  437    HG2  ARG  54           HG2      ARG  54  35.767  15.133  12.492
  438    HG3  ARG  54           HG1      ARG  54  37.037  15.948  13.402
  439    HD2  ARG  54           HD2      ARG  54  35.494  16.393  15.239
  440    HD3  ARG  54           HD1      ARG  54  34.160  15.699  14.319
  441    HE   ARG  54           HE       ARG  54  34.974  13.539  14.847
  442   HH11  ARG  54          HH11      ARG  54  36.382  12.153  15.942
  443   HH12  ARG  54          HH12      ARG  54  37.848  12.784  16.615
  444   HH21  ARG  54          HH21      ARG  54  37.250  16.030  15.551
  445   HH22  ARG  54          HH22      ARG  54  38.340  14.980  16.393
  446    H    THR  55           HN       THR  55  34.672  17.600   9.595
  447    HA   THR  55           HA       THR  55  34.639  20.570   9.256
  448    HB   THR  55           HB       THR  55  34.751  18.322   7.261
  449    HG1  THR  55           HG1      THR  55  36.534  19.733   7.907
  450   HG21  THR  55          HG21      THR  55  33.381  20.985   6.850
  451   HG22  THR  55          HG22      THR  55  32.739  19.377   6.527
  452   HG23  THR  55          HG23      THR  55  34.026  20.030   5.517
  453    H    LEU  56           HN       LEU  56  32.452  21.321   8.424
  454    HA   LEU  56           HA       LEU  56  30.333  20.195  10.005
  455    HB2  LEU  56           HB2      LEU  56  30.093  22.001   7.581
  456    HB3  LEU  56           HB1      LEU  56  28.887  21.783   8.848
  457    HG   LEU  56           HG       LEU  56  31.689  22.834   9.352
  458   HD11  LEU  56          HD11      LEU  56  29.116  24.428   9.190
  459   HD12  LEU  56          HD12      LEU  56  30.275  24.317   7.866
  460   HD13  LEU  56          HD13      LEU  56  30.751  25.055   9.396
  461   HD21  LEU  56          HD21      LEU  56  30.429  23.704  11.450
  462   HD22  LEU  56          HD22      LEU  56  30.816  21.988  11.389
  463   HD23  LEU  56          HD23      LEU  56  29.181  22.533  11.021
  464    H    SER  57           HN       SER  57  30.933  20.124   6.474
  465    HA   SER  57           HA       SER  57  28.728  18.404   5.858
  466    HB2  SER  57           HB2      SER  57  29.946  17.934   3.759
  467    HB3  SER  57           HB1      SER  57  29.977  19.656   4.126
  468    HG   SER  57           HG       SER  57  32.064  19.516   4.215
  469    H    ASP  58           HN       ASP  58  32.178  17.671   6.366
  470    HA   ASP  58           HA       ASP  58  32.051  14.872   6.185
  471    HB2  ASP  58           HB2      ASP  58  34.152  16.204   6.478
  472    HB3  ASP  58           HB1      ASP  58  33.726  16.427   8.177
  473    H    TYR  59           HN       TYR  59  30.892  16.983   8.743
  474    HA   TYR  59           HA       TYR  59  30.644  14.853  10.712
  475    HB2  TYR  59           HB2      TYR  59  30.196  17.712  10.591
  476    HB3  TYR  59           HB1      TYR  59  28.742  16.963  11.235
  477    HD1  TYR  59           HD1      TYR  59  31.891  18.272  12.109
  478    HD2  TYR  59           HD2      TYR  59  29.220  15.036  13.040
  479    HE1  TYR  59           HE1      TYR  59  32.981  18.007  14.320
  480    HE2  TYR  59           HE2      TYR  59  30.313  14.771  15.250
  481    HH   TYR  59           HH       TYR  59  32.511  17.101  16.502
  482    H    ASN  60           HN       ASN  60  28.801  15.949   7.986
  483    HA   ASN  60           HA       ASN  60  26.819  15.136   7.041
  484    HB2  ASN  60           HB2      ASN  60  27.039  12.785   8.930
  485    HB3  ASN  60           HB1      ASN  60  26.331  12.830   7.316
  486   HD21  ASN  60          HD21      ASN  60  28.130  13.766   5.618
  487   HD22  ASN  60          HD22      ASN  60  29.633  12.984   5.728
  488    H    ILE  61           HN       ILE  61  26.137  17.059   8.615
  489    HA   ILE  61           HA       ILE  61  24.705  16.484  11.011
  490    HB   ILE  61           HB       ILE  61  24.127  18.703   9.023
  491   HG12  ILE  61          HG12      ILE  61  26.018  18.718  11.396
  492   HG13  ILE  61          HG11      ILE  61  26.545  18.525   9.724
  493   HG21  ILE  61          HG21      ILE  61  23.700  18.505  12.021
  494   HG22  ILE  61          HG22      ILE  61  22.429  18.372  10.808
  495   HG23  ILE  61          HG23      ILE  61  23.301  19.892  11.008
  496   HD11  ILE  61          HD11      ILE  61  26.698  20.889  10.500
  497   HD12  ILE  61          HD12      ILE  61  24.954  20.887  10.763
  498   HD13  ILE  61          HD13      ILE  61  25.600  20.696   9.133
  499    H    GLN  62           HN       GLN  62  22.438  16.182  11.350
  500    HA   GLN  62           HA       GLN  62  21.137  14.560   9.342
  501    HB2  GLN  62           HB2      GLN  62  20.155  15.755  11.947
  502    HB3  GLN  62           HB1      GLN  62  19.184  14.674  10.945
  503    HG2  GLN  62           HG2      GLN  62  20.797  12.891  11.186
  504    HG3  GLN  62           HG1      GLN  62  21.937  13.967  11.992
  505   HE21  GLN  62          HE21      GLN  62  20.700  11.481  13.101
  506   HE22  GLN  62          HE22      GLN  62  19.867  11.964  14.499
  507    H    LYS  63           HN       LYS  63  20.060  17.658  10.813
  508    HA   LYS  63           HA       LYS  63  18.237  18.114   8.565
  509    HB2  LYS  63           HB2      LYS  63  17.685  18.814  10.896
  510    HB3  LYS  63           HB1      LYS  63  19.010  19.976  10.831
  511    HG2  LYS  63           HG2      LYS  63  17.947  21.114   8.932
  512    HG3  LYS  63           HG1      LYS  63  16.637  19.931   8.942
  513    HD2  LYS  63           HD2      LYS  63  16.006  20.628  11.215
  514    HD3  LYS  63           HD1      LYS  63  17.333  21.791  11.235
  515    HE2  LYS  63           HE2      LYS  63  15.252  22.940  10.660
  516    HE3  LYS  63           HE1      LYS  63  16.328  22.930   9.263
  517    HZ1  LYS  63           HZ1      LYS  63  14.600  22.064   8.182
  518    HZ2  LYS  63           HZ2      LYS  63  13.768  21.678   9.611
  519    HZ3  LYS  63           HZ3      LYS  63  14.946  20.618   8.997
  520    H    GLU  64           HN       GLU  64  21.420  19.222   9.572
  521    HA   GLU  64           HA       GLU  64  22.920  20.725   8.553
  522    HB2  GLU  64           HB2      GLU  64  22.790  18.751   6.964
  523    HB3  GLU  64           HB1      GLU  64  21.646  19.685   6.007
  524    HG2  GLU  64           HG2      GLU  64  23.315  21.458   5.699
  525    HG3  GLU  64           HG1      GLU  64  24.453  20.588   6.727
  526    H    SEP  65           HN       SEP  65  21.321  21.364   5.642
  527    HA   SEP  65           HA       SEP  65  20.419  23.376   4.827
  528    HB2  SEP  65           HB1      SEP  65  18.910  23.150   7.450
  529    HB3  SEP  65           HB2      SEP  65  18.427  22.421   5.920
  530    H    TPO  66           HN       TPO  66  19.469  25.613   6.427
  531    HA   TPO  66           HA       TPO  66  21.779  27.187   6.621
  532    HB   TPO  66           HB       TPO  66  19.265  27.442   8.301
  533   HG21  TPO  66          HG21      TPO  66  21.045  28.843   9.167
  534   HG22  TPO  66          HG22      TPO  66  19.904  29.867   8.294
  535   HG23  TPO  66          HG23      TPO  66  21.435  29.415   7.545
  536    H    LEU  67           HN       LEU  67  23.534  26.834   7.886
  537    HA   LEU  67           HA       LEU  67  23.266  25.308  10.401
  538    HB2  LEU  67           HB2      LEU  67  25.775  26.534   9.230
  539    HB3  LEU  67           HB1      LEU  67  25.663  25.215  10.396
  540    HG   LEU  67           HG       LEU  67  24.647  25.105   7.540
  541   HD11  LEU  67          HD11      LEU  67  27.186  25.150   7.935
  542   HD12  LEU  67          HD12      LEU  67  26.553  23.776   7.028
  543   HD13  LEU  67          HD13      LEU  67  26.976  23.589   8.729
  544   HD21  LEU  67          HD21      LEU  67  23.312  23.611   8.810
  545   HD22  LEU  67          HD22      LEU  67  24.665  23.145   9.841
  546   HD23  LEU  67          HD23      LEU  67  24.597  22.588   8.171
  547    H    HIS  68           HN       HIS  68  22.815  26.369  12.246
  548    HA   HIS  68           HA       HIS  68  23.607  29.246  12.519
  549    HB2  HIS  68           HB2      HIS  68  21.911  29.336  14.295
  550    HB3  HIS  68           HB1      HIS  68  21.197  28.718  12.805
  551    HD1  HIS  68           HD1      HIS  68  20.957  26.032  12.663
  552    HD2  HIS  68           HD2      HIS  68  21.739  27.581  16.457
  553    HE1  HIS  68           HE1      HIS  68  20.399  24.196  14.318
  554    HE2  HIS  68           HE2      HIS  68  20.871  25.127  16.629
  555    H    LEU  69           HN       LEU  69  25.194  29.745  13.946
  556    HA   LEU  69           HA       LEU  69  25.931  27.750  16.071
  557    HB2  LEU  69           HB2      LEU  69  27.861  29.431  14.443
  558    HB3  LEU  69           HB1      LEU  69  28.290  28.261  15.687
  559    HG   LEU  69           HG       LEU  69  26.785  27.557  13.148
  560   HD11  LEU  69          HD11      LEU  69  28.863  26.745  12.254
  561   HD12  LEU  69          HD12      LEU  69  29.698  27.026  13.779
  562   HD13  LEU  69          HD13      LEU  69  29.161  28.393  12.804
  563   HD21  LEU  69          HD21      LEU  69  26.333  25.879  14.755
  564   HD22  LEU  69          HD22      LEU  69  27.950  25.974  15.448
  565   HD23  LEU  69          HD23      LEU  69  27.708  25.231  13.868
  566    H    VAL  70           HN       VAL  70  26.734  28.708  18.030
  567    HA   VAL  70           HA       VAL  70  26.516  31.685  18.223
  568    HB   VAL  70           HB       VAL  70  25.430  29.684  20.236
  569   HG11  VAL  70          HG11      VAL  70  25.212  32.707  20.084
  570   HG12  VAL  70          HG12      VAL  70  26.256  31.821  21.196
  571   HG13  VAL  70          HG13      VAL  70  24.504  31.679  21.329
  572   HG21  VAL  70          HG21      VAL  70  23.212  30.753  19.517
  573   HG22  VAL  70          HG22      VAL  70  23.947  29.639  18.364
  574   HG23  VAL  70          HG23      VAL  70  24.087  31.380  18.119
  575    H    LEU  71           HN       LEU  71  28.520  32.353  18.844
  576    HA   LEU  71           HA       LEU  71  30.314  30.494  20.269
  577    HB2  LEU  71           HB2      LEU  71  31.081  31.899  18.341
  578    HB3  LEU  71           HB1      LEU  71  30.810  33.334  19.323
  579    HG   LEU  71           HG       LEU  71  32.490  31.232  20.625
  580   HD11  LEU  71          HD11      LEU  71  34.521  32.147  19.300
  581   HD12  LEU  71          HD12      LEU  71  33.330  32.628  18.090
  582   HD13  LEU  71          HD13      LEU  71  33.507  30.931  18.521
  583   HD21  LEU  71          HD21      LEU  71  33.656  33.110  21.500
  584   HD22  LEU  71          HD22      LEU  71  31.977  33.638  21.435
  585   HD23  LEU  71          HD23      LEU  71  33.111  34.163  20.195
  586    H    ARG  72           HN       ARG  72  31.216  30.951  22.340
  587    HA   ARG  72           HA       ARG  72  29.867  33.124  23.906
  588    HB2  ARG  72           HB2      ARG  72  29.078  30.737  24.402
  589    HB3  ARG  72           HB1      ARG  72  30.706  30.409  24.979
  590    HG2  ARG  72           HG2      ARG  72  29.370  32.841  26.121
  591    HG3  ARG  72           HG1      ARG  72  28.712  31.286  26.614
  592    HD2  ARG  72           HD2      ARG  72  31.615  32.131  26.860
  593    HD3  ARG  72           HD1      ARG  72  30.455  32.009  28.180
  594    HE   ARG  72           HE       ARG  72  30.570  29.497  26.826
  595   HH11  ARG  72          HH11      ARG  72  31.754  27.824  27.778
  596   HH12  ARG  72          HH12      ARG  72  32.957  28.199  28.965
  597   HH21  ARG  72          HH21      ARG  72  32.418  31.620  28.815
  598   HH22  ARG  72          HH22      ARG  72  33.334  30.348  29.551
  599    H    LEU  73           HN       LEU  73  31.277  34.211  25.384
  600    HA   LEU  73           HA       LEU  73  34.187  33.498  25.136
  601    HB2  LEU  73           HB2      LEU  73  34.478  36.001  25.722
  602    HB3  LEU  73           HB1      LEU  73  33.971  35.602  24.084
  603    HG   LEU  73           HG       LEU  73  31.793  36.025  26.108
  604   HD11  LEU  73          HD11      LEU  73  33.434  38.282  24.922
  605   HD12  LEU  73          HD12      LEU  73  33.259  37.898  26.633
  606   HD13  LEU  73          HD13      LEU  73  31.872  38.489  25.715
  607   HD21  LEU  73          HD21      LEU  73  31.573  35.463  23.570
  608   HD22  LEU  73          HD22      LEU  73  32.001  37.153  23.310
  609   HD23  LEU  73          HD23      LEU  73  30.553  36.741  24.229
  610    H    ARG  74           HN       ARG  74  35.096  32.886  27.040
  611    HA   ARG  74           HA       ARG  74  33.646  32.766  29.486
  612    HB2  ARG  74           HB2      ARG  74  35.681  31.400  28.917
  613    HB3  ARG  74           HB1      ARG  74  36.660  32.843  29.177
  614    HG2  ARG  74           HG2      ARG  74  35.816  33.000  31.493
  615    HG3  ARG  74           HG1      ARG  74  34.849  31.548  31.236
  616    HD2  ARG  74           HD2      ARG  74  36.931  30.280  30.736
  617    HD3  ARG  74           HD1      ARG  74  37.872  31.730  31.088
  618    HE   ARG  74           HE       ARG  74  36.200  31.203  33.327
  619   HH11  ARG  74          HH11      ARG  74  37.090  30.180  35.135
  620   HH12  ARG  74          HH12      ARG  74  38.551  29.266  34.964
  621   HH21  ARG  74          HH21      ARG  74  38.860  29.893  31.569
  622   HH22  ARG  74          HH22      ARG  74  39.553  29.103  32.944
  623    H    GLY  75           HN       GLY  75  33.385  34.240  31.123
  624    HA2  GLY  75           HA3      GLY  75  33.637  36.227  32.358
  625    HA3  GLY  75           HA2      GLY  75  35.197  36.452  31.566
  626    H    GLY  76           HN       GLY  76  34.435  38.768  31.510
  627    HA2  GLY  76           HA3      GLY  76  33.761  40.575  30.165
  628    HA3  GLY  76           HA2      GLY  76  33.448  39.415  28.873
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1  29.138  28.281   2.755
    2    H2   MET   1           HT2      MET   1  28.276  26.876   2.342
    3    H3   MET   1           HT3      MET   1  28.589  27.237   3.973
    4    HA   MET   1           HA       MET   1  26.813  28.739   2.128
    5    HB2  MET   1           HB2      MET   1  26.252  27.196   4.681
    6    HB3  MET   1           HB1      MET   1  25.056  28.041   3.697
    7    HG2  MET   1           HG2      MET   1  26.798  25.766   2.703
    8    HG3  MET   1           HG1      MET   1  25.127  25.586   3.233
    9    HE1  MET   1           HE1      MET   1  24.552  25.059  -0.380
   10    HE2  MET   1           HE2      MET   1  25.132  24.368   1.134
   11    HE3  MET   1           HE3      MET   1  26.289  24.958  -0.057
   12    H    GLN   2           HN       GLN   2  25.531  30.391   3.477
   13    HA   GLN   2           HA       GLN   2  27.444  32.108   4.850
   14    HB2  GLN   2           HB2      GLN   2  24.442  32.372   4.482
   15    HB3  GLN   2           HB1      GLN   2  25.504  33.637   5.102
   16    HG2  GLN   2           HG2      GLN   2  26.760  33.648   2.996
   17    HG3  GLN   2           HG1      GLN   2  25.756  32.339   2.373
   18   HE21  GLN   2          HE21      GLN   2  25.623  34.491   0.776
   19   HE22  GLN   2          HE22      GLN   2  24.213  35.403   1.029
   20    H    ILE   3           HN       ILE   3  28.050  30.985   6.759
   21    HA   ILE   3           HA       ILE   3  25.984  30.037   8.617
   22    HB   ILE   3           HB       ILE   3  28.993  30.273   8.915
   23   HG12  ILE   3          HG12      ILE   3  27.259  27.823   8.483
   24   HG13  ILE   3          HG11      ILE   3  28.088  28.668   7.175
   25   HG21  ILE   3          HG21      ILE   3  26.850  29.048  10.672
   26   HG22  ILE   3          HG22      ILE   3  28.018  30.294  11.113
   27   HG23  ILE   3          HG23      ILE   3  28.560  28.642  10.822
   28   HD11  ILE   3          HD11      ILE   3  30.244  28.345   8.441
   29   HD12  ILE   3          HD12      ILE   3  29.505  26.844   7.880
   30   HD13  ILE   3          HD13      ILE   3  29.359  27.323   9.572
   31    H    PHE   4           HN       PHE   4  25.178  31.168  10.316
   32    HA   PHE   4           HA       PHE   4  26.336  33.889  10.886
   33    HB2  PHE   4           HB2      PHE   4  23.500  32.861  11.231
   34    HB3  PHE   4           HB1      PHE   4  24.057  34.479  11.659
   35    HD1  PHE   4           HD1      PHE   4  23.299  32.173   8.890
   36    HD2  PHE   4           HD2      PHE   4  24.635  36.117   9.943
   37    HE1  PHE   4           HE1      PHE   4  22.943  32.917   6.551
   38    HE2  PHE   4           HE2      PHE   4  24.281  36.861   7.605
   39    HZ   PHE   4           HZ       PHE   4  23.434  35.262   5.909
   40    H    VAL   5           HN       VAL   5  26.756  34.414  13.061
   41    HA   VAL   5           HA       VAL   5  26.016  32.426  15.149
   42    HB   VAL   5           HB       VAL   5  28.265  31.770  14.502
   43   HG11  VAL   5          HG11      VAL   5  30.117  33.379  14.484
   44   HG12  VAL   5          HG12      VAL   5  29.012  34.680  14.923
   45   HG13  VAL   5          HG13      VAL   5  28.862  33.887  13.355
   46   HG21  VAL   5          HG21      VAL   5  27.644  32.030  16.977
   47   HG22  VAL   5          HG22      VAL   5  28.575  33.526  16.949
   48   HG23  VAL   5          HG23      VAL   5  29.368  31.987  16.610
   49    H    LYS   6           HN       LYS   6  25.531  33.418  17.092
   50    HA   LYS   6           HA       LYS   6  25.896  36.401  17.228
   51    HB2  LYS   6           HB2      LYS   6  23.860  36.422  18.616
   52    HB3  LYS   6           HB1      LYS   6  23.536  35.716  17.032
   53    HG2  LYS   6           HG2      LYS   6  24.010  33.439  18.135
   54    HG3  LYS   6           HG1      LYS   6  23.878  34.290  19.675
   55    HD2  LYS   6           HD2      LYS   6  21.735  34.305  17.529
   56    HD3  LYS   6           HD1      LYS   6  21.722  33.249  18.940
   57    HE2  LYS   6           HE2      LYS   6  21.911  35.372  20.355
   58    HE3  LYS   6           HE1      LYS   6  21.542  36.268  18.880
   59    HZ1  LYS   6           HZ1      LYS   6  19.556  34.731  18.687
   60    HZ2  LYS   6           HZ2      LYS   6  19.492  35.916  19.903
   61    HZ3  LYS   6           HZ3      LYS   6  19.852  34.304  20.300
   62    H    THR   7           HN       THR   7  26.669  37.260  19.150
   63    HA   THR   7           HA       THR   7  27.822  35.301  21.091
   64    HB   THR   7           HB       THR   7  29.322  37.094  21.744
   65    HG1  THR   7           HG1      THR   7  28.933  39.119  21.259
   66   HG21  THR   7          HG21      THR   7  29.006  36.986  18.732
   67   HG22  THR   7          HG22      THR   7  29.928  35.847  19.715
   68   HG23  THR   7          HG23      THR   7  30.450  37.527  19.588
   69    H    LEU   8           HN       LEU   8  27.929  36.417  23.416
   70    HA   LEU   8           HA       LEU   8  25.232  36.631  24.353
   71    HB2  LEU   8           HB2      LEU   8  27.749  37.612  25.732
   72    HB3  LEU   8           HB1      LEU   8  26.217  37.208  26.506
   73    HG   LEU   8           HG       LEU   8  27.923  35.246  24.943
   74   HD11  LEU   8          HD11      LEU   8  28.433  34.297  27.191
   75   HD12  LEU   8          HD12      LEU   8  27.589  35.658  27.930
   76   HD13  LEU   8          HD13      LEU   8  29.058  35.935  26.995
   77   HD21  LEU   8          HD21      LEU   8  26.375  33.638  26.306
   78   HD22  LEU   8          HD22      LEU   8  25.712  34.423  24.878
   79   HD23  LEU   8          HD23      LEU   8  25.329  35.046  26.482
   80    H    THR   9           HN       THR   9  27.576  39.019  23.287
   81    HA   THR   9           HA       THR   9  26.029  41.286  24.293
   82    HB   THR   9           HB       THR   9  28.263  41.245  22.242
   83    HG1  THR   9           HG1      THR   9  28.478  40.447  24.605
   84   HG21  THR   9          HG21      THR   9  28.551  43.613  23.208
   85   HG22  THR   9          HG22      THR   9  26.929  43.410  23.867
   86   HG23  THR   9          HG23      THR   9  27.186  43.351  22.123
   87    H    GLY  10           HN       GLY  10  25.647  39.163  21.722
   88    HA2  GLY  10           HA3      GLY  10  23.828  39.263  20.158
   89    HA3  GLY  10           HA2      GLY  10  23.717  41.005  20.423
   90    H    LYS  11           HN       LYS  11  26.896  40.622  20.128
   91    HA   LYS  11           HA       LYS  11  27.213  41.857  17.642
   92    HB2  LYS  11           HB2      LYS  11  29.040  41.450  19.328
   93    HB3  LYS  11           HB1      LYS  11  29.113  39.777  18.769
   94    HG2  LYS  11           HG2      LYS  11  29.648  40.534  16.498
   95    HG3  LYS  11           HG1      LYS  11  29.524  42.217  17.015
   96    HD2  LYS  11           HD2      LYS  11  31.370  41.847  18.625
   97    HD3  LYS  11           HD1      LYS  11  31.513  40.181  18.065
   98    HE2  LYS  11           HE2      LYS  11  32.020  40.983  15.789
   99    HE3  LYS  11           HE1      LYS  11  31.875  42.651  16.342
  100    HZ1  LYS  11           HZ1      LYS  11  34.143  42.194  16.428
  101    HZ2  LYS  11           HZ2      LYS  11  33.913  40.641  17.078
  102    HZ3  LYS  11           HZ3      LYS  11  33.637  42.016  18.037
  103    H    THR  12           HN       THR  12  26.463  41.174  15.695
  104    HA   THR  12           HA       THR  12  26.178  38.259  15.178
  105    HB   THR  12           HB       THR  12  25.233  40.658  13.579
  106    HG1  THR  12           HG1      THR  12  24.155  40.416  15.548
  107   HG21  THR  12          HG21      THR  12  25.475  38.834  12.070
  108   HG22  THR  12          HG22      THR  12  23.771  38.839  12.522
  109   HG23  THR  12          HG23      THR  12  24.874  37.676  13.255
  110    H    ILE  13           HN       ILE  13  27.484  37.190  13.789
  111    HA   ILE  13           HA       ILE  13  29.220  38.733  11.904
  112    HB   ILE  13           HB       ILE  13  30.178  36.466  13.687
  113   HG12  ILE  13          HG12      ILE  13  30.908  39.412  13.763
  114   HG13  ILE  13          HG11      ILE  13  29.791  38.639  14.888
  115   HG21  ILE  13          HG21      ILE  13  31.615  38.253  11.701
  116   HG22  ILE  13          HG22      ILE  13  31.283  36.534  11.496
  117   HG23  ILE  13          HG23      ILE  13  32.398  37.073  12.749
  118   HD11  ILE  13          HD11      ILE  13  31.673  36.995  15.414
  119   HD12  ILE  13          HD12      ILE  13  31.911  38.645  15.986
  120   HD13  ILE  13          HD13      ILE  13  32.743  38.086  14.535
  121    H    THR  14           HN       THR  14  29.118  37.817   9.877
  122    HA   THR  14           HA       THR  14  27.947  35.065   9.648
  123    HB   THR  14           HB       THR  14  26.516  36.537   8.492
  124    HG1  THR  14           HG1      THR  14  27.285  36.258   6.201
  125   HG21  THR  14          HG21      THR  14  27.396  38.321   6.975
  126   HG22  THR  14          HG22      THR  14  29.027  37.918   7.510
  127   HG23  THR  14          HG23      THR  14  27.854  38.556   8.661
  128    H    LEU  15           HN       LEU  15  29.262  33.503   8.860
  129    HA   LEU  15           HA       LEU  15  31.777  34.315   7.432
  130    HB2  LEU  15           HB2      LEU  15  31.786  33.183   9.851
  131    HB3  LEU  15           HB1      LEU  15  31.533  31.708   8.924
  132    HG   LEU  15           HG       LEU  15  33.548  32.621   7.468
  133   HD11  LEU  15          HD11      LEU  15  34.348  33.828  10.116
  134   HD12  LEU  15          HD12      LEU  15  33.469  34.795   8.934
  135   HD13  LEU  15          HD13      LEU  15  35.033  34.105   8.514
  136   HD21  LEU  15          HD21      LEU  15  35.111  31.392   8.909
  137   HD22  LEU  15          HD22      LEU  15  33.565  30.550   8.851
  138   HD23  LEU  15          HD23      LEU  15  33.991  31.517  10.262
  139    H    GLU  16           HN       GLU  16  31.548  33.798   5.309
  140    HA   GLU  16           HA       GLU  16  29.971  31.356   4.571
  141    HB2  GLU  16           HB2      GLU  16  30.106  32.514   2.237
  142    HB3  GLU  16           HB1      GLU  16  29.012  33.185   3.445
  143    HG2  GLU  16           HG2      GLU  16  30.646  34.882   4.057
  144    HG3  GLU  16           HG1      GLU  16  31.840  34.170   2.973
  145    H    VAL  17           HN       VAL  17  31.167  29.631   3.957
  146    HA   VAL  17           HA       VAL  17  33.469  29.937   2.214
  147    HB   VAL  17           HB       VAL  17  34.452  30.442   4.453
  148   HG11  VAL  17          HG11      VAL  17  34.543  28.772   6.162
  149   HG12  VAL  17          HG12      VAL  17  33.889  27.540   5.083
  150   HG13  VAL  17          HG13      VAL  17  32.856  28.851   5.653
  151   HG21  VAL  17          HG21      VAL  17  35.824  29.455   2.664
  152   HG22  VAL  17          HG22      VAL  17  35.337  27.841   3.176
  153   HG23  VAL  17          HG23      VAL  17  36.325  28.842   4.239
  154    H    GLU  18           HN       GLU  18  34.132  27.903   1.338
  155    HA   GLU  18           HA       GLU  18  32.241  26.000   0.772
  156    HB2  GLU  18           HB2      GLU  18  35.194  25.509   1.215
  157    HB3  GLU  18           HB1      GLU  18  34.109  24.405   0.373
  158    HG2  GLU  18           HG2      GLU  18  33.596  26.143  -1.287
  159    HG3  GLU  18           HG1      GLU  18  34.643  27.279  -0.434
  160    HA   PRO  19           HA       PRO  19  31.289  24.485   4.998
  161    HB2  PRO  19           HB2      PRO  19  30.119  22.323   3.260
  162    HB3  PRO  19           HB1      PRO  19  29.434  23.096   4.707
  163    HG2  PRO  19           HG2      PRO  19  28.610  23.805   2.295
  164    HG3  PRO  19           HG1      PRO  19  28.851  25.024   3.563
  165    HD2  PRO  19           HD2      PRO  19  30.532  24.460   1.153
  166    HD3  PRO  19           HD1      PRO  19  30.276  25.994   2.017
  167    H    SER  20           HN       SER  20  33.066  22.809   2.492
  168    HA   SER  20           HA       SER  20  33.721  20.506   4.140
  169    HB2  SER  20           HB2      SER  20  35.594  20.265   2.367
  170    HB3  SER  20           HB1      SER  20  33.921  20.120   1.832
  171    HG   SER  20           HG       SER  20  34.925  22.689   1.882
  172    H    ASP  21           HN       ASP  21  34.436  23.635   4.567
  173    HA   ASP  21           HA       ASP  21  37.265  23.579   5.111
  174    HB2  ASP  21           HB2      ASP  21  34.973  25.425   5.730
  175    HB3  ASP  21           HB1      ASP  21  36.503  25.657   6.567
  176    H    THR  22           HN       THR  22  38.300  23.190   7.081
  177    HA   THR  22           HA       THR  22  36.843  21.514   8.972
  178    HB   THR  22           HB       THR  22  39.010  21.328  10.127
  179    HG1  THR  22           HG1      THR  22  39.442  23.620   8.732
  180   HG21  THR  22          HG21      THR  22  40.290  20.363   8.244
  181   HG22  THR  22          HG22      THR  22  39.212  21.176   7.108
  182   HG23  THR  22          HG23      THR  22  38.585  19.914   8.169
  183    H    ILE  23           HN       ILE  23  36.462  21.975  11.171
  184    HA   ILE  23           HA       ILE  23  35.446  24.483  11.841
  185    HB   ILE  23           HB       ILE  23  36.606  22.326  13.604
  186   HG12  ILE  23          HG12      ILE  23  33.729  23.131  13.122
  187   HG13  ILE  23          HG11      ILE  23  34.550  21.924  12.133
  188   HG21  ILE  23          HG21      ILE  23  35.144  24.879  14.311
  189   HG22  ILE  23          HG22      ILE  23  36.683  24.303  14.950
  190   HG23  ILE  23          HG23      ILE  23  35.184  23.485  15.390
  191   HD11  ILE  23          HD11      ILE  23  33.179  21.153  14.221
  192   HD12  ILE  23          HD12      ILE  23  34.600  21.671  15.126
  193   HD13  ILE  23          HD13      ILE  23  34.745  20.418  13.894
  194    H    GLU  24           HN       GLU  24  38.722  23.238  12.579
  195    HA   GLU  24           HA       GLU  24  39.754  25.381  14.025
  196    HB2  GLU  24           HB2      GLU  24  41.961  24.843  12.900
  197    HB3  GLU  24           HB1      GLU  24  41.143  23.458  13.625
  198    HG2  GLU  24           HG2      GLU  24  40.196  22.876  11.411
  199    HG3  GLU  24           HG1      GLU  24  41.058  24.237  10.695
  200    H    ASN  25           HN       ASN  25  39.172  25.193  10.543
  201    HA   ASN  25           HA       ASN  25  40.507  27.652   9.865
  202    HB2  ASN  25           HB2      ASN  25  39.739  25.838   8.243
  203    HB3  ASN  25           HB1      ASN  25  38.106  26.472   8.444
  204   HD21  ASN  25          HD21      ASN  25  37.899  27.364   6.305
  205   HD22  ASN  25          HD22      ASN  25  38.852  28.658   5.760
  206    H    VAL  26           HN       VAL  26  37.215  26.832  10.856
  207    HA   VAL  26           HA       VAL  26  36.111  29.469  10.528
  208    HB   VAL  26           HB       VAL  26  35.253  27.359  12.528
  209   HG11  VAL  26          HG11      VAL  26  33.118  28.399  12.422
  210   HG12  VAL  26          HG12      VAL  26  33.560  29.337  10.996
  211   HG13  VAL  26          HG13      VAL  26  34.269  29.727  12.564
  212   HG21  VAL  26          HG21      VAL  26  34.611  27.633   9.576
  213   HG22  VAL  26          HG22      VAL  26  33.748  26.567  10.684
  214   HG23  VAL  26          HG23      VAL  26  35.458  26.293  10.350
  215    H    LYS  27           HN       LYS  27  36.966  27.739  13.535
  216    HA   LYS  27           HA       LYS  27  36.837  29.842  15.337
  217    HB2  LYS  27           HB2      LYS  27  38.882  27.607  15.202
  218    HB3  LYS  27           HB1      LYS  27  38.649  28.648  16.605
  219    HG2  LYS  27           HG2      LYS  27  36.210  27.950  16.584
  220    HG3  LYS  27           HG1      LYS  27  36.648  26.739  15.380
  221    HD2  LYS  27           HD2      LYS  27  38.258  25.735  16.930
  222    HD3  LYS  27           HD1      LYS  27  37.897  26.973  18.133
  223    HE2  LYS  27           HE2      LYS  27  35.837  25.060  17.002
  224    HE3  LYS  27           HE1      LYS  27  36.681  24.813  18.531
  225    HZ1  LYS  27           HZ1      LYS  27  35.215  27.315  17.965
  226    HZ2  LYS  27           HZ2      LYS  27  35.688  26.678  19.468
  227    HZ3  LYS  27           HZ3      LYS  27  34.422  25.954  18.595
  228    H    ALA  28           HN       ALA  28  39.312  29.236  12.920
  229    HA   ALA  28           HA       ALA  28  41.246  31.117  13.949
  230    HB1  ALA  28           HB1      ALA  28  40.899  30.379  11.037
  231    HB2  ALA  28           HB2      ALA  28  41.635  29.280  12.202
  232    HB3  ALA  28           HB3      ALA  28  42.382  30.842  11.870
  233    H    LYS  29           HN       LYS  29  39.012  31.405  11.158
  234    HA   LYS  29           HA       LYS  29  39.425  34.151  10.681
  235    HB2  LYS  29           HB2      LYS  29  37.047  32.349  10.246
  236    HB3  LYS  29           HB1      LYS  29  36.993  34.053   9.797
  237    HG2  LYS  29           HG2      LYS  29  38.656  33.822   8.160
  238    HG3  LYS  29           HG1      LYS  29  39.314  32.356   8.888
  239    HD2  LYS  29           HD2      LYS  29  37.328  31.103   8.223
  240    HD3  LYS  29           HD1      LYS  29  36.610  32.560   7.535
  241    HE2  LYS  29           HE2      LYS  29  39.274  31.433   6.634
  242    HE3  LYS  29           HE1      LYS  29  37.743  31.048   5.847
  243    HZ1  LYS  29           HZ1      LYS  29  37.421  33.508   5.614
  244    HZ2  LYS  29           HZ2      LYS  29  38.676  32.851   4.677
  245    HZ3  LYS  29           HZ3      LYS  29  39.034  33.702   6.102
  246    H    ILE  30           HN       ILE  30  37.578  32.570  13.174
  247    HA   ILE  30           HA       ILE  30  36.141  34.989  13.978
  248    HB   ILE  30           HB       ILE  30  36.569  32.301  15.319
  249   HG12  ILE  30          HG12      ILE  30  34.057  33.533  14.154
  250   HG13  ILE  30          HG11      ILE  30  35.127  32.477  13.231
  251   HG21  ILE  30          HG21      ILE  30  36.230  33.872  17.100
  252   HG22  ILE  30          HG22      ILE  30  34.656  33.131  16.806
  253   HG23  ILE  30          HG23      ILE  30  35.002  34.744  16.184
  254   HD11  ILE  30          HD11      ILE  30  34.724  30.630  14.682
  255   HD12  ILE  30          HD12      ILE  30  33.140  31.340  14.374
  256   HD13  ILE  30          HD13      ILE  30  33.967  31.657  15.898
  257    H    GLN  31           HN       GLN  31  38.493  32.978  15.731
  258    HA   GLN  31           HA       GLN  31  39.277  34.609  17.773
  259    HB2  GLN  31           HB2      GLN  31  40.245  32.394  17.374
  260    HB3  GLN  31           HB1      GLN  31  41.120  33.009  15.975
  261    HG2  GLN  31           HG2      GLN  31  42.425  34.481  17.355
  262    HG3  GLN  31           HG1      GLN  31  41.466  34.093  18.780
  263   HE21  GLN  31          HE21      GLN  31  43.336  33.207  19.928
  264   HE22  GLN  31          HE22      GLN  31  44.030  31.726  19.474
  265    H    ASP  32           HN       ASP  32  40.470  34.866  14.440
  266    HA   ASP  32           HA       ASP  32  42.237  37.096  14.988
  267    HB2  ASP  32           HB2      ASP  32  41.001  36.069  12.420
  268    HB3  ASP  32           HB1      ASP  32  42.149  37.408  12.470
  269    H    LYS  33           HN       LYS  33  39.070  36.950  13.388
  270    HA   LYS  33           HA       LYS  33  38.690  39.733  13.090
  271    HB2  LYS  33           HB2      LYS  33  36.723  37.495  13.421
  272    HB3  LYS  33           HB1      LYS  33  36.218  39.147  13.086
  273    HG2  LYS  33           HG2      LYS  33  37.494  39.174  11.029
  274    HG3  LYS  33           HG1      LYS  33  38.195  37.601  11.386
  275    HD2  LYS  33           HD2      LYS  33  35.960  36.570  11.281
  276    HD3  LYS  33           HD1      LYS  33  35.245  38.145  10.933
  277    HE2  LYS  33           HE2      LYS  33  36.572  38.304   8.867
  278    HE3  LYS  33           HE1      LYS  33  37.315  36.744   9.215
  279    HZ1  LYS  33           HZ1      LYS  33  35.544  36.356   7.721
  280    HZ2  LYS  33           HZ2      LYS  33  34.462  37.298   8.632
  281    HZ3  LYS  33           HZ3      LYS  33  35.015  35.811   9.237
  282    H    GLU  34           HN       GLU  34  37.880  37.668  15.889
  283    HA   GLU  34           HA       GLU  34  36.887  40.064  17.347
  284    HB2  GLU  34           HB2      GLU  34  37.090  37.289  18.516
  285    HB3  GLU  34           HB1      GLU  34  35.959  38.580  18.911
  286    HG2  GLU  34           HG2      GLU  34  35.013  38.352  16.582
  287    HG3  GLU  34           HG1      GLU  34  36.017  36.916  16.383
  288    H    GLY  35           HN       GLY  35  39.671  37.993  17.138
  289    HA2  GLY  35           HA3      GLY  35  41.797  38.211  18.158
  290    HA3  GLY  35           HA2      GLY  35  41.271  39.789  18.741
  291    H    ILE  36           HN       ILE  36  39.252  37.099  19.486
  292    HA   ILE  36           HA       ILE  36  40.006  37.315  22.348
  293    HB   ILE  36           HB       ILE  36  37.584  36.028  21.100
  294   HG12  ILE  36          HG12      ILE  36  37.998  38.840  22.165
  295   HG13  ILE  36          HG11      ILE  36  37.713  38.408  20.481
  296   HG21  ILE  36          HG21      ILE  36  38.085  37.117  23.878
  297   HG22  ILE  36          HG22      ILE  36  38.247  35.416  23.449
  298   HG23  ILE  36          HG23      ILE  36  36.678  36.208  23.335
  299   HD11  ILE  36          HD11      ILE  36  35.608  39.099  21.402
  300   HD12  ILE  36          HD12      ILE  36  35.821  38.042  22.798
  301   HD13  ILE  36          HD13      ILE  36  35.555  37.348  21.197
  302    HA   PRO  37           HA       PRO  37  42.190  33.349  21.440
  303    HB2  PRO  37           HB2      PRO  37  42.262  33.469  24.444
  304    HB3  PRO  37           HB1      PRO  37  43.550  33.019  23.307
  305    HG2  PRO  37           HG2      PRO  37  43.541  35.410  24.439
  306    HG3  PRO  37           HG1      PRO  37  43.992  35.220  22.733
  307    HD2  PRO  37           HD2      PRO  37  41.458  36.316  23.899
  308    HD3  PRO  37           HD1      PRO  37  42.290  36.759  22.391
  309    HA   PRO  38           HA       PRO  38  38.373  30.869  21.789
  310    HB2  PRO  38           HB2      PRO  38  40.532  28.791  21.803
  311    HB3  PRO  38           HB1      PRO  38  38.943  28.746  21.004
  312    HG2  PRO  38           HG2      PRO  38  41.055  29.380  19.610
  313    HG3  PRO  38           HG1      PRO  38  39.569  30.308  19.397
  314    HD2  PRO  38           HD2      PRO  38  42.106  31.107  20.769
  315    HD3  PRO  38           HD1      PRO  38  40.915  32.121  19.921
  316    H    ASP  39           HN       ASP  39  41.194  30.351  23.870
  317    HA   ASP  39           HA       ASP  39  40.116  28.655  25.814
  318    HB2  ASP  39           HB2      ASP  39  42.466  29.446  25.815
  319    HB3  ASP  39           HB1      ASP  39  41.910  31.043  26.318
  320    H    GLN  40           HN       GLN  40  39.775  32.173  25.575
  321    HA   GLN  40           HA       GLN  40  38.057  32.286  27.945
  322    HB2  GLN  40           HB2      GLN  40  38.716  34.388  25.861
  323    HB3  GLN  40           HB1      GLN  40  37.894  34.680  27.392
  324    HG2  GLN  40           HG2      GLN  40  39.883  33.807  28.602
  325    HG3  GLN  40           HG1      GLN  40  40.710  33.615  27.055
  326   HE21  GLN  40          HE21      GLN  40  40.660  35.669  29.603
  327   HE22  GLN  40          HE22      GLN  40  40.975  37.141  28.818
  328    H    GLN  41           HN       GLN  41  37.444  30.961  25.113
  329    HA   GLN  41           HA       GLN  41  34.585  31.850  25.111
  330    HB2  GLN  41           HB2      GLN  41  36.284  31.520  22.622
  331    HB3  GLN  41           HB1      GLN  41  34.566  31.915  22.661
  332    HG2  GLN  41           HG2      GLN  41  35.105  33.976  23.955
  333    HG3  GLN  41           HG1      GLN  41  36.819  33.598  23.786
  334   HE21  GLN  41          HE21      GLN  41  37.381  33.069  21.289
  335   HE22  GLN  41          HE22      GLN  41  36.752  34.188  20.179
  336    H    ARG  42           HN       ARG  42  33.125  30.243  24.627
  337    HA   ARG  42           HA       ARG  42  34.169  27.546  23.870
  338    HB2  ARG  42           HB2      ARG  42  32.366  28.303  26.180
  339    HB3  ARG  42           HB1      ARG  42  32.290  26.692  25.467
  340    HG2  ARG  42           HG2      ARG  42  34.975  27.809  26.264
  341    HG3  ARG  42           HG1      ARG  42  33.909  27.173  27.514
  342    HD2  ARG  42           HD2      ARG  42  33.915  25.001  26.592
  343    HD3  ARG  42           HD1      ARG  42  34.515  25.564  25.032
  344    HE   ARG  42           HE       ARG  42  36.140  25.005  27.405
  345   HH11  ARG  42          HH11      ARG  42  38.371  25.193  27.095
  346   HH12  ARG  42          HH12      ARG  42  38.971  25.976  25.670
  347   HH21  ARG  42          HH21      ARG  42  35.818  26.647  24.391
  348   HH22  ARG  42          HH22      ARG  42  37.525  26.798  24.140
  349    H    LEU  43           HN       LEU  43  33.041  26.863  22.058
  350    HA   LEU  43           HA       LEU  43  30.666  28.417  21.257
  351    HB2  LEU  43           HB2      LEU  43  31.933  26.082  19.827
  352    HB3  LEU  43           HB1      LEU  43  30.855  27.311  19.144
  353    HG   LEU  43           HG       LEU  43  33.756  27.553  19.964
  354   HD11  LEU  43          HD11      LEU  43  32.156  28.455  17.562
  355   HD12  LEU  43          HD12      LEU  43  33.167  27.012  17.634
  356   HD13  LEU  43          HD13      LEU  43  33.903  28.612  17.745
  357   HD21  LEU  43          HD21      LEU  43  33.476  30.043  19.600
  358   HD22  LEU  43          HD22      LEU  43  32.762  29.438  21.089
  359   HD23  LEU  43          HD23      LEU  43  31.733  29.799  19.704
  360    H    ILE  44           HN       ILE  44  28.608  27.605  21.118
  361    HA   ILE  44           HA       ILE  44  28.128  24.804  22.106
  362    HB   ILE  44           HB       ILE  44  26.426  27.273  22.600
  363   HG12  ILE  44          HG12      ILE  44  28.446  27.331  23.974
  364   HG13  ILE  44          HG11      ILE  44  27.064  26.926  24.986
  365   HG21  ILE  44          HG21      ILE  44  25.012  25.320  22.437
  366   HG22  ILE  44          HG22      ILE  44  25.220  25.647  24.159
  367   HG23  ILE  44          HG23      ILE  44  26.140  24.354  23.389
  368   HD11  ILE  44          HD11      ILE  44  27.817  24.424  24.394
  369   HD12  ILE  44          HD12      ILE  44  28.563  25.321  25.712
  370   HD13  ILE  44          HD13      ILE  44  29.371  25.215  24.152
  371    H    PHE  45           HN       PHE  45  26.801  23.592  20.763
  372    HA   PHE  45           HA       PHE  45  25.023  24.970  18.856
  373    HB2  PHE  45           HB2      PHE  45  27.075  24.881  17.573
  374    HB3  PHE  45           HB1      PHE  45  27.338  23.197  18.023
  375    HD1  PHE  45           HD1      PHE  45  25.407  25.498  15.907
  376    HD2  PHE  45           HD2      PHE  45  25.969  21.407  17.074
  377    HE1  PHE  45           HE1      PHE  45  24.063  24.761  13.956
  378    HE2  PHE  45           HE2      PHE  45  24.626  20.664  15.123
  379    HZ   PHE  45           HZ       PHE  45  23.672  22.342  13.564
  380    H    ALA  46           HN       ALA  46  23.147  23.907  19.220
  381    HA   ALA  46           HA       ALA  46  21.625  22.157  19.518
  382    HB1  ALA  46           HB1      ALA  46  22.918  21.414  17.401
  383    HB2  ALA  46           HB2      ALA  46  21.993  20.190  18.270
  384    HB3  ALA  46           HB3      ALA  46  23.743  20.279  18.471
  385    H    GLY  47           HN       GLY  47  23.873  22.725  21.583
  386    HA2  GLY  47           HA3      GLY  47  24.008  21.894  23.811
  387    HA3  GLY  47           HA2      GLY  47  23.182  20.425  23.297
  388    H    LYS  48           HN       LYS  48  25.627  21.121  21.118
  389    HA   LYS  48           HA       LYS  48  27.620  19.417  22.580
  390    HB2  LYS  48           HB2      LYS  48  26.867  19.294  19.668
  391    HB3  LYS  48           HB1      LYS  48  28.166  18.370  20.413
  392    HG2  LYS  48           HG2      LYS  48  26.521  17.309  21.930
  393    HG3  LYS  48           HG1      LYS  48  25.226  18.209  21.141
  394    HD2  LYS  48           HD2      LYS  48  25.764  17.126  18.996
  395    HD3  LYS  48           HD1      LYS  48  27.075  16.235  19.769
  396    HE2  LYS  48           HE2      LYS  48  25.087  14.814  19.619
  397    HE3  LYS  48           HE1      LYS  48  25.427  15.190  21.308
  398    HZ1  LYS  48           HZ1      LYS  48  23.100  15.725  19.846
  399    HZ2  LYS  48           HZ2      LYS  48  23.800  17.213  20.277
  400    HZ3  LYS  48           HZ3      LYS  48  23.421  16.071  21.476
  401    H    GLN  49           HN       GLN  49  29.848  19.933  22.135
  402    HA   GLN  49           HA       GLN  49  30.251  22.676  21.182
  403    HB2  GLN  49           HB2      GLN  49  31.290  21.649  23.307
  404    HB3  GLN  49           HB1      GLN  49  32.349  20.758  22.215
  405    HG2  GLN  49           HG2      GLN  49  33.012  22.972  21.192
  406    HG3  GLN  49           HG1      GLN  49  32.106  23.764  22.477
  407   HE21  GLN  49          HE21      GLN  49  35.110  23.686  21.945
  408   HE22  GLN  49          HE22      GLN  49  35.784  23.130  23.401
  409    H    LEU  50           HN       LEU  50  32.042  23.072  19.578
  410    HA   LEU  50           HA       LEU  50  32.093  20.920  17.502
  411    HB2  LEU  50           HB2      LEU  50  32.998  23.800  17.231
  412    HB3  LEU  50           HB1      LEU  50  32.642  22.658  15.938
  413    HG   LEU  50           HG       LEU  50  30.615  23.708  17.934
  414   HD11  LEU  50          HD11      LEU  50  30.967  24.333  14.987
  415   HD12  LEU  50          HD12      LEU  50  31.420  25.412  16.307
  416   HD13  LEU  50          HD13      LEU  50  29.727  24.991  16.055
  417   HD21  LEU  50          HD21      LEU  50  29.868  21.565  17.244
  418   HD22  LEU  50          HD22      LEU  50  30.474  21.787  15.602
  419   HD23  LEU  50          HD23      LEU  50  29.047  22.672  16.144
  420    H    GLU  51           HN       GLU  51  33.879  19.636  17.642
  421    HA   GLU  51           HA       GLU  51  36.369  20.710  18.846
  422    HB2  GLU  51           HB2      GLU  51  35.674  17.911  17.904
  423    HB3  GLU  51           HB1      GLU  51  37.123  18.369  18.800
  424    HG2  GLU  51           HG2      GLU  51  35.680  19.179  20.661
  425    HG3  GLU  51           HG1      GLU  51  34.263  18.612  19.777
  426    H    ASP  52           HN       ASP  52  38.395  20.605  17.725
  427    HA   ASP  52           HA       ASP  52  38.206  21.210  14.892
  428    HB2  ASP  52           HB2      ASP  52  40.641  21.463  15.006
  429    HB3  ASP  52           HB1      ASP  52  39.892  22.265  16.386
  430    H    GLY  53           HN       GLY  53  39.297  19.995  13.185
  431    HA2  GLY  53           HA3      GLY  53  40.330  17.993  12.306
  432    HA3  GLY  53           HA2      GLY  53  39.926  17.150  13.801
  433    H    ARG  54           HN       ARG  54  37.793  19.120  11.740
  434    HA   ARG  54           HA       ARG  54  36.487  16.874  10.498
  435    HB2  ARG  54           HB2      ARG  54  35.720  16.581  12.872
  436    HB3  ARG  54           HB1      ARG  54  34.975  18.177  12.783
  437    HG2  ARG  54           HG2      ARG  54  33.413  17.482  11.140
  438    HG3  ARG  54           HG1      ARG  54  34.327  16.020  10.770
  439    HD2  ARG  54           HD2      ARG  54  32.291  15.586  12.168
  440    HD3  ARG  54           HD1      ARG  54  33.791  15.068  12.937
  441    HE   ARG  54           HE       ARG  54  32.954  17.784  13.653
  442   HH11  ARG  54          HH11      ARG  54  32.414  18.069  15.831
  443   HH12  ARG  54          HH12      ARG  54  32.169  16.680  16.836
  444   HH21  ARG  54          HH21      ARG  54  32.808  14.400  14.303
  445   HH22  ARG  54          HH22      ARG  54  32.393  14.605  15.971
  446    H    THR  55           HN       THR  55  34.700  17.610   9.116
  447    HA   THR  55           HA       THR  55  34.620  20.593   8.751
  448    HB   THR  55           HB       THR  55  34.325  20.186   6.368
  449    HG1  THR  55           HG1      THR  55  33.999  18.224   5.581
  450   HG21  THR  55          HG21      THR  55  36.509  18.935   5.902
  451   HG22  THR  55          HG22      THR  55  36.636  18.721   7.647
  452   HG23  THR  55          HG23      THR  55  36.623  20.343   6.956
  453    H    LEU  56           HN       LEU  56  32.467  20.991   7.244
  454    HA   LEU  56           HA       LEU  56  30.259  20.221   8.956
  455    HB2  LEU  56           HB2      LEU  56  30.463  21.710   6.340
  456    HB3  LEU  56           HB1      LEU  56  28.891  21.244   6.974
  457    HG   LEU  56           HG       LEU  56  29.466  22.405   9.121
  458   HD11  LEU  56          HD11      LEU  56  31.384  24.072   8.935
  459   HD12  LEU  56          HD12      LEU  56  31.911  23.177   7.511
  460   HD13  LEU  56          HD13      LEU  56  31.863  22.382   9.084
  461   HD21  LEU  56          HD21      LEU  56  28.981  24.596   8.300
  462   HD22  LEU  56          HD22      LEU  56  28.225  23.480   7.163
  463   HD23  LEU  56          HD23      LEU  56  29.751  24.261   6.749
  464    H    SER  57           HN       SER  57  31.162  19.331   5.589
  465    HA   SER  57           HA       SER  57  29.045  17.475   5.181
  466    HB2  SER  57           HB2      SER  57  30.528  16.427   3.507
  467    HB3  SER  57           HB1      SER  57  30.593  18.182   3.380
  468    HG   SER  57           HG       SER  57  32.565  18.187   4.271
  469    H    ASP  58           HN       ASP  58  32.359  16.880   6.320
  470    HA   ASP  58           HA       ASP  58  32.106  14.157   6.977
  471    HB2  ASP  58           HB2      ASP  58  34.243  15.416   7.103
  472    HB3  ASP  58           HB1      ASP  58  33.650  16.254   8.538
  473    H    TYR  59           HN       TYR  59  30.807  16.969   8.612
  474    HA   TYR  59           HA       TYR  59  30.203  15.585  11.099
  475    HB2  TYR  59           HB2      TYR  59  30.168  18.256  10.213
  476    HB3  TYR  59           HB1      TYR  59  28.472  17.900  10.494
  477    HD1  TYR  59           HD1      TYR  59  31.004  19.469  12.034
  478    HD2  TYR  59           HD2      TYR  59  28.439  16.099  12.750
  479    HE1  TYR  59           HE1      TYR  59  31.350  19.727  14.474
  480    HE2  TYR  59           HE2      TYR  59  28.784  16.358  15.192
  481    HH   TYR  59           HH       TYR  59  29.494  17.881  16.796
  482    H    ASN  60           HN       ASN  60  28.829  15.665   7.977
  483    HA   ASN  60           HA       ASN  60  26.902  14.675   7.081
  484    HB2  ASN  60           HB2      ASN  60  26.610  13.241   9.727
  485    HB3  ASN  60           HB1      ASN  60  26.106  12.695   8.129
  486   HD21  ASN  60          HD21      ASN  60  28.372  11.983  10.363
  487   HD22  ASN  60          HD22      ASN  60  29.674  11.552   9.362
  488    H    ILE  61           HN       ILE  61  26.245  17.092   7.676
  489    HA   ILE  61           HA       ILE  61  24.444  17.576   9.834
  490    HB   ILE  61           HB       ILE  61  24.337  18.885   7.099
  491   HG12  ILE  61          HG12      ILE  61  25.989  19.780   9.476
  492   HG13  ILE  61          HG11      ILE  61  26.664  18.816   8.165
  493   HG21  ILE  61          HG21      ILE  61  23.357  20.739   8.250
  494   HG22  ILE  61          HG22      ILE  61  23.759  20.061   9.826
  495   HG23  ILE  61          HG23      ILE  61  22.506  19.312   8.838
  496   HD11  ILE  61          HD11      ILE  61  26.426  20.528   6.598
  497   HD12  ILE  61          HD12      ILE  61  26.824  21.436   8.055
  498   HD13  ILE  61          HD13      ILE  61  25.150  21.334   7.512
  499    H    GLN  62           HN       GLN  62  22.177  17.394   9.956
  500    HA   GLN  62           HA       GLN  62  20.993  15.361   8.209
  501    HB2  GLN  62           HB2      GLN  62  20.517  15.419  10.646
  502    HB3  GLN  62           HB1      GLN  62  19.741  16.990  10.441
  503    HG2  GLN  62           HG2      GLN  62  18.062  16.020   8.965
  504    HG3  GLN  62           HG1      GLN  62  18.877  14.456   9.016
  505   HE21  GLN  62          HE21      GLN  62  17.005  13.406  10.014
  506   HE22  GLN  62          HE22      GLN  62  16.591  13.701  11.634
  507    H    LYS  63           HN       LYS  63  19.999  18.692   9.110
  508    HA   LYS  63           HA       LYS  63  18.156  18.867   6.876
  509    HB2  LYS  63           HB2      LYS  63  19.309  21.171   8.468
  510    HB3  LYS  63           HB1      LYS  63  17.778  21.128   7.596
  511    HG2  LYS  63           HG2      LYS  63  18.459  19.399   9.994
  512    HG3  LYS  63           HG1      LYS  63  17.458  20.851  10.043
  513    HD2  LYS  63           HD2      LYS  63  16.016  19.687   8.236
  514    HD3  LYS  63           HD1      LYS  63  16.866  18.212   8.698
  515    HE2  LYS  63           HE2      LYS  63  15.346  20.001  10.617
  516    HE3  LYS  63           HE1      LYS  63  14.730  18.492   9.943
  517    HZ1  LYS  63           HZ1      LYS  63  15.637  17.691  11.839
  518    HZ2  LYS  63           HZ2      LYS  63  16.796  18.927  11.957
  519    HZ3  LYS  63           HZ3      LYS  63  17.034  17.636  10.878
  520    H    GLU  64           HN       GLU  64  21.524  19.697   7.383
  521    HA   GLU  64           HA       GLU  64  23.124  20.603   5.920
  522    HB2  GLU  64           HB2      GLU  64  22.478  18.535   4.677
  523    HB3  GLU  64           HB1      GLU  64  21.250  19.470   3.821
  524    HG2  GLU  64           HG2      GLU  64  22.982  20.955   2.914
  525    HG3  GLU  64           HG1      GLU  64  24.223  20.072   3.802
  526    H    SEP  65           HN       SEP  65  22.447  22.801   6.542
  527    HA   SEP  65           HA       SEP  65  21.735  24.397   4.227
  528    HB2  SEP  65           HB1      SEP  65  19.769  24.404   6.534
  529    HB3  SEP  65           HB2      SEP  65  19.489  23.553   5.019
  530    H    TPO  66           HN       TPO  66  20.968  26.747   5.499
  531    HA   TPO  66           HA       TPO  66  23.436  27.727   6.525
  532    HB   TPO  66           HB       TPO  66  22.155  29.738   7.151
  533   HG21  TPO  66          HG21      TPO  66  21.335  30.293   4.954
  534   HG22  TPO  66          HG22      TPO  66  21.095  28.592   4.558
  535   HG23  TPO  66          HG23      TPO  66  22.727  29.232   4.745
  536    H    LEU  67           HN       LEU  67  24.293  26.847   8.369
  537    HA   LEU  67           HA       LEU  67  22.538  26.114  10.628
  538    HB2  LEU  67           HB2      LEU  67  25.562  26.014  10.427
  539    HB3  LEU  67           HB1      LEU  67  24.564  25.231  11.650
  540    HG   LEU  67           HG       LEU  67  24.522  24.631   8.678
  541   HD11  LEU  67          HD11      LEU  67  25.328  22.358   9.606
  542   HD12  LEU  67          HD12      LEU  67  25.713  23.240  11.082
  543   HD13  LEU  67          HD13      LEU  67  26.500  23.675   9.563
  544   HD21  LEU  67          HD21      LEU  67  22.331  24.163   9.390
  545   HD22  LEU  67          HD22      LEU  67  22.848  23.691  11.010
  546   HD23  LEU  67          HD23      LEU  67  23.133  22.616   9.642
  547    H    HIS  68           HN       HIS  68  22.932  26.956  12.790
  548    HA   HIS  68           HA       HIS  68  24.102  29.722  12.833
  549    HB2  HIS  68           HB2      HIS  68  21.632  28.684  14.263
  550    HB3  HIS  68           HB1      HIS  68  22.343  30.280  14.503
  551    HD1  HIS  68           HD1      HIS  68  20.666  28.181  11.826
  552    HD2  HIS  68           HD2      HIS  68  21.675  32.165  12.540
  553    HE1  HIS  68           HE1      HIS  68  19.572  29.539   9.987
  554    HE2  HIS  68           HE2      HIS  68  20.180  31.965  10.413
  555    H    LEU  69           HN       LEU  69  25.662  29.962  14.370
  556    HA   LEU  69           HA       LEU  69  25.936  27.830  16.469
  557    HB2  LEU  69           HB2      LEU  69  27.915  29.487  14.914
  558    HB3  LEU  69           HB1      LEU  69  28.357  28.915  16.521
  559    HG   LEU  69           HG       LEU  69  27.821  26.589  15.811
  560   HD11  LEU  69          HD11      LEU  69  26.250  26.784  14.074
  561   HD12  LEU  69          HD12      LEU  69  27.718  26.335  13.213
  562   HD13  LEU  69          HD13      LEU  69  27.184  28.017  13.230
  563   HD21  LEU  69          HD21      LEU  69  29.765  26.405  14.180
  564   HD22  LEU  69          HD22      LEU  69  30.125  27.272  15.672
  565   HD23  LEU  69          HD23      LEU  69  29.831  28.167  14.182
  566    H    VAL  70           HN       VAL  70  26.880  28.698  18.566
  567    HA   VAL  70           HA       VAL  70  26.195  31.564  19.072
  568    HB   VAL  70           HB       VAL  70  25.277  29.216  20.766
  569   HG11  VAL  70          HG11      VAL  70  24.049  31.069  21.990
  570   HG12  VAL  70          HG12      VAL  70  25.029  32.220  21.081
  571   HG13  VAL  70          HG13      VAL  70  25.801  31.086  22.189
  572   HG21  VAL  70          HG21      VAL  70  23.731  31.199  19.064
  573   HG22  VAL  70          HG22      VAL  70  23.009  29.981  20.115
  574   HG23  VAL  70          HG23      VAL  70  23.949  29.486  18.707
  575    H    LEU  71           HN       LEU  71  28.124  32.397  19.774
  576    HA   LEU  71           HA       LEU  71  30.088  30.695  21.122
  577    HB2  LEU  71           HB2      LEU  71  30.646  32.516  19.454
  578    HB3  LEU  71           HB1      LEU  71  30.122  33.696  20.647
  579    HG   LEU  71           HG       LEU  71  32.139  31.682  21.588
  580   HD11  LEU  71          HD11      LEU  71  34.018  32.878  20.594
  581   HD12  LEU  71          HD12      LEU  71  32.919  33.994  19.786
  582   HD13  LEU  71          HD13      LEU  71  32.959  32.298  19.309
  583   HD21  LEU  71          HD21      LEU  71  31.356  33.472  23.085
  584   HD22  LEU  71          HD22      LEU  71  31.830  34.690  21.905
  585   HD23  LEU  71          HD23      LEU  71  33.057  33.712  22.705
  586    H    ARG  72           HN       ARG  72  30.732  30.963  23.340
  587    HA   ARG  72           HA       ARG  72  28.886  32.628  25.025
  588    HB2  ARG  72           HB2      ARG  72  28.603  30.077  25.152
  589    HB3  ARG  72           HB1      ARG  72  30.206  30.043  25.885
  590    HG2  ARG  72           HG2      ARG  72  29.468  31.479  27.700
  591    HG3  ARG  72           HG1      ARG  72  27.895  31.703  26.934
  592    HD2  ARG  72           HD2      ARG  72  28.986  29.023  27.836
  593    HD3  ARG  72           HD1      ARG  72  27.852  30.002  28.768
  594    HE   ARG  72           HE       ARG  72  26.747  29.646  26.180
  595   HH11  ARG  72          HH11      ARG  72  25.168  28.058  25.869
  596   HH12  ARG  72          HH12      ARG  72  25.047  26.743  26.991
  597   HH21  ARG  72          HH21      ARG  72  27.664  27.851  28.979
  598   HH22  ARG  72          HH22      ARG  72  26.460  26.626  28.752
  599    H    LEU  73           HN       LEU  73  29.948  33.298  27.111
  600    HA   LEU  73           HA       LEU  73  32.895  33.723  26.733
  601    HB2  LEU  73           HB2      LEU  73  31.469  35.783  26.693
  602    HB3  LEU  73           HB1      LEU  73  30.911  35.386  28.317
  603    HG   LEU  73           HG       LEU  73  33.284  35.460  29.107
  604   HD11  LEU  73          HD11      LEU  73  34.785  36.836  27.408
  605   HD12  LEU  73          HD12      LEU  73  33.732  36.100  26.200
  606   HD13  LEU  73          HD13      LEU  73  34.683  35.083  27.282
  607   HD21  LEU  73          HD21      LEU  73  32.079  37.895  27.774
  608   HD22  LEU  73          HD22      LEU  73  33.494  37.988  28.822
  609   HD23  LEU  73          HD23      LEU  73  31.955  37.418  29.469
  610    H    ARG  74           HN       ARG  74  34.232  33.010  28.378
  611    HA   ARG  74           HA       ARG  74  33.152  31.234  30.378
  612    HB2  ARG  74           HB2      ARG  74  35.891  32.536  30.294
  613    HB3  ARG  74           HB1      ARG  74  35.449  31.105  31.219
  614    HG2  ARG  74           HG2      ARG  74  35.144  31.220  28.211
  615    HG3  ARG  74           HG1      ARG  74  36.650  30.718  28.972
  616    HD2  ARG  74           HD2      ARG  74  33.937  29.393  29.246
  617    HD3  ARG  74           HD1      ARG  74  35.381  28.725  28.493
  618    HE   ARG  74           HE       ARG  74  36.123  29.290  31.131
  619   HH11  ARG  74          HH11      ARG  74  36.003  27.704  32.739
  620   HH12  ARG  74          HH12      ARG  74  34.925  26.364  32.535
  621   HH21  ARG  74          HH21      ARG  74  33.755  27.432  29.450
  622   HH22  ARG  74          HH22      ARG  74  33.652  26.209  30.673
  623    H    GLY  75           HN       GLY  75  34.232  34.608  30.423
  624    HA2  GLY  75           HA3      GLY  75  33.576  36.295  31.948
  625    HA3  GLY  75           HA2      GLY  75  32.652  35.084  32.840
  626    H    GLY  76           HN       GLY  76  35.689  33.833  32.330
  627    HA2  GLY  76           HA3      GLY  76  37.319  35.173  34.233
  628    HA3  GLY  76           HA2      GLY  76  36.424  33.911  35.082
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1  29.372  27.940   2.833
    2    H2   MET   1           HT2      MET   1  28.276  26.719   2.396
    3    H3   MET   1           HT3      MET   1  28.498  27.117   4.031
    4    HA   MET   1           HA       MET   1  27.344  28.909   1.962
    5    HB2  MET   1           HB2      MET   1  26.057  27.454   4.293
    6    HB3  MET   1           HB1      MET   1  25.240  28.576   3.204
    7    HG2  MET   1           HG2      MET   1  25.720  27.101   1.298
    8    HG3  MET   1           HG1      MET   1  26.577  25.986   2.363
    9    HE1  MET   1           HE1      MET   1  23.330  24.232   1.227
   10    HE2  MET   1           HE2      MET   1  24.853  23.718   1.947
   11    HE3  MET   1           HE3      MET   1  24.860  24.894   0.636
   12    H    GLN   2           HN       GLN   2  25.893  30.501   3.560
   13    HA   GLN   2           HA       GLN   2  27.941  32.009   5.007
   14    HB2  GLN   2           HB2      GLN   2  24.964  32.510   4.704
   15    HB3  GLN   2           HB1      GLN   2  26.135  33.656   5.358
   16    HG2  GLN   2           HG2      GLN   2  27.354  33.631   3.208
   17    HG3  GLN   2           HG1      GLN   2  26.169  32.502   2.553
   18   HE21  GLN   2          HE21      GLN   2  26.239  34.739   1.087
   19   HE22  GLN   2          HE22      GLN   2  24.975  35.808   1.462
   20    H    ILE   3           HN       ILE   3  28.461  30.654   6.805
   21    HA   ILE   3           HA       ILE   3  26.398  29.617   8.559
   22    HB   ILE   3           HB       ILE   3  29.349  30.048   9.109
   23   HG12  ILE   3          HG12      ILE   3  27.881  27.561   8.177
   24   HG13  ILE   3          HG11      ILE   3  28.818  28.612   7.114
   25   HG21  ILE   3          HG21      ILE   3  27.241  28.323  10.449
   26   HG22  ILE   3          HG22      ILE   3  28.055  29.716  11.161
   27   HG23  ILE   3          HG23      ILE   3  28.965  28.251  10.806
   28   HD11  ILE   3          HD11      ILE   3  30.828  28.209   8.485
   29   HD12  ILE   3          HD12      ILE   3  30.171  26.694   7.868
   30   HD13  ILE   3          HD13      ILE   3  29.890  27.159   9.546
   31    H    PHE   4           HN       PHE   4  25.337  30.686  10.139
   32    HA   PHE   4           HA       PHE   4  26.028  33.497  10.674
   33    HB2  PHE   4           HB2      PHE   4  23.778  31.713  11.639
   34    HB3  PHE   4           HB1      PHE   4  23.950  33.409  12.094
   35    HD1  PHE   4           HD1      PHE   4  23.163  31.071   9.373
   36    HD2  PHE   4           HD2      PHE   4  23.690  35.200  10.431
   37    HE1  PHE   4           HE1      PHE   4  22.073  31.754   7.252
   38    HE2  PHE   4           HE2      PHE   4  22.602  35.883   8.311
   39    HZ   PHE   4           HZ       PHE   4  21.793  34.160   6.721
   40    H    VAL   5           HN       VAL   5  26.514  34.324  12.744
   41    HA   VAL   5           HA       VAL   5  27.177  32.359  14.899
   42    HB   VAL   5           HB       VAL   5  29.082  34.492  13.879
   43   HG11  VAL   5          HG11      VAL   5  30.638  33.312  15.515
   44   HG12  VAL   5          HG12      VAL   5  29.206  32.514  16.167
   45   HG13  VAL   5          HG13      VAL   5  29.352  34.269  16.251
   46   HG21  VAL   5          HG21      VAL   5  28.967  32.544  12.383
   47   HG22  VAL   5          HG22      VAL   5  29.193  31.461  13.756
   48   HG23  VAL   5          HG23      VAL   5  30.495  32.544  13.262
   49    H    LYS   6           HN       LYS   6  25.646  33.130  16.344
   50    HA   LYS   6           HA       LYS   6  25.383  36.049  16.771
   51    HB2  LYS   6           HB2      LYS   6  23.911  33.685  17.972
   52    HB3  LYS   6           HB1      LYS   6  23.531  35.378  18.291
   53    HG2  LYS   6           HG2      LYS   6  23.098  35.742  15.891
   54    HG3  LYS   6           HG1      LYS   6  23.482  34.051  15.565
   55    HD2  LYS   6           HD2      LYS   6  21.626  33.344  17.033
   56    HD3  LYS   6           HD1      LYS   6  21.235  35.034  17.348
   57    HE2  LYS   6           HE2      LYS   6  20.801  35.391  14.948
   58    HE3  LYS   6           HE1      LYS   6  21.205  33.705  14.622
   59    HZ1  LYS   6           HZ1      LYS   6  18.916  34.772  16.163
   60    HZ2  LYS   6           HZ2      LYS   6  19.403  33.148  16.280
   61    HZ3  LYS   6           HZ3      LYS   6  18.884  33.778  14.790
   62    H    THR   7           HN       THR   7  26.630  37.033  18.289
   63    HA   THR   7           HA       THR   7  28.113  35.415  20.249
   64    HB   THR   7           HB       THR   7  28.002  38.429  19.943
   65    HG1  THR   7           HG1      THR   7  30.156  36.941  19.041
   66   HG21  THR   7          HG21      THR   7  29.870  36.520  21.363
   67   HG22  THR   7          HG22      THR   7  28.924  37.829  22.071
   68   HG23  THR   7          HG23      THR   7  30.294  38.197  21.023
   69    H    LEU   8           HN       LEU   8  28.017  35.959  22.583
   70    HA   LEU   8           HA       LEU   8  25.343  35.924  23.580
   71    HB2  LEU   8           HB2      LEU   8  27.243  34.976  24.830
   72    HB3  LEU   8           HB1      LEU   8  27.932  36.585  25.021
   73    HG   LEU   8           HG       LEU   8  25.958  37.289  26.322
   74   HD11  LEU   8          HD11      LEU   8  25.009  34.526  25.581
   75   HD12  LEU   8          HD12      LEU   8  24.125  36.052  25.546
   76   HD13  LEU   8          HD13      LEU   8  24.457  35.264  27.085
   77   HD21  LEU   8          HD21      LEU   8  27.781  36.411  27.610
   78   HD22  LEU   8          HD22      LEU   8  27.351  34.750  27.205
   79   HD23  LEU   8          HD23      LEU   8  26.313  35.693  28.273
   80    H    THR   9           HN       THR   9  27.674  38.554  23.152
   81    HA   THR   9           HA       THR   9  26.001  40.505  24.536
   82    HB   THR   9           HB       THR   9  27.636  42.149  23.683
   83    HG1  THR   9           HG1      THR   9  28.339  41.562  21.777
   84   HG21  THR   9          HG21      THR   9  28.110  40.636  25.678
   85   HG22  THR   9          HG22      THR   9  29.528  41.340  24.901
   86   HG23  THR   9          HG23      THR   9  29.094  39.660  24.587
   87    H    GLY  10           HN       GLY  10  25.462  38.920  21.753
   88    HA2  GLY  10           HA3      GLY  10  23.689  39.425  20.218
   89    HA3  GLY  10           HA2      GLY  10  23.800  41.125  20.673
   90    H    LYS  11           HN       LYS  11  26.864  40.741  20.359
   91    HA   LYS  11           HA       LYS  11  27.111  41.895  17.775
   92    HB2  LYS  11           HB2      LYS  11  28.869  41.895  19.613
   93    HB3  LYS  11           HB1      LYS  11  29.248  40.237  19.143
   94    HG2  LYS  11           HG2      LYS  11  29.763  40.976  16.861
   95    HG3  LYS  11           HG1      LYS  11  29.341  42.634  17.289
   96    HD2  LYS  11           HD2      LYS  11  31.140  42.650  18.986
   97    HD3  LYS  11           HD1      LYS  11  31.574  41.001  18.534
   98    HE2  LYS  11           HE2      LYS  11  32.068  41.753  16.239
   99    HE3  LYS  11           HE1      LYS  11  31.624  43.400  16.680
  100    HZ1  LYS  11           HZ1      LYS  11  33.935  43.318  16.885
  101    HZ2  LYS  11           HZ2      LYS  11  33.915  41.798  17.645
  102    HZ3  LYS  11           HZ3      LYS  11  33.374  43.175  18.479
  103    H    THR  12           HN       THR  12  25.819  40.579  16.360
  104    HA   THR  12           HA       THR  12  26.680  37.777  15.922
  105    HB   THR  12           HB       THR  12  24.455  39.406  14.658
  106    HG1  THR  12           HG1      THR  12  23.424  38.869  16.383
  107   HG21  THR  12          HG21      THR  12  23.649  37.115  13.957
  108   HG22  THR  12          HG22      THR  12  25.219  36.484  14.452
  109   HG23  THR  12          HG23      THR  12  25.113  37.656  13.140
  110    H    ILE  13           HN       ILE  13  28.290  37.391  14.503
  111    HA   ILE  13           HA       ILE  13  28.777  39.331  12.282
  112    HB   ILE  13           HB       ILE  13  30.555  37.177  13.473
  113   HG12  ILE  13          HG12      ILE  13  30.831  40.195  13.582
  114   HG13  ILE  13          HG11      ILE  13  30.105  39.242  14.876
  115   HG21  ILE  13          HG21      ILE  13  30.990  39.213  11.269
  116   HG22  ILE  13          HG22      ILE  13  31.089  37.458  11.137
  117   HG23  ILE  13          HG23      ILE  13  32.304  38.341  12.061
  118   HD11  ILE  13          HD11      ILE  13  32.937  39.014  13.822
  119   HD12  ILE  13          HD12      ILE  13  32.221  37.891  14.979
  120   HD13  ILE  13          HD13      ILE  13  32.443  39.585  15.416
  121    H    THR  14           HN       THR  14  29.196  38.422  10.150
  122    HA   THR  14           HA       THR  14  27.920  35.733   9.715
  123    HB   THR  14           HB       THR  14  28.002  38.133   7.856
  124    HG1  THR  14           HG1      THR  14  25.772  36.942   9.117
  125   HG21  THR  14          HG21      THR  14  26.847  35.351   7.616
  126   HG22  THR  14          HG22      THR  14  27.993  36.145   6.537
  127   HG23  THR  14          HG23      THR  14  26.316  36.688   6.596
  128    H    LEU  15           HN       LEU  15  29.240  34.237   8.785
  129    HA   LEU  15           HA       LEU  15  31.807  35.184   7.532
  130    HB2  LEU  15           HB2      LEU  15  31.313  32.464   8.763
  131    HB3  LEU  15           HB1      LEU  15  32.858  33.190   8.322
  132    HG   LEU  15           HG       LEU  15  31.004  34.228  10.489
  133   HD11  LEU  15          HD11      LEU  15  32.519  33.283  12.071
  134   HD12  LEU  15          HD12      LEU  15  33.709  32.915  10.823
  135   HD13  LEU  15          HD13      LEU  15  32.202  32.003  10.901
  136   HD21  LEU  15          HD21      LEU  15  33.709  35.088   9.441
  137   HD22  LEU  15          HD22      LEU  15  33.162  35.522  11.060
  138   HD23  LEU  15          HD23      LEU  15  32.258  36.070   9.648
  139    H    GLU  16           HN       GLU  16  31.636  34.998   5.349
  140    HA   GLU  16           HA       GLU  16  29.969  32.809   4.198
  141    HB2  GLU  16           HB2      GLU  16  30.529  34.174   2.030
  142    HB3  GLU  16           HB1      GLU  16  29.367  34.838   3.177
  143    HG2  GLU  16           HG2      GLU  16  31.071  36.255   4.172
  144    HG3  GLU  16           HG1      GLU  16  32.320  35.519   3.169
  145    H    VAL  17           HN       VAL  17  31.073  30.982   3.758
  146    HA   VAL  17           HA       VAL  17  33.478  31.068   2.133
  147    HB   VAL  17           HB       VAL  17  34.526  31.468   4.299
  148   HG11  VAL  17          HG11      VAL  17  33.335  28.850   5.237
  149   HG12  VAL  17          HG12      VAL  17  32.572  30.404   5.577
  150   HG13  VAL  17          HG13      VAL  17  34.185  30.061   6.196
  151   HG21  VAL  17          HG21      VAL  17  36.092  29.647   4.269
  152   HG22  VAL  17          HG22      VAL  17  35.542  29.862   2.608
  153   HG23  VAL  17          HG23      VAL  17  34.892  28.548   3.588
  154    H    GLU  18           HN       GLU  18  34.027  28.930   1.335
  155    HA   GLU  18           HA       GLU  18  31.974  27.244   0.651
  156    HB2  GLU  18           HB2      GLU  18  34.839  26.490   1.298
  157    HB3  GLU  18           HB1      GLU  18  33.710  25.416   0.473
  158    HG2  GLU  18           HG2      GLU  18  34.390  28.200  -0.508
  159    HG3  GLU  18           HG1      GLU  18  35.202  26.740  -1.076
  160    HA   PRO  19           HA       PRO  19  30.631  25.294   4.407
  161    HB2  PRO  19           HB2      PRO  19  29.580  22.946   3.464
  162    HB3  PRO  19           HB1      PRO  19  28.801  24.521   3.216
  163    HG2  PRO  19           HG2      PRO  19  30.522  22.953   1.340
  164    HG3  PRO  19           HG1      PRO  19  29.011  23.825   1.018
  165    HD2  PRO  19           HD2      PRO  19  31.446  24.882   0.410
  166    HD3  PRO  19           HD1      PRO  19  30.070  25.896   0.897
  167    H    SER  20           HN       SER  20  32.921  23.593   2.360
  168    HA   SER  20           HA       SER  20  33.411  21.458   4.268
  169    HB2  SER  20           HB2      SER  20  35.556  21.209   2.819
  170    HB3  SER  20           HB1      SER  20  33.992  20.896   2.067
  171    HG   SER  20           HG       SER  20  34.045  22.994   1.225
  172    H    ASP  21           HN       ASP  21  33.687  24.440   4.978
  173    HA   ASP  21           HA       ASP  21  36.463  24.860   5.637
  174    HB2  ASP  21           HB2      ASP  21  33.900  26.231   6.085
  175    HB3  ASP  21           HB1      ASP  21  34.958  26.364   7.481
  176    H    THR  22           HN       THR  22  37.574  24.290   7.515
  177    HA   THR  22           HA       THR  22  36.302  22.206   9.172
  178    HB   THR  22           HB       THR  22  38.541  21.866  10.080
  179    HG1  THR  22           HG1      THR  22  38.860  24.401   9.062
  180   HG21  THR  22          HG21      THR  22  38.550  22.347   7.089
  181   HG22  THR  22          HG22      THR  22  38.096  20.852   7.906
  182   HG23  THR  22          HG23      THR  22  39.766  21.413   7.960
  183    H    ILE  23           HN       ILE  23  35.914  22.409  11.388
  184    HA   ILE  23           HA       ILE  23  35.046  24.836  12.448
  185    HB   ILE  23           HB       ILE  23  36.378  22.703  14.135
  186   HG12  ILE  23          HG12      ILE  23  34.890  21.511  12.655
  187   HG13  ILE  23          HG11      ILE  23  34.067  21.670  14.200
  188   HG21  ILE  23          HG21      ILE  23  34.910  23.445  15.858
  189   HG22  ILE  23          HG22      ILE  23  33.929  24.373  14.724
  190   HG23  ILE  23          HG23      ILE  23  35.557  24.914  15.128
  191   HD11  ILE  23          HD11      ILE  23  32.420  22.269  12.616
  192   HD12  ILE  23          HD12      ILE  23  33.564  23.198  11.649
  193   HD13  ILE  23          HD13      ILE  23  33.019  23.817  13.208
  194    H    GLU  24           HN       GLU  24  38.288  23.394  12.818
  195    HA   GLU  24           HA       GLU  24  39.423  25.439  14.416
  196    HB2  GLU  24           HB2      GLU  24  41.608  24.684  13.375
  197    HB3  GLU  24           HB1      GLU  24  40.644  23.391  14.090
  198    HG2  GLU  24           HG2      GLU  24  39.720  22.865  11.846
  199    HG3  GLU  24           HG1      GLU  24  40.741  24.122  11.148
  200    H    ASN  25           HN       ASN  25  38.964  25.236  10.902
  201    HA   ASN  25           HA       ASN  25  40.533  27.564  10.269
  202    HB2  ASN  25           HB2      ASN  25  39.859  25.886   8.568
  203    HB3  ASN  25           HB1      ASN  25  38.174  26.365   8.775
  204   HD21  ASN  25          HD21      ASN  25  41.252  27.309   7.359
  205   HD22  ASN  25          HD22      ASN  25  40.670  28.680   6.545
  206    H    VAL  26           HN       VAL  26  37.044  27.061  10.817
  207    HA   VAL  26           HA       VAL  26  36.211  29.744  10.435
  208    HB   VAL  26           HB       VAL  26  35.118  27.812  12.502
  209   HG11  VAL  26          HG11      VAL  26  32.980  29.004  11.900
  210   HG12  VAL  26          HG12      VAL  26  33.949  30.140  10.961
  211   HG13  VAL  26          HG13      VAL  26  34.174  30.021  12.706
  212   HG21  VAL  26          HG21      VAL  26  35.196  26.580  10.459
  213   HG22  VAL  26          HG22      VAL  26  34.711  27.985   9.510
  214   HG23  VAL  26          HG23      VAL  26  33.547  27.196  10.576
  215    H    LYS  27           HN       LYS  27  36.793  28.129  13.564
  216    HA   LYS  27           HA       LYS  27  36.762  30.252  15.302
  217    HB2  LYS  27           HB2      LYS  27  38.714  27.936  15.203
  218    HB3  LYS  27           HB1      LYS  27  38.588  29.036  16.576
  219    HG2  LYS  27           HG2      LYS  27  36.105  28.469  16.645
  220    HG3  LYS  27           HG1      LYS  27  36.455  27.187  15.490
  221    HD2  LYS  27           HD2      LYS  27  37.983  26.121  17.030
  222    HD3  LYS  27           HD1      LYS  27  37.861  27.472  18.158
  223    HE2  LYS  27           HE2      LYS  27  35.455  26.994  18.464
  224    HE3  LYS  27           HE1      LYS  27  35.589  25.629  17.357
  225    HZ1  LYS  27           HZ1      LYS  27  36.202  25.734  20.106
  226    HZ2  LYS  27           HZ2      LYS  27  37.610  25.349  19.237
  227    HZ3  LYS  27           HZ3      LYS  27  36.216  24.395  19.065
  228    H    ALA  28           HN       ALA  28  39.237  29.583  12.903
  229    HA   ALA  28           HA       ALA  28  41.210  31.417  13.926
  230    HB1  ALA  28           HB1      ALA  28  41.454  29.568  12.111
  231    HB2  ALA  28           HB2      ALA  28  42.351  31.070  11.890
  232    HB3  ALA  28           HB3      ALA  28  40.859  30.794  10.992
  233    H    LYS  29           HN       LYS  29  38.941  31.781  11.175
  234    HA   LYS  29           HA       LYS  29  39.378  34.506  10.661
  235    HB2  LYS  29           HB2      LYS  29  36.934  32.754  10.401
  236    HB3  LYS  29           HB1      LYS  29  36.838  34.469  10.006
  237    HG2  LYS  29           HG2      LYS  29  37.344  33.230   7.977
  238    HG3  LYS  29           HG1      LYS  29  38.768  34.163   8.436
  239    HD2  LYS  29           HD2      LYS  29  39.857  32.228   9.335
  240    HD3  LYS  29           HD1      LYS  29  38.374  31.276   9.251
  241    HE2  LYS  29           HE2      LYS  29  38.408  31.389   6.804
  242    HE3  LYS  29           HE1      LYS  29  39.849  32.407   6.855
  243    HZ1  LYS  29           HZ1      LYS  29  41.168  30.677   7.475
  244    HZ2  LYS  29           HZ2      LYS  29  40.022  29.826   6.553
  245    HZ3  LYS  29           HZ3      LYS  29  39.916  29.833   8.249
  246    H    ILE  30           HN       ILE  30  37.652  33.010  13.298
  247    HA   ILE  30           HA       ILE  30  36.402  35.514  14.174
  248    HB   ILE  30           HB       ILE  30  36.658  32.761  15.416
  249   HG12  ILE  30          HG12      ILE  30  34.225  34.277  14.431
  250   HG13  ILE  30          HG11      ILE  30  35.141  33.162  13.419
  251   HG21  ILE  30          HG21      ILE  30  35.360  35.290  16.464
  252   HG22  ILE  30          HG22      ILE  30  36.562  34.284  17.274
  253   HG23  ILE  30          HG23      ILE  30  34.918  33.685  17.044
  254   HD11  ILE  30          HD11      ILE  30  34.703  31.332  14.978
  255   HD12  ILE  30          HD12      ILE  30  33.177  32.070  14.488
  256   HD13  ILE  30          HD13      ILE  30  33.865  32.434  16.071
  257    H    GLN  31           HN       GLN  31  38.709  33.324  15.770
  258    HA   GLN  31           HA       GLN  31  39.660  34.822  17.834
  259    HB2  GLN  31           HB2      GLN  31  40.523  32.601  17.289
  260    HB3  GLN  31           HB1      GLN  31  41.343  33.244  15.871
  261    HG2  GLN  31           HG2      GLN  31  42.791  34.593  17.224
  262    HG3  GLN  31           HG1      GLN  31  41.887  34.207  18.687
  263   HE21  GLN  31          HE21      GLN  31  44.336  33.515  19.193
  264   HE22  GLN  31          HE22      GLN  31  44.693  31.883  18.882
  265    H    ASP  32           HN       ASP  32  40.824  35.165  14.484
  266    HA   ASP  32           HA       ASP  32  42.632  37.340  15.111
  267    HB2  ASP  32           HB2      ASP  32  42.898  35.926  13.099
  268    HB3  ASP  32           HB1      ASP  32  41.400  36.587  12.444
  269    H    LYS  33           HN       LYS  33  39.499  37.327  13.423
  270    HA   LYS  33           HA       LYS  33  39.235  40.130  13.188
  271    HB2  LYS  33           HB2      LYS  33  37.064  38.072  13.498
  272    HB3  LYS  33           HB1      LYS  33  36.813  39.708  12.921
  273    HG2  LYS  33           HG2      LYS  33  38.824  37.909  11.567
  274    HG3  LYS  33           HG1      LYS  33  37.113  37.774  11.172
  275    HD2  LYS  33           HD2      LYS  33  38.729  40.333  10.995
  276    HD3  LYS  33           HD1      LYS  33  38.355  39.291   9.632
  277    HE2  LYS  33           HE2      LYS  33  35.845  39.642  10.559
  278    HE3  LYS  33           HE1      LYS  33  36.562  41.150  11.129
  279    HZ1  LYS  33           HZ1      LYS  33  36.669  41.939   9.073
  280    HZ2  LYS  33           HZ2      LYS  33  35.652  40.659   8.614
  281    HZ3  LYS  33           HZ3      LYS  33  37.336  40.507   8.454
  282    H    GLU  34           HN       GLU  34  38.174  38.023  15.863
  283    HA   GLU  34           HA       GLU  34  37.197  40.398  17.338
  284    HB2  GLU  34           HB2      GLU  34  37.304  37.558  18.370
  285    HB3  GLU  34           HB1      GLU  34  36.255  38.872  18.893
  286    HG2  GLU  34           HG2      GLU  34  36.179  37.473  16.206
  287    HG3  GLU  34           HG1      GLU  34  34.969  37.361  17.487
  288    H    GLY  35           HN       GLY  35  39.897  38.116  17.384
  289    HA2  GLY  35           HA3      GLY  35  42.002  38.440  18.421
  290    HA3  GLY  35           HA2      GLY  35  41.398  39.946  19.109
  291    H    ILE  36           HN       ILE  36  39.472  37.110  19.495
  292    HA   ILE  36           HA       ILE  36  40.068  37.086  22.404
  293    HB   ILE  36           HB       ILE  36  37.725  35.901  20.926
  294   HG12  ILE  36          HG12      ILE  36  38.046  38.618  22.242
  295   HG13  ILE  36          HG11      ILE  36  37.861  38.329  20.513
  296   HG21  ILE  36          HG21      ILE  36  38.339  35.149  23.290
  297   HG22  ILE  36          HG22      ILE  36  36.714  35.801  23.086
  298   HG23  ILE  36          HG23      ILE  36  37.981  36.796  23.799
  299   HD11  ILE  36          HD11      ILE  36  35.681  37.200  21.011
  300   HD12  ILE  36          HD12      ILE  36  35.702  38.922  21.382
  301   HD13  ILE  36          HD13      ILE  36  35.847  37.740  22.681
  302    HA   PRO  37           HA       PRO  37  42.344  33.260  21.134
  303    HB2  PRO  37           HB2      PRO  37  42.421  33.136  24.137
  304    HB3  PRO  37           HB1      PRO  37  43.712  32.794  22.965
  305    HG2  PRO  37           HG2      PRO  37  43.678  35.088  24.282
  306    HG3  PRO  37           HG1      PRO  37  44.121  35.042  22.565
  307    HD2  PRO  37           HD2      PRO  37  41.581  36.004  23.827
  308    HD3  PRO  37           HD1      PRO  37  42.399  36.579  22.357
  309    HA   PRO  38           HA       PRO  38  38.559  30.703  21.313
  310    HB2  PRO  38           HB2      PRO  38  40.737  28.663  21.042
  311    HB3  PRO  38           HB1      PRO  38  39.131  28.694  20.278
  312    HG2  PRO  38           HG2      PRO  38  41.209  29.492  18.919
  313    HG3  PRO  38           HG1      PRO  38  39.714  30.425  18.838
  314    HD2  PRO  38           HD2      PRO  38  42.272  31.091  20.246
  315    HD3  PRO  38           HD1      PRO  38  41.062  32.179  19.524
  316    H    ASP  39           HN       ASP  39  41.328  30.448  23.385
  317    HA   ASP  39           HA       ASP  39  40.477  28.366  25.124
  318    HB2  ASP  39           HB2      ASP  39  42.198  30.803  25.607
  319    HB3  ASP  39           HB1      ASP  39  41.941  29.556  26.828
  320    H    GLN  40           HN       GLN  40  39.819  31.858  25.211
  321    HA   GLN  40           HA       GLN  40  38.125  31.557  27.594
  322    HB2  GLN  40           HB2      GLN  40  38.758  33.970  25.870
  323    HB3  GLN  40           HB1      GLN  40  37.913  34.001  27.415
  324    HG2  GLN  40           HG2      GLN  40  39.929  32.948  28.476
  325    HG3  GLN  40           HG1      GLN  40  40.771  33.123  26.936
  326   HE21  GLN  40          HE21      GLN  40  42.093  34.940  26.984
  327   HE22  GLN  40          HE22      GLN  40  41.703  36.415  27.729
  328    H    GLN  41           HN       GLN  41  37.510  30.583  24.641
  329    HA   GLN  41           HA       GLN  41  34.705  31.655  24.629
  330    HB2  GLN  41           HB2      GLN  41  36.446  31.146  22.200
  331    HB3  GLN  41           HB1      GLN  41  34.759  31.658  22.171
  332    HG2  GLN  41           HG2      GLN  41  35.363  33.715  23.397
  333    HG3  GLN  41           HG1      GLN  41  37.051  33.208  23.408
  334   HE21  GLN  41          HE21      GLN  41  34.927  35.164  21.731
  335   HE22  GLN  41          HE22      GLN  41  35.707  35.188  20.224
  336    H    ARG  42           HN       ARG  42  33.129  30.170  24.201
  337    HA   ARG  42           HA       ARG  42  33.935  27.382  23.473
  338    HB2  ARG  42           HB2      ARG  42  32.103  28.264  25.730
  339    HB3  ARG  42           HB1      ARG  42  32.117  26.619  25.098
  340    HG2  ARG  42           HG2      ARG  42  34.752  27.825  25.899
  341    HG3  ARG  42           HG1      ARG  42  33.651  27.336  27.185
  342    HD2  ARG  42           HD2      ARG  42  35.405  25.610  26.149
  343    HD3  ARG  42           HD1      ARG  42  33.801  25.082  26.656
  344    HE   ARG  42           HE       ARG  42  33.376  25.753  24.038
  345   HH11  ARG  42          HH11      ARG  42  33.730  24.366  22.290
  346   HH12  ARG  42          HH12      ARG  42  34.895  23.092  22.434
  347   HH21  ARG  42          HH21      ARG  42  35.767  23.897  25.691
  348   HH22  ARG  42          HH22      ARG  42  36.048  22.827  24.359
  349    H    LEU  43           HN       LEU  43  32.746  26.792  21.655
  350    HA   LEU  43           HA       LEU  43  30.473  28.500  20.891
  351    HB2  LEU  43           HB2      LEU  43  31.540  26.082  19.439
  352    HB3  LEU  43           HB1      LEU  43  30.604  27.429  18.771
  353    HG   LEU  43           HG       LEU  43  33.488  27.398  19.691
  354   HD11  LEU  43          HD11      LEU  43  33.819  28.373  17.445
  355   HD12  LEU  43          HD12      LEU  43  32.077  28.305  17.177
  356   HD13  LEU  43          HD13      LEU  43  32.998  26.814  17.360
  357   HD21  LEU  43          HD21      LEU  43  33.420  29.892  19.213
  358   HD22  LEU  43          HD22      LEU  43  32.614  29.395  20.695
  359   HD23  LEU  43          HD23      LEU  43  31.662  29.777  19.263
  360    H    ILE  44           HN       ILE  44  28.363  27.698  20.541
  361    HA   ILE  44           HA       ILE  44  27.732  25.001  21.705
  362    HB   ILE  44           HB       ILE  44  26.137  27.577  21.950
  363   HG12  ILE  44          HG12      ILE  44  28.042  27.549  23.479
  364   HG13  ILE  44          HG11      ILE  44  26.559  27.293  24.391
  365   HG21  ILE  44          HG21      ILE  44  24.611  25.701  21.734
  366   HG22  ILE  44          HG22      ILE  44  24.671  26.136  23.445
  367   HG23  ILE  44          HG23      ILE  44  25.566  24.733  22.858
  368   HD11  ILE  44          HD11      ILE  44  27.878  25.620  25.297
  369   HD12  ILE  44          HD12      ILE  44  28.782  25.375  23.807
  370   HD13  ILE  44          HD13      ILE  44  27.157  24.720  23.966
  371    H    PHE  45           HN       PHE  45  26.483  23.740  20.351
  372    HA   PHE  45           HA       PHE  45  24.929  25.056  18.190
  373    HB2  PHE  45           HB2      PHE  45  27.058  24.692  17.118
  374    HB3  PHE  45           HB1      PHE  45  27.162  23.052  17.758
  375    HD1  PHE  45           HD1      PHE  45  25.573  25.233  15.259
  376    HD2  PHE  45           HD2      PHE  45  25.784  21.254  16.852
  377    HE1  PHE  45           HE1      PHE  45  24.364  24.375  13.267
  378    HE2  PHE  45           HE2      PHE  45  24.578  20.391  14.860
  379    HZ   PHE  45           HZ       PHE  45  23.867  21.953  13.070
  380    H    ALA  46           HN       ALA  46  22.960  24.181  18.334
  381    HA   ALA  46           HA       ALA  46  21.241  22.636  18.697
  382    HB1  ALA  46           HB1      ALA  46  21.545  20.500  17.616
  383    HB2  ALA  46           HB2      ALA  46  23.299  20.652  17.705
  384    HB3  ALA  46           HB3      ALA  46  22.375  21.719  16.650
  385    H    GLY  47           HN       GLY  47  23.387  22.978  20.933
  386    HA2  GLY  47           HA3      GLY  47  23.145  22.123  23.159
  387    HA3  GLY  47           HA2      GLY  47  22.403  20.663  22.511
  388    H    LYS  48           HN       LYS  48  24.985  21.159  20.552
  389    HA   LYS  48           HA       LYS  48  26.881  19.644  22.316
  390    HB2  LYS  48           HB2      LYS  48  26.510  19.259  19.357
  391    HB3  LYS  48           HB1      LYS  48  27.540  18.311  20.418
  392    HG2  LYS  48           HG2      LYS  48  24.533  18.506  20.746
  393    HG3  LYS  48           HG1      LYS  48  25.326  17.219  19.842
  394    HD2  LYS  48           HD2      LYS  48  26.705  16.794  21.973
  395    HD3  LYS  48           HD1      LYS  48  25.534  17.822  22.797
  396    HE2  LYS  48           HE2      LYS  48  23.703  16.355  22.047
  397    HE3  LYS  48           HE1      LYS  48  24.867  15.324  21.218
  398    HZ1  LYS  48           HZ1      LYS  48  24.164  15.391  23.974
  399    HZ2  LYS  48           HZ2      LYS  48  25.838  15.594  23.768
  400    HZ3  LYS  48           HZ3      LYS  48  25.059  14.229  23.122
  401    H    GLN  49           HN       GLN  49  29.135  20.111  21.932
  402    HA   GLN  49           HA       GLN  49  29.581  22.774  20.785
  403    HB2  GLN  49           HB2      GLN  49  31.390  20.934  22.309
  404    HB3  GLN  49           HB1      GLN  49  31.821  22.559  21.801
  405    HG2  GLN  49           HG2      GLN  49  30.047  23.507  23.162
  406    HG3  GLN  49           HG1      GLN  49  29.454  21.899  23.576
  407   HE21  GLN  49          HE21      GLN  49  30.653  24.122  25.326
  408   HE22  GLN  49          HE22      GLN  49  31.904  23.350  26.175
  409    H    LEU  50           HN       LEU  50  31.626  23.028  19.403
  410    HA   LEU  50           HA       LEU  50  31.675  20.846  17.376
  411    HB2  LEU  50           HB2      LEU  50  32.942  23.597  17.253
  412    HB3  LEU  50           HB1      LEU  50  32.699  22.481  15.912
  413    HG   LEU  50           HG       LEU  50  30.471  23.719  17.553
  414   HD11  LEU  50          HD11      LEU  50  31.213  24.319  14.681
  415   HD12  LEU  50          HD12      LEU  50  31.826  25.271  16.035
  416   HD13  LEU  50          HD13      LEU  50  30.092  25.201  15.719
  417   HD21  LEU  50          HD21      LEU  50  29.163  22.858  15.461
  418   HD22  LEU  50          HD22      LEU  50  29.624  21.688  16.693
  419   HD23  LEU  50          HD23      LEU  50  30.563  21.817  15.206
  420    H    GLU  51           HN       GLU  51  33.391  19.481  17.259
  421    HA   GLU  51           HA       GLU  51  35.774  20.050  18.970
  422    HB2  GLU  51           HB2      GLU  51  34.877  17.478  17.634
  423    HB3  GLU  51           HB1      GLU  51  36.244  17.646  18.735
  424    HG2  GLU  51           HG2      GLU  51  33.378  18.319  19.462
  425    HG3  GLU  51           HG1      GLU  51  34.174  16.797  19.862
  426    H    ASP  52           HN       ASP  52  37.912  19.599  18.073
  427    HA   ASP  52           HA       ASP  52  38.185  20.592  15.341
  428    HB2  ASP  52           HB2      ASP  52  40.179  19.645  17.415
  429    HB3  ASP  52           HB1      ASP  52  40.656  20.195  15.809
  430    H    GLY  53           HN       GLY  53  39.308  19.395  13.631
  431    HA2  GLY  53           HA3      GLY  53  40.013  17.404  12.521
  432    HA3  GLY  53           HA2      GLY  53  39.585  16.474  13.958
  433    H    ARG  54           HN       ARG  54  37.367  18.785  12.600
  434    HA   ARG  54           HA       ARG  54  35.838  16.676  11.176
  435    HB2  ARG  54           HB2      ARG  54  34.618  18.327  13.412
  436    HB3  ARG  54           HB1      ARG  54  33.783  17.130  12.420
  437    HG2  ARG  54           HG2      ARG  54  35.474  15.425  13.252
  438    HG3  ARG  54           HG1      ARG  54  36.011  16.641  14.412
  439    HD2  ARG  54           HD2      ARG  54  34.404  15.358  15.594
  440    HD3  ARG  54           HD1      ARG  54  33.538  16.816  15.110
  441    HE   ARG  54           HE       ARG  54  33.110  14.987  13.039
  442   HH11  ARG  54          HH11      ARG  54  31.283  13.655  13.013
  443   HH12  ARG  54          HH12      ARG  54  30.470  13.292  14.497
  444   HH21  ARG  54          HH21      ARG  54  32.635  15.171  16.448
  445   HH22  ARG  54          HH22      ARG  54  31.235  14.152  16.442
  446    H    THR  55           HN       THR  55  34.416  17.533   9.607
  447    HA   THR  55           HA       THR  55  34.494  20.503   9.216
  448    HB   THR  55           HB       THR  55  34.533  18.296   7.124
  449    HG1  THR  55           HG1      THR  55  36.441  20.081   8.160
  450   HG21  THR  55          HG21      THR  55  34.965  20.386   5.637
  451   HG22  THR  55          HG22      THR  55  34.224  21.286   6.959
  452   HG23  THR  55          HG23      THR  55  33.310  20.029   6.124
  453    H    LEU  56           HN       LEU  56  32.495  21.104   7.703
  454    HA   LEU  56           HA       LEU  56  30.126  20.185   9.048
  455    HB2  LEU  56           HB2      LEU  56  30.614  21.829   6.567
  456    HB3  LEU  56           HB1      LEU  56  28.982  21.392   7.058
  457    HG   LEU  56           HG       LEU  56  29.368  22.442   9.264
  458   HD11  LEU  56          HD11      LEU  56  31.712  22.231   9.605
  459   HD12  LEU  56          HD12      LEU  56  31.446  23.959   9.386
  460   HD13  LEU  56          HD13      LEU  56  32.086  22.993   8.058
  461   HD21  LEU  56          HD21      LEU  56  30.167  24.410   7.109
  462   HD22  LEU  56          HD22      LEU  56  29.140  24.687   8.517
  463   HD23  LEU  56          HD23      LEU  56  28.548  23.712   7.171
  464    H    SER  57           HN       SER  57  31.273  19.652   5.684
  465    HA   SER  57           HA       SER  57  29.222  17.765   5.018
  466    HB2  SER  57           HB2      SER  57  30.655  18.829   3.308
  467    HB3  SER  57           HB1      SER  57  32.058  17.978   3.948
  468    HG   SER  57           HG       SER  57  30.941  16.015   3.457
  469    H    ASP  58           HN       ASP  58  32.499  17.367   6.286
  470    HA   ASP  58           HA       ASP  58  32.530  14.525   6.386
  471    HB2  ASP  58           HB2      ASP  58  34.525  15.981   6.772
  472    HB3  ASP  58           HB1      ASP  58  33.856  16.419   8.344
  473    H    TYR  59           HN       TYR  59  30.939  16.881   8.456
  474    HA   TYR  59           HA       TYR  59  30.510  15.016  10.647
  475    HB2  TYR  59           HB2      TYR  59  29.993  17.802  10.108
  476    HB3  TYR  59           HB1      TYR  59  28.468  17.075  10.592
  477    HD1  TYR  59           HD1      TYR  59  31.538  18.466  11.752
  478    HD2  TYR  59           HD2      TYR  59  28.540  15.545  12.722
  479    HE1  TYR  59           HE1      TYR  59  32.255  18.518  14.125
  480    HE2  TYR  59           HE2      TYR  59  29.258  15.596  15.094
  481    HH   TYR  59           HH       TYR  59  30.427  17.269  16.623
  482    H    ASN  60           HN       ASN  60  29.009  15.630   7.580
  483    HA   ASN  60           HA       ASN  60  27.171  14.631   6.528
  484    HB2  ASN  60           HB2      ASN  60  27.496  12.489   8.649
  485    HB3  ASN  60           HB1      ASN  60  26.724  12.316   7.074
  486   HD21  ASN  60          HD21      ASN  60  29.478  11.407   8.552
  487   HD22  ASN  60          HD22      ASN  60  30.576  11.507   7.262
  488    H    ILE  61           HN       ILE  61  26.257  16.633   7.959
  489    HA   ILE  61           HA       ILE  61  24.500  15.953  10.143
  490    HB   ILE  61           HB       ILE  61  24.340  18.328   8.259
  491   HG12  ILE  61          HG12      ILE  61  25.748  18.112  10.937
  492   HG13  ILE  61          HG11      ILE  61  26.579  17.981   9.386
  493   HG21  ILE  61          HG21      ILE  61  22.330  17.982   9.651
  494   HG22  ILE  61          HG22      ILE  61  23.220  19.407  10.182
  495   HG23  ILE  61          HG23      ILE  61  23.339  17.903  11.094
  496   HD11  ILE  61          HD11      ILE  61  25.621  20.235   8.777
  497   HD12  ILE  61          HD12      ILE  61  26.764  20.276  10.120
  498   HD13  ILE  61          HD13      ILE  61  25.031  20.366  10.435
  499    H    GLN  62           HN       GLN  62  22.371  15.283  10.089
  500    HA   GLN  62           HA       GLN  62  21.330  14.098   7.707
  501    HB2  GLN  62           HB2      GLN  62  20.007  14.867  10.321
  502    HB3  GLN  62           HB1      GLN  62  19.176  13.981   9.042
  503    HG2  GLN  62           HG2      GLN  62  20.755  12.158   9.183
  504    HG3  GLN  62           HG1      GLN  62  21.782  13.070  10.290
  505   HE21  GLN  62          HE21      GLN  62  20.414  10.452  10.803
  506   HE22  GLN  62          HE22      GLN  62  19.419  10.714  12.153
  507    H    LYS  63           HN       LYS  63  20.251  17.061   9.429
  508    HA   LYS  63           HA       LYS  63  18.423  17.799   7.312
  509    HB2  LYS  63           HB2      LYS  63  19.631  19.647   9.384
  510    HB3  LYS  63           HB1      LYS  63  18.091  19.832   8.544
  511    HG2  LYS  63           HG2      LYS  63  18.763  17.581  10.466
  512    HG3  LYS  63           HG1      LYS  63  17.786  18.993  10.861
  513    HD2  LYS  63           HD2      LYS  63  16.313  18.303   8.848
  514    HD3  LYS  63           HD1      LYS  63  17.142  16.750   8.947
  515    HE2  LYS  63           HE2      LYS  63  15.660  18.065  11.241
  516    HE3  LYS  63           HE1      LYS  63  15.023  16.757  10.245
  517    HZ1  LYS  63           HZ1      LYS  63  17.411  15.783  10.979
  518    HZ2  LYS  63           HZ2      LYS  63  15.954  15.458  11.790
  519    HZ3  LYS  63           HZ3      LYS  63  16.992  16.678  12.357
  520    H    GLU  64           HN       GLU  64  21.794  18.475   7.998
  521    HA   GLU  64           HA       GLU  64  23.306  19.980   6.952
  522    HB2  GLU  64           HB2      GLU  64  23.532  19.305   4.499
  523    HB3  GLU  64           HB1      GLU  64  23.678  18.009   5.685
  524    HG2  GLU  64           HG2      GLU  64  21.386  17.312   5.286
  525    HG3  GLU  64           HG1      GLU  64  21.111  18.694   4.224
  526    H    SEP  65           HN       SEP  65  21.717  21.846   7.438
  527    HA   SEP  65           HA       SEP  65  21.200  23.258   4.872
  528    HB2  SEP  65           HB1      SEP  65  19.139  23.079   7.092
  529    HB3  SEP  65           HB2      SEP  65  19.055  22.166   5.589
  530    H    TPO  66           HN       TPO  66  19.688  25.287   6.586
  531    HA   TPO  66           HA       TPO  66  21.747  27.120   7.062
  532    HB   TPO  66           HB       TPO  66  19.296  27.646   7.105
  533   HG21  TPO  66          HG21      TPO  66  18.818  25.649   8.654
  534   HG22  TPO  66          HG22      TPO  66  17.959  27.150   9.000
  535   HG23  TPO  66          HG23      TPO  66  19.360  26.692   9.969
  536    H    LEU  67           HN       LEU  67  23.307  27.307   8.611
  537    HA   LEU  67           HA       LEU  67  23.163  25.472  10.989
  538    HB2  LEU  67           HB2      LEU  67  25.665  26.669   9.784
  539    HB3  LEU  67           HB1      LEU  67  25.546  25.338  10.935
  540    HG   LEU  67           HG       LEU  67  24.533  25.293   8.077
  541   HD11  LEU  67          HD11      LEU  67  26.347  23.485   7.920
  542   HD12  LEU  67          HD12      LEU  67  26.969  24.134   9.438
  543   HD13  LEU  67          HD13      LEU  67  26.902  25.157   8.001
  544   HD21  LEU  67          HD21      LEU  67  24.433  23.309  10.357
  545   HD22  LEU  67          HD22      LEU  67  24.359  22.776   8.678
  546   HD23  LEU  67          HD23      LEU  67  23.116  23.849   9.315
  547    H    HIS  68           HN       HIS  68  22.732  26.560  12.815
  548    HA   HIS  68           HA       HIS  68  23.500  29.438  13.035
  549    HB2  HIS  68           HB2      HIS  68  21.945  29.454  14.965
  550    HB3  HIS  68           HB1      HIS  68  21.145  28.895  13.496
  551    HD1  HIS  68           HD1      HIS  68  22.637  27.580  16.721
  552    HD2  HIS  68           HD2      HIS  68  20.208  26.250  13.601
  553    HE1  HIS  68           HE1      HIS  68  21.743  25.313  17.422
  554    HE2  HIS  68           HE2      HIS  68  20.265  24.495  15.530
  555    H    LEU  69           HN       LEU  69  25.256  29.938  14.221
  556    HA   LEU  69           HA       LEU  69  26.240  27.981  16.285
  557    HB2  LEU  69           HB2      LEU  69  27.698  29.736  14.305
  558    HB3  LEU  69           HB1      LEU  69  28.480  29.304  15.821
  559    HG   LEU  69           HG       LEU  69  28.028  26.880  15.284
  560   HD11  LEU  69          HD11      LEU  69  27.712  26.566  12.689
  561   HD12  LEU  69          HD12      LEU  69  26.965  28.161  12.771
  562   HD13  LEU  69          HD13      LEU  69  26.301  26.826  13.707
  563   HD21  LEU  69          HD21      LEU  69  29.669  28.422  13.249
  564   HD22  LEU  69          HD22      LEU  69  29.879  26.724  13.680
  565   HD23  LEU  69          HD23      LEU  69  30.213  27.983  14.868
  566    H    VAL  70           HN       VAL  70  26.822  28.890  18.322
  567    HA   VAL  70           HA       VAL  70  26.357  31.829  18.657
  568    HB   VAL  70           HB       VAL  70  25.356  29.641  20.508
  569   HG11  VAL  70          HG11      VAL  70  24.212  31.548  21.630
  570   HG12  VAL  70          HG12      VAL  70  25.046  32.659  20.543
  571   HG13  VAL  70          HG13      VAL  70  25.968  31.692  21.693
  572   HG21  VAL  70          HG21      VAL  70  23.946  29.630  18.579
  573   HG22  VAL  70          HG22      VAL  70  23.976  31.389  18.459
  574   HG23  VAL  70          HG23      VAL  70  23.099  30.610  19.776
  575    H    LEU  71           HN       LEU  71  28.327  32.582  19.284
  576    HA   LEU  71           HA       LEU  71  30.207  30.857  20.728
  577    HB2  LEU  71           HB2      LEU  71  30.854  32.533  18.940
  578    HB3  LEU  71           HB1      LEU  71  30.444  33.813  20.075
  579    HG   LEU  71           HG       LEU  71  32.333  31.697  21.069
  580   HD11  LEU  71          HD11      LEU  71  33.218  33.886  19.168
  581   HD12  LEU  71          HD12      LEU  71  33.155  32.171  18.767
  582   HD13  LEU  71          HD13      LEU  71  34.267  32.746  20.009
  583   HD21  LEU  71          HD21      LEU  71  32.197  34.726  21.306
  584   HD22  LEU  71          HD22      LEU  71  33.412  33.714  22.085
  585   HD23  LEU  71          HD23      LEU  71  31.719  33.560  22.537
  586    H    ARG  72           HN       ARG  72  30.798  31.092  22.911
  587    HA   ARG  72           HA       ARG  72  29.128  32.979  24.542
  588    HB2  ARG  72           HB2      ARG  72  28.661  30.550  24.920
  589    HB3  ARG  72           HB1      ARG  72  30.354  30.325  25.361
  590    HG2  ARG  72           HG2      ARG  72  30.121  31.878  27.226
  591    HG3  ARG  72           HG1      ARG  72  28.458  32.235  26.756
  592    HD2  ARG  72           HD2      ARG  72  27.816  29.905  27.164
  593    HD3  ARG  72           HD1      ARG  72  29.483  29.501  27.576
  594    HE   ARG  72           HE       ARG  72  27.577  30.915  29.296
  595   HH11  ARG  72          HH11      ARG  72  28.341  31.384  31.372
  596   HH12  ARG  72          HH12      ARG  72  30.035  31.246  31.709
  597   HH21  ARG  72          HH21      ARG  72  30.862  30.242  28.495
  598   HH22  ARG  72          HH22      ARG  72  31.462  30.599  30.080
  599    H    LEU  73           HN       LEU  73  30.263  33.944  26.391
  600    HA   LEU  73           HA       LEU  73  33.094  34.471  25.779
  601    HB2  LEU  73           HB2      LEU  73  31.512  35.484  28.152
  602    HB3  LEU  73           HB1      LEU  73  32.946  36.202  27.422
  603    HG   LEU  73           HG       LEU  73  30.235  35.936  26.087
  604   HD11  LEU  73          HD11      LEU  73  31.727  38.337  27.189
  605   HD12  LEU  73          HD12      LEU  73  30.243  37.641  27.845
  606   HD13  LEU  73          HD13      LEU  73  30.229  38.418  26.260
  607   HD21  LEU  73          HD21      LEU  73  32.919  36.987  25.168
  608   HD22  LEU  73          HD22      LEU  73  31.415  37.544  24.432
  609   HD23  LEU  73          HD23      LEU  73  31.853  35.838  24.354
  610    H    ARG  74           HN       ARG  74  34.702  34.367  27.610
  611    HA   ARG  74           HA       ARG  74  35.874  33.095  29.187
  612    HB2  ARG  74           HB2      ARG  74  33.809  33.839  30.543
  613    HB3  ARG  74           HB1      ARG  74  33.187  32.214  30.257
  614    HG2  ARG  74           HG2      ARG  74  35.271  31.272  31.241
  615    HG3  ARG  74           HG1      ARG  74  35.814  32.911  31.601
  616    HD2  ARG  74           HD2      ARG  74  33.793  33.261  32.995
  617    HD3  ARG  74           HD1      ARG  74  33.291  31.604  32.663
  618    HE   ARG  74           HE       ARG  74  35.957  31.632  33.744
  619   HH11  ARG  74          HH11      ARG  74  36.208  30.977  35.893
  620   HH12  ARG  74          HH12      ARG  74  34.832  30.949  36.941
  621   HH21  ARG  74          HH21      ARG  74  32.624  32.066  34.513
  622   HH22  ARG  74          HH22      ARG  74  32.802  31.565  36.161
  623    H    GLY  75           HN       GLY  75  36.553  30.911  29.552
  624    HA2  GLY  75           HA3      GLY  75  35.003  28.664  28.565
  625    HA3  GLY  75           HA2      GLY  75  36.307  29.100  27.461
  626    H    GLY  76           HN       GLY  76  36.237  26.615  28.824
  627    HA2  GLY  76           HA3      GLY  76  38.805  26.201  29.691
  628    HA3  GLY  76           HA2      GLY  76  38.004  26.779  31.153
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1  29.346  29.662   3.678
    2    H2   MET   1           HT2      MET   1  29.907  28.889   2.272
    3    H3   MET   1           HT3      MET   1  28.466  28.374   3.012
    4    HA   MET   1           HA       MET   1  28.902  30.496   1.132
    5    HB2  MET   1           HB2      MET   1  27.313  28.514   0.978
    6    HB3  MET   1           HB1      MET   1  26.332  29.310   2.209
    7    HG2  MET   1           HG2      MET   1  26.071  31.275   0.773
    8    HG3  MET   1           HG1      MET   1  27.119  30.548  -0.445
    9    HE1  MET   1           HE1      MET   1  25.157  30.689  -2.444
   10    HE2  MET   1           HE2      MET   1  24.620  31.733  -1.129
   11    HE3  MET   1           HE3      MET   1  23.483  30.615  -1.878
   12    H    GLN   2           HN       GLN   2  26.830  30.215   4.048
   13    HA   GLN   2           HA       GLN   2  27.484  32.967   4.820
   14    HB2  GLN   2           HB2      GLN   2  25.703  33.234   3.067
   15    HB3  GLN   2           HB1      GLN   2  24.624  32.275   4.081
   16    HG2  GLN   2           HG2      GLN   2  24.830  33.913   5.894
   17    HG3  GLN   2           HG1      GLN   2  25.969  34.857   4.934
   18   HE21  GLN   2          HE21      GLN   2  23.742  36.250   5.693
   19   HE22  GLN   2          HE22      GLN   2  22.656  36.428   4.401
   20    H    ILE   3           HN       ILE   3  28.191  31.404   6.580
   21    HA   ILE   3           HA       ILE   3  26.069  30.175   8.181
   22    HB   ILE   3           HB       ILE   3  29.034  30.551   8.694
   23   HG12  ILE   3          HG12      ILE   3  27.458  28.050   8.016
   24   HG13  ILE   3          HG11      ILE   3  28.293  29.026   6.807
   25   HG21  ILE   3          HG21      ILE   3  27.987  30.368  10.838
   26   HG22  ILE   3          HG22      ILE   3  28.578  28.751  10.455
   27   HG23  ILE   3          HG23      ILE   3  26.867  29.134  10.262
   28   HD11  ILE   3          HD11      ILE   3  29.632  27.064   7.671
   29   HD12  ILE   3          HD12      ILE   3  29.662  27.862   9.243
   30   HD13  ILE   3          HD13      ILE   3  30.427  28.628   7.852
   31    H    PHE   4           HN       PHE   4  25.030  31.115   9.871
   32    HA   PHE   4           HA       PHE   4  25.645  33.926  10.518
   33    HB2  PHE   4           HB2      PHE   4  23.470  32.024  11.434
   34    HB3  PHE   4           HB1      PHE   4  23.610  33.689  11.999
   35    HD1  PHE   4           HD1      PHE   4  22.811  31.519   9.144
   36    HD2  PHE   4           HD2      PHE   4  23.248  35.579  10.476
   37    HE1  PHE   4           HE1      PHE   4  21.641  32.313   7.106
   38    HE2  PHE   4           HE2      PHE   4  22.078  36.374   8.438
   39    HZ   PHE   4           HZ       PHE   4  21.275  34.741   6.754
   40    H    VAL   5           HN       VAL   5  26.111  34.636  12.701
   41    HA   VAL   5           HA       VAL   5  26.944  32.520  14.629
   42    HB   VAL   5           HB       VAL   5  28.710  34.863  13.870
   43   HG11  VAL   5          HG11      VAL   5  30.391  33.465  15.157
   44   HG12  VAL   5          HG12      VAL   5  29.040  32.455  15.671
   45   HG13  VAL   5          HG13      VAL   5  29.095  34.155  16.134
   46   HG21  VAL   5          HG21      VAL   5  28.732  33.392  11.984
   47   HG22  VAL   5          HG22      VAL   5  28.738  31.960  13.013
   48   HG23  VAL   5          HG23      VAL   5  30.170  32.984  12.921
   49    H    LYS   6           HN       LYS   6  25.484  33.056  16.217
   50    HA   LYS   6           HA       LYS   6  25.052  35.914  16.902
   51    HB2  LYS   6           HB2      LYS   6  23.193  34.103  16.702
   52    HB3  LYS   6           HB1      LYS   6  23.764  33.549  18.274
   53    HG2  LYS   6           HG2      LYS   6  22.128  35.072  18.935
   54    HG3  LYS   6           HG1      LYS   6  23.547  36.116  18.921
   55    HD2  LYS   6           HD2      LYS   6  22.968  36.917  16.675
   56    HD3  LYS   6           HD1      LYS   6  21.597  35.812  16.613
   57    HE2  LYS   6           HE2      LYS   6  20.657  37.895  17.253
   58    HE3  LYS   6           HE1      LYS   6  20.778  36.982  18.756
   59    HZ1  LYS   6           HZ1      LYS   6  22.949  38.088  19.125
   60    HZ2  LYS   6           HZ2      LYS   6  21.629  39.158  19.130
   61    HZ3  LYS   6           HZ3      LYS   6  22.648  39.065  17.773
   62    H    THR   7           HN       THR   7  26.174  36.844  18.542
   63    HA   THR   7           HA       THR   7  27.857  35.148  20.286
   64    HB   THR   7           HB       THR   7  28.813  37.288  21.037
   65    HG1  THR   7           HG1      THR   7  26.526  38.208  19.799
   66   HG21  THR   7          HG21      THR   7  28.479  36.853  18.069
   67   HG22  THR   7          HG22      THR   7  29.867  36.465  19.086
   68   HG23  THR   7          HG23      THR   7  29.497  38.146  18.703
   69    H    LEU   8           HN       LEU   8  27.884  35.754  22.679
   70    HA   LEU   8           HA       LEU   8  25.229  35.453  23.761
   71    HB2  LEU   8           HB2      LEU   8  27.201  34.510  24.890
   72    HB3  LEU   8           HB1      LEU   8  27.850  36.129  25.135
   73    HG   LEU   8           HG       LEU   8  25.922  36.706  26.554
   74   HD11  LEU   8          HD11      LEU   8  24.087  35.471  25.778
   75   HD12  LEU   8          HD12      LEU   8  24.492  34.614  27.261
   76   HD13  LEU   8          HD13      LEU   8  25.002  33.966  25.702
   77   HD21  LEU   8          HD21      LEU   8  27.977  35.577  27.492
   78   HD22  LEU   8          HD22      LEU   8  27.103  34.047  27.407
   79   HD23  LEU   8          HD23      LEU   8  26.520  35.340  28.457
   80    H    THR   9           HN       THR   9  27.410  38.190  23.323
   81    HA   THR   9           HA       THR   9  25.771  40.007  24.915
   82    HB   THR   9           HB       THR   9  27.272  41.754  24.028
   83    HG1  THR   9           HG1      THR   9  27.459  40.789  21.930
   84   HG21  THR   9          HG21      THR   9  28.136  40.592  25.922
   85   HG22  THR   9          HG22      THR   9  29.462  40.661  24.761
   86   HG23  THR   9          HG23      THR   9  28.537  39.172  24.956
   87    H    GLY  10           HN       GLY  10  25.208  38.549  22.021
   88    HA2  GLY  10           HA3      GLY  10  23.298  39.008  20.640
   89    HA3  GLY  10           HA2      GLY  10  23.301  40.675  21.215
   90    H    LYS  11           HN       LYS  11  26.366  40.565  20.699
   91    HA   LYS  11           HA       LYS  11  26.364  41.935  18.216
   92    HB2  LYS  11           HB2      LYS  11  28.603  40.393  19.569
   93    HB3  LYS  11           HB1      LYS  11  28.829  41.475  18.194
   94    HG2  LYS  11           HG2      LYS  11  27.899  43.346  19.506
   95    HG3  LYS  11           HG1      LYS  11  27.669  42.267  20.883
   96    HD2  LYS  11           HD2      LYS  11  30.098  41.838  20.957
   97    HD3  LYS  11           HD1      LYS  11  30.331  42.914  19.579
   98    HE2  LYS  11           HE2      LYS  11  29.406  44.791  20.881
   99    HE3  LYS  11           HE1      LYS  11  29.162  43.720  22.260
  100    HZ1  LYS  11           HZ1      LYS  11  31.373  43.618  22.695
  101    HZ2  LYS  11           HZ2      LYS  11  31.329  45.165  21.993
  102    HZ3  LYS  11           HZ3      LYS  11  31.832  43.826  21.075
  103    H    THR  12           HN       THR  12  25.689  41.053  16.321
  104    HA   THR  12           HA       THR  12  26.058  38.150  15.832
  105    HB   THR  12           HB       THR  12  24.648  40.279  14.192
  106    HG1  THR  12           HG1      THR  12  23.779  39.680  16.304
  107   HG21  THR  12          HG21      THR  12  25.266  38.516  12.715
  108   HG22  THR  12          HG22      THR  12  23.593  38.185  13.163
  109   HG23  THR  12          HG23      THR  12  24.903  37.280  13.920
  110    H    ILE  13           HN       ILE  13  27.125  37.372  13.929
  111    HA   ILE  13           HA       ILE  13  28.789  39.305  12.404
  112    HB   ILE  13           HB       ILE  13  29.973  36.815  13.668
  113   HG12  ILE  13          HG12      ILE  13  30.179  39.717  14.536
  114   HG13  ILE  13          HG11      ILE  13  29.404  38.414  15.438
  115   HG21  ILE  13          HG21      ILE  13  31.331  39.227  12.442
  116   HG22  ILE  13          HG22      ILE  13  30.951  37.769  11.525
  117   HG23  ILE  13          HG23      ILE  13  32.069  37.688  12.887
  118   HD11  ILE  13          HD11      ILE  13  31.574  38.641  16.396
  119   HD12  ILE  13          HD12      ILE  13  32.343  38.742  14.811
  120   HD13  ILE  13          HD13      ILE  13  31.660  37.212  15.366
  121    H    THR  14           HN       THR  14  29.043  38.641  10.269
  122    HA   THR  14           HA       THR  14  27.731  36.051   9.518
  123    HB   THR  14           HB       THR  14  27.464  37.085   7.288
  124    HG1  THR  14           HG1      THR  14  29.267  38.776   8.320
  125   HG21  THR  14          HG21      THR  14  25.793  37.420   9.187
  126   HG22  THR  14          HG22      THR  14  25.723  38.608   7.884
  127   HG23  THR  14          HG23      THR  14  26.510  39.015   9.409
  128    H    LEU  15           HN       LEU  15  29.068  34.463   8.833
  129    HA   LEU  15           HA       LEU  15  31.762  35.204   7.736
  130    HB2  LEU  15           HB2      LEU  15  31.477  33.963  10.077
  131    HB3  LEU  15           HB1      LEU  15  31.224  32.549   9.059
  132    HG   LEU  15           HG       LEU  15  33.425  33.406   7.841
  133   HD11  LEU  15          HD11      LEU  15  33.953  34.426  10.636
  134   HD12  LEU  15          HD12      LEU  15  33.375  35.498   9.363
  135   HD13  LEU  15          HD13      LEU  15  34.919  34.665   9.182
  136   HD21  LEU  15          HD21      LEU  15  34.771  32.015   9.379
  137   HD22  LEU  15          HD22      LEU  15  33.213  31.258   9.046
  138   HD23  LEU  15          HD23      LEU  15  33.479  32.091  10.579
  139    H    GLU  16           HN       GLU  16  31.733  34.800   5.573
  140    HA   GLU  16           HA       GLU  16  30.027  32.589   4.526
  141    HB2  GLU  16           HB2      GLU  16  30.815  33.694   2.282
  142    HB3  GLU  16           HB1      GLU  16  29.612  34.523   3.266
  143    HG2  GLU  16           HG2      GLU  16  31.313  35.956   4.241
  144    HG3  GLU  16           HG1      GLU  16  32.591  35.061   3.418
  145    H    VAL  17           HN       VAL  17  31.078  30.665   4.395
  146    HA   VAL  17           HA       VAL  17  33.654  30.522   3.001
  147    HB   VAL  17           HB       VAL  17  34.552  30.943   5.166
  148   HG11  VAL  17          HG11      VAL  17  33.763  29.683   7.173
  149   HG12  VAL  17          HG12      VAL  17  32.497  28.961   6.181
  150   HG13  VAL  17          HG13      VAL  17  32.509  30.701   6.469
  151   HG21  VAL  17          HG21      VAL  17  34.418  27.925   5.087
  152   HG22  VAL  17          HG22      VAL  17  35.742  28.937   5.660
  153   HG23  VAL  17          HG23      VAL  17  35.384  28.848   3.935
  154    H    GLU  18           HN       GLU  18  34.052  28.422   2.204
  155    HA   GLU  18           HA       GLU  18  31.894  26.794   1.562
  156    HB2  GLU  18           HB2      GLU  18  34.825  26.134   1.901
  157    HB3  GLU  18           HB1      GLU  18  33.664  24.941   1.315
  158    HG2  GLU  18           HG2      GLU  18  33.034  26.433  -0.532
  159    HG3  GLU  18           HG1      GLU  18  34.153  27.660   0.063
  160    HA   PRO  19           HA       PRO  19  30.910  24.708   5.366
  161    HB2  PRO  19           HB2      PRO  19  29.696  22.448   4.464
  162    HB3  PRO  19           HB1      PRO  19  28.961  24.054   4.281
  163    HG2  PRO  19           HG2      PRO  19  30.505  22.451   2.282
  164    HG3  PRO  19           HG1      PRO  19  28.988  23.347   2.070
  165    HD2  PRO  19           HD2      PRO  19  31.401  24.371   1.304
  166    HD3  PRO  19           HD1      PRO  19  30.066  25.398   1.876
  167    H    SER  20           HN       SER  20  32.902  23.013   3.005
  168    HA   SER  20           HA       SER  20  33.535  20.802   4.779
  169    HB2  SER  20           HB2      SER  20  35.467  20.506   3.079
  170    HB3  SER  20           HB1      SER  20  33.814  20.309   2.501
  171    HG   SER  20           HG       SER  20  35.384  21.768   1.318
  172    H    ASP  21           HN       ASP  21  34.269  23.981   5.064
  173    HA   ASP  21           HA       ASP  21  37.069  23.968   5.640
  174    HB2  ASP  21           HB2      ASP  21  34.754  25.755   6.121
  175    HB3  ASP  21           HB1      ASP  21  36.022  25.902   7.329
  176    H    THR  22           HN       THR  22  38.104  23.837   7.782
  177    HA   THR  22           HA       THR  22  36.849  21.769   9.434
  178    HB   THR  22           HB       THR  22  38.982  21.841  10.685
  179    HG1  THR  22           HG1      THR  22  39.836  23.765  10.648
  180   HG21  THR  22          HG21      THR  22  39.543  21.952   7.718
  181   HG22  THR  22          HG22      THR  22  38.680  20.608   8.468
  182   HG23  THR  22          HG23      THR  22  40.342  20.960   8.937
  183    H    ILE  23           HN       ILE  23  37.110  22.092  11.902
  184    HA   ILE  23           HA       ILE  23  35.431  24.319  12.684
  185    HB   ILE  23           HB       ILE  23  36.998  22.314  14.320
  186   HG12  ILE  23          HG12      ILE  23  34.038  22.478  13.706
  187   HG13  ILE  23          HG11      ILE  23  35.166  21.488  12.780
  188   HG21  ILE  23          HG21      ILE  23  36.585  24.207  15.728
  189   HG22  ILE  23          HG22      ILE  23  35.324  23.035  16.109
  190   HG23  ILE  23          HG23      ILE  23  34.960  24.420  15.079
  191   HD11  ILE  23          HD11      ILE  23  34.795  21.281  15.771
  192   HD12  ILE  23          HD12      ILE  23  35.760  20.221  14.747
  193   HD13  ILE  23          HD13      ILE  23  34.003  20.226  14.602
  194    H    GLU  24           HN       GLU  24  38.838  23.475  13.348
  195    HA   GLU  24           HA       GLU  24  39.506  25.799  14.828
  196    HB2  GLU  24           HB2      GLU  24  41.395  24.424  12.913
  197    HB3  GLU  24           HB1      GLU  24  41.785  25.232  14.430
  198    HG2  GLU  24           HG2      GLU  24  40.226  22.653  14.105
  199    HG3  GLU  24           HG1      GLU  24  41.838  22.829  14.796
  200    H    ASN  25           HN       ASN  25  39.015  25.302  11.418
  201    HA   ASN  25           HA       ASN  25  40.395  27.654  10.485
  202    HB2  ASN  25           HB2      ASN  25  39.684  25.772   9.000
  203    HB3  ASN  25           HB1      ASN  25  38.003  26.239   9.260
  204   HD21  ASN  25          HD21      ASN  25  41.118  27.552   8.027
  205   HD22  ASN  25          HD22      ASN  25  40.399  28.640   6.938
  206    H    VAL  26           HN       VAL  26  37.067  26.979  11.505
  207    HA   VAL  26           HA       VAL  26  36.065  29.636  10.982
  208    HB   VAL  26           HB       VAL  26  35.079  27.602  13.007
  209   HG11  VAL  26          HG11      VAL  26  32.878  28.755  12.471
  210   HG12  VAL  26          HG12      VAL  26  33.823  29.992  11.639
  211   HG13  VAL  26          HG13      VAL  26  34.041  29.730  13.370
  212   HG21  VAL  26          HG21      VAL  26  35.313  26.679  10.698
  213   HG22  VAL  26          HG22      VAL  26  34.274  27.974  10.107
  214   HG23  VAL  26          HG23      VAL  26  33.634  26.771  11.226
  215    H    LYS  27           HN       LYS  27  36.782  28.014  14.081
  216    HA   LYS  27           HA       LYS  27  36.643  30.170  15.816
  217    HB2  LYS  27           HB2      LYS  27  38.721  27.955  15.797
  218    HB3  LYS  27           HB1      LYS  27  38.369  28.995  17.176
  219    HG2  LYS  27           HG2      LYS  27  36.020  28.207  17.157
  220    HG3  LYS  27           HG1      LYS  27  36.404  27.136  15.811
  221    HD2  LYS  27           HD2      LYS  27  38.008  25.915  17.171
  222    HD3  LYS  27           HD1      LYS  27  37.786  27.043  18.508
  223    HE2  LYS  27           HE2      LYS  27  35.568  26.300  18.910
  224    HE3  LYS  27           HE1      LYS  27  35.477  25.471  17.357
  225    HZ1  LYS  27           HZ1      LYS  27  36.778  24.645  19.838
  226    HZ2  LYS  27           HZ2      LYS  27  37.539  24.213  18.381
  227    HZ3  LYS  27           HZ3      LYS  27  35.944  23.716  18.690
  228    H    ALA  28           HN       ALA  28  39.408  29.289  13.739
  229    HA   ALA  28           HA       ALA  28  41.116  31.415  14.674
  230    HB1  ALA  28           HB1      ALA  28  42.291  30.966  12.426
  231    HB2  ALA  28           HB2      ALA  28  41.079  29.705  12.182
  232    HB3  ALA  28           HB3      ALA  28  42.185  29.610  13.552
  233    H    LYS  29           HN       LYS  29  39.298  31.094  11.598
  234    HA   LYS  29           HA       LYS  29  39.729  33.617  10.543
  235    HB2  LYS  29           HB2      LYS  29  37.310  31.829  10.516
  236    HB3  LYS  29           HB1      LYS  29  37.244  33.407   9.728
  237    HG2  LYS  29           HG2      LYS  29  38.907  32.850   8.167
  238    HG3  LYS  29           HG1      LYS  29  39.544  31.538   9.158
  239    HD2  LYS  29           HD2      LYS  29  37.609  30.179   8.725
  240    HD3  LYS  29           HD1      LYS  29  36.794  31.504   7.893
  241    HE2  LYS  29           HE2      LYS  29  39.332  30.106   6.992
  242    HE3  LYS  29           HE1      LYS  29  37.747  29.996   6.227
  243    HZ1  LYS  29           HZ1      LYS  29  39.509  32.369   6.413
  244    HZ2  LYS  29           HZ2      LYS  29  37.877  32.466   5.948
  245    HZ3  LYS  29           HZ3      LYS  29  38.978  31.574   5.012
  246    H    ILE  30           HN       ILE  30  37.502  32.803  13.207
  247    HA   ILE  30           HA       ILE  30  36.416  35.493  13.350
  248    HB   ILE  30           HB       ILE  30  36.412  33.168  15.303
  249   HG12  ILE  30          HG12      ILE  30  34.184  34.276  13.569
  250   HG13  ILE  30          HG11      ILE  30  35.200  32.918  13.088
  251   HG21  ILE  30          HG21      ILE  30  36.099  35.198  16.571
  252   HG22  ILE  30          HG22      ILE  30  34.500  34.490  16.339
  253   HG23  ILE  30          HG23      ILE  30  35.012  35.856  15.350
  254   HD11  ILE  30          HD11      ILE  30  33.360  33.066  15.487
  255   HD12  ILE  30          HD12      ILE  30  34.532  31.772  15.240
  256   HD13  ILE  30          HD13      ILE  30  33.213  31.999  14.094
  257    H    GLN  31           HN       GLN  31  38.874  33.630  15.114
  258    HA   GLN  31           HA       GLN  31  39.584  35.416  17.121
  259    HB2  GLN  31           HB2      GLN  31  40.626  33.218  16.892
  260    HB3  GLN  31           HB1      GLN  31  41.407  33.713  15.395
  261    HG2  GLN  31           HG2      GLN  31  42.742  35.346  16.546
  262    HG3  GLN  31           HG1      GLN  31  41.867  35.084  18.053
  263   HE21  GLN  31          HE21      GLN  31  43.845  34.382  19.164
  264   HE22  GLN  31          HE22      GLN  31  44.544  32.870  18.835
  265    H    ASP  32           HN       ASP  32  40.826  35.387  13.763
  266    HA   ASP  32           HA       ASP  32  42.459  37.718  14.078
  267    HB2  ASP  32           HB2      ASP  32  42.625  36.036  12.210
  268    HB3  ASP  32           HB1      ASP  32  41.164  36.745  11.521
  269    H    LYS  33           HN       LYS  33  39.028  37.324  13.362
  270    HA   LYS  33           HA       LYS  33  38.701  40.098  12.517
  271    HB2  LYS  33           HB2      LYS  33  36.727  37.949  13.231
  272    HB3  LYS  33           HB1      LYS  33  36.274  39.535  12.611
  273    HG2  LYS  33           HG2      LYS  33  37.533  39.148  10.575
  274    HG3  LYS  33           HG1      LYS  33  38.148  37.625  11.197
  275    HD2  LYS  33           HD2      LYS  33  35.943  36.650  11.206
  276    HD3  LYS  33           HD1      LYS  33  35.204  38.200  10.794
  277    HE2  LYS  33           HE2      LYS  33  35.330  36.932   8.753
  278    HE3  LYS  33           HE1      LYS  33  36.582  38.172   8.663
  279    HZ1  LYS  33           HZ1      LYS  33  36.881  35.388   8.547
  280    HZ2  LYS  33           HZ2      LYS  33  37.669  35.944   9.944
  281    HZ3  LYS  33           HZ3      LYS  33  38.079  36.582   8.424
  282    H    GLU  34           HN       GLU  34  37.921  38.243  15.476
  283    HA   GLU  34           HA       GLU  34  37.076  40.748  16.816
  284    HB2  GLU  34           HB2      GLU  34  37.228  37.961  17.995
  285    HB3  GLU  34           HB1      GLU  34  36.315  39.338  18.604
  286    HG2  GLU  34           HG2      GLU  34  34.910  39.325  16.587
  287    HG3  GLU  34           HG1      GLU  34  35.834  37.966  15.944
  288    H    GLY  35           HN       GLY  35  39.744  38.424  16.850
  289    HA2  GLY  35           HA3      GLY  35  41.941  38.876  17.620
  290    HA3  GLY  35           HA2      GLY  35  41.359  40.355  18.384
  291    H    ILE  36           HN       ILE  36  39.389  37.678  18.997
  292    HA   ILE  36           HA       ILE  36  40.286  37.572  21.795
  293    HB   ILE  36           HB       ILE  36  37.928  36.270  20.430
  294   HG12  ILE  36          HG12      ILE  36  38.145  38.884  21.957
  295   HG13  ILE  36          HG11      ILE  36  37.915  38.738  20.215
  296   HG21  ILE  36          HG21      ILE  36  37.053  36.053  22.685
  297   HG22  ILE  36          HG22      ILE  36  38.441  36.912  23.345
  298   HG23  ILE  36          HG23      ILE  36  38.648  35.312  22.632
  299   HD11  ILE  36          HD11      ILE  36  36.029  37.794  22.375
  300   HD12  ILE  36          HD12      ILE  36  35.826  37.448  20.657
  301   HD13  ILE  36          HD13      ILE  36  35.759  39.112  21.236
  302    HA   PRO  37           HA       PRO  37  42.415  33.722  20.806
  303    HB2  PRO  37           HB2      PRO  37  42.947  32.809  23.323
  304    HB3  PRO  37           HB1      PRO  37  43.817  34.172  22.591
  305    HG2  PRO  37           HG2      PRO  37  41.547  34.208  24.534
  306    HG3  PRO  37           HG1      PRO  37  43.022  35.192  24.512
  307    HD2  PRO  37           HD2      PRO  37  40.618  36.121  23.597
  308    HD3  PRO  37           HD1      PRO  37  42.172  36.669  22.929
  309    HA   PRO  38           HA       PRO  38  38.766  30.984  20.628
  310    HB2  PRO  38           HB2      PRO  38  41.057  29.071  20.371
  311    HB3  PRO  38           HB1      PRO  38  39.496  29.064  19.523
  312    HG2  PRO  38           HG2      PRO  38  41.592  30.046  18.326
  313    HG3  PRO  38           HG1      PRO  38  40.055  30.907  18.218
  314    HD2  PRO  38           HD2      PRO  38  42.501  31.611  19.797
  315    HD3  PRO  38           HD1      PRO  38  41.274  32.680  19.076
  316    H    ASP  39           HN       ASP  39  41.498  30.504  22.805
  317    HA   ASP  39           HA       ASP  39  40.457  28.357  24.340
  318    HB2  ASP  39           HB2      ASP  39  42.251  30.665  25.122
  319    HB3  ASP  39           HB1      ASP  39  41.906  29.299  26.185
  320    H    GLN  40           HN       GLN  40  40.029  31.853  24.716
  321    HA   GLN  40           HA       GLN  40  38.323  31.570  27.045
  322    HB2  GLN  40           HB2      GLN  40  38.863  33.916  25.205
  323    HB3  GLN  40           HB1      GLN  40  37.951  34.010  26.712
  324    HG2  GLN  40           HG2      GLN  40  39.910  33.170  27.954
  325    HG3  GLN  40           HG1      GLN  40  40.828  33.095  26.452
  326   HE21  GLN  40          HE21      GLN  40  41.939  34.726  28.343
  327   HE22  GLN  40          HE22      GLN  40  41.669  36.362  27.984
  328    H    GLN  41           HN       GLN  41  37.731  30.956  23.793
  329    HA   GLN  41           HA       GLN  41  34.790  31.385  24.201
  330    HB2  GLN  41           HB2      GLN  41  36.413  32.003  21.718
  331    HB3  GLN  41           HB1      GLN  41  34.650  31.967  21.769
  332    HG2  GLN  41           HG2      GLN  41  34.804  33.667  23.668
  333    HG3  GLN  41           HG1      GLN  41  36.509  33.838  23.248
  334   HE21  GLN  41          HE21      GLN  41  36.945  34.435  20.878
  335   HE22  GLN  41          HE22      GLN  41  35.819  35.434  20.092
  336    H    ARG  42           HN       ARG  42  33.540  29.693  23.606
  337    HA   ARG  42           HA       ARG  42  34.728  27.491  21.966
  338    HB2  ARG  42           HB2      ARG  42  33.008  27.108  24.444
  339    HB3  ARG  42           HB1      ARG  42  33.720  25.837  23.449
  340    HG2  ARG  42           HG2      ARG  42  35.992  26.943  23.999
  341    HG3  ARG  42           HG1      ARG  42  35.122  27.794  25.274
  342    HD2  ARG  42           HD2      ARG  42  35.235  24.781  24.942
  343    HD3  ARG  42           HD1      ARG  42  36.148  25.713  26.129
  344    HE   ARG  42           HE       ARG  42  33.297  25.063  26.276
  345   HH11  ARG  42          HH11      ARG  42  32.260  25.753  28.161
  346   HH12  ARG  42          HH12      ARG  42  33.044  26.899  29.196
  347   HH21  ARG  42          HH21      ARG  42  35.875  27.154  27.206
  348   HH22  ARG  42          HH22      ARG  42  35.092  27.693  28.655
  349    H    LEU  43           HN       LEU  43  33.263  26.720  20.430
  350    HA   LEU  43           HA       LEU  43  30.791  28.286  20.167
  351    HB2  LEU  43           HB2      LEU  43  32.241  26.285  18.429
  352    HB3  LEU  43           HB1      LEU  43  30.609  26.849  18.019
  353    HG   LEU  43           HG       LEU  43  31.371  29.145  17.928
  354   HD11  LEU  43          HD11      LEU  43  33.938  27.973  19.007
  355   HD12  LEU  43          HD12      LEU  43  32.982  29.298  19.669
  356   HD13  LEU  43          HD13      LEU  43  33.908  29.534  18.188
  357   HD21  LEU  43          HD21      LEU  43  33.177  27.181  16.499
  358   HD22  LEU  43          HD22      LEU  43  33.140  28.902  16.137
  359   HD23  LEU  43          HD23      LEU  43  31.699  27.920  15.885
  360    H    ILE  44           HN       ILE  44  28.750  27.492  20.273
  361    HA   ILE  44           HA       ILE  44  28.356  24.650  21.178
  362    HB   ILE  44           HB       ILE  44  26.814  27.123  22.037
  363   HG12  ILE  44          HG12      ILE  44  29.015  27.063  23.092
  364   HG13  ILE  44          HG11      ILE  44  27.789  26.640  24.282
  365   HG21  ILE  44          HG21      ILE  44  25.360  25.160  21.960
  366   HG22  ILE  44          HG22      ILE  44  25.742  25.500  23.649
  367   HG23  ILE  44          HG23      ILE  44  26.568  24.190  22.805
  368   HD11  ILE  44          HD11      ILE  44  28.360  24.155  23.473
  369   HD12  ILE  44          HD12      ILE  44  29.337  24.968  24.692
  370   HD13  ILE  44          HD13      ILE  44  29.883  24.914  23.021
  371    H    PHE  45           HN       PHE  45  26.790  23.531  20.020
  372    HA   PHE  45           HA       PHE  45  25.082  25.102  18.117
  373    HB2  PHE  45           HB2      PHE  45  26.876  23.972  16.890
  374    HB3  PHE  45           HB1      PHE  45  26.481  22.444  17.679
  375    HD1  PHE  45           HD1      PHE  45  25.335  24.978  15.250
  376    HD2  PHE  45           HD2      PHE  45  24.542  21.159  17.035
  377    HE1  PHE  45           HE1      PHE  45  23.632  24.520  13.505
  378    HE2  PHE  45           HE2      PHE  45  22.837  20.695  15.293
  379    HZ   PHE  45           HZ       PHE  45  22.382  22.376  13.526
  380    H    ALA  46           HN       ALA  46  23.126  24.958  19.192
  381    HA   ALA  46           HA       ALA  46  21.276  23.960  20.255
  382    HB1  ALA  46           HB1      ALA  46  20.848  23.178  18.021
  383    HB2  ALA  46           HB2      ALA  46  20.563  21.818  19.106
  384    HB3  ALA  46           HB3      ALA  46  22.057  21.905  18.175
  385    H    GLY  47           HN       GLY  47  23.304  23.694  21.994
  386    HA2  GLY  47           HA3      GLY  47  23.897  22.434  23.874
  387    HA3  GLY  47           HA2      GLY  47  22.644  21.287  23.413
  388    H    LYS  48           HN       LYS  48  24.529  21.450  20.711
  389    HA   LYS  48           HA       LYS  48  25.882  18.948  21.437
  390    HB2  LYS  48           HB2      LYS  48  24.688  19.266  19.259
  391    HB3  LYS  48           HB1      LYS  48  25.896  20.475  18.822
  392    HG2  LYS  48           HG2      LYS  48  27.653  18.880  18.929
  393    HG3  LYS  48           HG1      LYS  48  26.593  17.646  19.606
  394    HD2  LYS  48           HD2      LYS  48  25.251  17.679  17.522
  395    HD3  LYS  48           HD1      LYS  48  26.352  18.878  16.843
  396    HE2  LYS  48           HE2      LYS  48  28.220  17.301  17.016
  397    HE3  LYS  48           HE1      LYS  48  27.163  16.106  17.766
  398    HZ1  LYS  48           HZ1      LYS  48  27.447  16.819  14.997
  399    HZ2  LYS  48           HZ2      LYS  48  25.828  16.777  15.511
  400    HZ3  LYS  48           HZ3      LYS  48  26.818  15.406  15.694
  401    H    GLN  49           HN       GLN  49  28.180  18.661  20.958
  402    HA   GLN  49           HA       GLN  49  29.806  21.136  21.319
  403    HB2  GLN  49           HB2      GLN  49  29.628  19.614  23.352
  404    HB3  GLN  49           HB1      GLN  49  30.512  18.411  22.412
  405    HG2  GLN  49           HG2      GLN  49  32.316  20.124  22.044
  406    HG3  GLN  49           HG1      GLN  49  31.464  21.187  23.163
  407   HE21  GLN  49          HE21      GLN  49  32.511  21.103  25.155
  408   HE22  GLN  49          HE22      GLN  49  33.086  19.687  25.894
  409    H    LEU  50           HN       LEU  50  31.248  21.454  19.721
  410    HA   LEU  50           HA       LEU  50  31.804  19.232  17.818
  411    HB2  LEU  50           HB2      LEU  50  32.705  22.112  17.586
  412    HB3  LEU  50           HB1      LEU  50  32.544  20.918  16.300
  413    HG   LEU  50           HG       LEU  50  30.264  22.090  17.923
  414   HD11  LEU  50          HD11      LEU  50  31.199  23.681  16.307
  415   HD12  LEU  50          HD12      LEU  50  29.628  23.111  15.747
  416   HD13  LEU  50          HD13      LEU  50  31.105  22.469  15.032
  417   HD21  LEU  50          HD21      LEU  50  30.409  19.968  15.770
  418   HD22  LEU  50          HD22      LEU  50  28.930  20.882  16.060
  419   HD23  LEU  50          HD23      LEU  50  29.611  19.881  17.341
  420    H    GLU  51           HN       GLU  51  33.691  18.119  17.976
  421    HA   GLU  51           HA       GLU  51  35.807  19.130  19.799
  422    HB2  GLU  51           HB2      GLU  51  35.562  16.472  18.355
  423    HB3  GLU  51           HB1      GLU  51  36.738  16.871  19.609
  424    HG2  GLU  51           HG2      GLU  51  34.882  17.274  21.202
  425    HG3  GLU  51           HG1      GLU  51  33.726  16.820  19.952
  426    H    ASP  52           HN       ASP  52  38.019  19.281  19.093
  427    HA   ASP  52           HA       ASP  52  38.362  20.430  16.484
  428    HB2  ASP  52           HB2      ASP  52  40.758  20.442  17.029
  429    HB3  ASP  52           HB1      ASP  52  39.817  20.976  18.421
  430    H    GLY  53           HN       GLY  53  39.673  19.564  14.719
  431    HA2  GLY  53           HA3      GLY  53  40.569  17.825  13.376
  432    HA3  GLY  53           HA2      GLY  53  40.321  16.703  14.716
  433    H    ARG  54           HN       ARG  54  37.919  18.830  13.212
  434    HA   ARG  54           HA       ARG  54  36.629  16.537  11.875
  435    HB2  ARG  54           HB2      ARG  54  35.834  16.572  14.298
  436    HB3  ARG  54           HB1      ARG  54  35.088  18.122  13.940
  437    HG2  ARG  54           HG2      ARG  54  33.422  16.364  13.689
  438    HG3  ARG  54           HG1      ARG  54  33.779  17.060  12.112
  439    HD2  ARG  54           HD2      ARG  54  33.682  14.427  12.430
  440    HD3  ARG  54           HD1      ARG  54  34.884  15.147  11.368
  441    HE   ARG  54           HE       ARG  54  35.781  14.791  14.140
  442   HH11  ARG  54          HH11      ARG  54  37.483  13.328  14.405
  443   HH12  ARG  54          HH12      ARG  54  37.909  12.270  13.101
  444   HH21  ARG  54          HH21      ARG  54  35.464  13.485  10.964
  445   HH22  ARG  54          HH22      ARG  54  36.767  12.361  11.153
  446    H    THR  55           HN       THR  55  35.001  17.181  10.364
  447    HA   THR  55           HA       THR  55  34.970  20.117   9.726
  448    HB   THR  55           HB       THR  55  34.932  17.711   7.876
  449    HG1  THR  55           HG1      THR  55  36.798  19.155   7.118
  450   HG21  THR  55          HG21      THR  55  34.465  20.651   7.378
  451   HG22  THR  55          HG22      THR  55  33.463  19.287   6.883
  452   HG23  THR  55          HG23      THR  55  35.020  19.565   6.105
  453    H    LEU  56           HN       LEU  56  32.940  20.775   8.545
  454    HA   LEU  56           HA       LEU  56  30.608  19.867   9.962
  455    HB2  LEU  56           HB2      LEU  56  30.794  21.477   7.404
  456    HB3  LEU  56           HB1      LEU  56  29.361  21.332   8.412
  457    HG   LEU  56           HG       LEU  56  31.947  22.287   9.643
  458   HD11  LEU  56          HD11      LEU  56  30.956  24.660   9.164
  459   HD12  LEU  56          HD12      LEU  56  30.111  23.856   7.841
  460   HD13  LEU  56          HD13      LEU  56  31.871  23.846   7.896
  461   HD21  LEU  56          HD21      LEU  56  30.325  23.544  11.080
  462   HD22  LEU  56          HD22      LEU  56  30.077  21.801  11.141
  463   HD23  LEU  56          HD23      LEU  56  29.000  22.811  10.177
  464    H    SER  57           HN       SER  57  31.690  19.334   6.575
  465    HA   SER  57           HA       SER  57  29.474  17.700   5.811
  466    HB2  SER  57           HB2      SER  57  32.377  17.584   4.923
  467    HB3  SER  57           HB1      SER  57  31.060  16.723   4.129
  468    HG   SER  57           HG       SER  57  30.330  18.557   3.332
  469    H    ASP  58           HN       ASP  58  32.665  16.807   7.049
  470    HA   ASP  58           HA       ASP  58  32.331  14.040   7.319
  471    HB2  ASP  58           HB2      ASP  58  34.404  15.427   7.890
  472    HB3  ASP  58           HB1      ASP  58  33.655  15.711   9.462
  473    H    TYR  59           HN       TYR  59  30.965  16.621   9.297
  474    HA   TYR  59           HA       TYR  59  30.026  14.844  11.404
  475    HB2  TYR  59           HB2      TYR  59  29.920  17.714  10.775
  476    HB3  TYR  59           HB1      TYR  59  28.387  17.152  11.428
  477    HD1  TYR  59           HD1      TYR  59  31.283  18.681  12.412
  478    HD2  TYR  59           HD2      TYR  59  28.912  15.244  13.425
  479    HE1  TYR  59           HE1      TYR  59  32.222  18.708  14.706
  480    HE2  TYR  59           HE2      TYR  59  29.855  15.271  15.718
  481    HH   TYR  59           HH       TYR  59  30.935  16.719  17.241
  482    H    ASN  60           HN       ASN  60  28.980  15.617   8.235
  483    HA   ASN  60           HA       ASN  60  27.094  14.968   7.005
  484    HB2  ASN  60           HB2      ASN  60  27.851  12.749   8.059
  485    HB3  ASN  60           HB1      ASN  60  26.553  12.993   9.229
  486   HD21  ASN  60          HD21      ASN  60  25.180  11.281   8.452
  487   HD22  ASN  60          HD22      ASN  60  24.453  11.322   6.919
  488    H    ILE  61           HN       ILE  61  26.438  17.220   8.096
  489    HA   ILE  61           HA       ILE  61  24.465  17.249  10.159
  490    HB   ILE  61           HB       ILE  61  24.700  19.161   7.814
  491   HG12  ILE  61          HG12      ILE  61  26.036  19.277  10.538
  492   HG13  ILE  61          HG11      ILE  61  26.852  18.798   9.049
  493   HG21  ILE  61          HG21      ILE  61  23.620  19.525  10.626
  494   HG22  ILE  61          HG22      ILE  61  22.632  19.369   9.174
  495   HG23  ILE  61          HG23      ILE  61  23.689  20.766   9.377
  496   HD11  ILE  61          HD11      ILE  61  26.249  21.003   8.050
  497   HD12  ILE  61          HD12      ILE  61  27.274  21.166   9.476
  498   HD13  ILE  61          HD13      ILE  61  25.542  21.477   9.593
  499    H    GLN  62           HN       GLN  62  22.327  16.696  10.118
  500    HA   GLN  62           HA       GLN  62  21.232  15.351   7.814
  501    HB2  GLN  62           HB2      GLN  62  20.602  14.827  10.171
  502    HB3  GLN  62           HB1      GLN  62  19.780  16.384  10.266
  503    HG2  GLN  62           HG2      GLN  62  18.292  15.730   8.420
  504    HG3  GLN  62           HG1      GLN  62  19.126  14.183   8.285
  505   HE21  GLN  62          HE21      GLN  62  17.957  12.552   9.294
  506   HE22  GLN  62          HE22      GLN  62  17.039  12.738  10.710
  507    H    LYS  63           HN       LYS  63  20.390  18.479   9.362
  508    HA   LYS  63           HA       LYS  63  18.435  19.180   7.387
  509    HB2  LYS  63           HB2      LYS  63  20.082  20.870   9.282
  510    HB3  LYS  63           HB1      LYS  63  18.795  21.525   8.267
  511    HG2  LYS  63           HG2      LYS  63  17.227  19.840   9.288
  512    HG3  LYS  63           HG1      LYS  63  18.515  19.387  10.403
  513    HD2  LYS  63           HD2      LYS  63  17.638  22.268  10.144
  514    HD3  LYS  63           HD1      LYS  63  16.769  21.149  11.190
  515    HE2  LYS  63           HE2      LYS  63  19.724  21.820  11.365
  516    HE3  LYS  63           HE1      LYS  63  18.468  22.343  12.486
  517    HZ1  LYS  63           HZ1      LYS  63  19.854  19.854  12.360
  518    HZ2  LYS  63           HZ2      LYS  63  18.169  19.631  12.338
  519    HZ3  LYS  63           HZ3      LYS  63  18.899  20.494  13.607
  520    H    GLU  64           HN       GLU  64  21.931  19.611   7.523
  521    HA   GLU  64           HA       GLU  64  23.409  20.651   6.000
  522    HB2  GLU  64           HB2      GLU  64  22.678  18.473   4.924
  523    HB3  GLU  64           HB1      GLU  64  21.519  19.413   3.986
  524    HG2  GLU  64           HG2      GLU  64  23.341  20.766   3.050
  525    HG3  GLU  64           HG1      GLU  64  24.516  19.877   4.021
  526    H    SEP  65           HN       SEP  65  22.212  22.779   6.748
  527    HA   SEP  65           HA       SEP  65  21.665  24.302   4.309
  528    HB2  SEP  65           HB1      SEP  65  19.445  23.263   4.898
  529    HB3  SEP  65           HB2      SEP  65  19.434  25.024   4.896
  530    H    TPO  66           HN       TPO  66  20.215  26.348   5.989
  531    HA   TPO  66           HA       TPO  66  22.352  28.004   6.706
  532    HB   TPO  66           HB       TPO  66  20.735  29.220   8.142
  533   HG21  TPO  66          HG21      TPO  66  20.700  29.375   5.618
  534   HG22  TPO  66          HG22      TPO  66  19.169  29.770   6.399
  535   HG23  TPO  66          HG23      TPO  66  19.389  28.196   5.631
  536    H    LEU  67           HN       LEU  67  23.945  27.638   8.163
  537    HA   LEU  67           HA       LEU  67  23.424  25.823  10.469
  538    HB2  LEU  67           HB2      LEU  67  26.063  27.032   9.605
  539    HB3  LEU  67           HB1      LEU  67  25.810  25.643  10.661
  540    HG   LEU  67           HG       LEU  67  25.047  25.770   7.727
  541   HD11  LEU  67          HD11      LEU  67  27.460  25.674   7.976
  542   HD12  LEU  67          HD12      LEU  67  26.887  24.075   7.505
  543   HD13  LEU  67          HD13      LEU  67  27.325  24.395   9.182
  544   HD21  LEU  67          HD21      LEU  67  24.849  23.216   8.180
  545   HD22  LEU  67          HD22      LEU  67  23.545  24.252   8.753
  546   HD23  LEU  67          HD23      LEU  67  24.766  23.667   9.883
  547    H    HIS  68           HN       HIS  68  22.992  26.695  12.411
  548    HA   HIS  68           HA       HIS  68  23.580  29.574  12.892
  549    HB2  HIS  68           HB2      HIS  68  22.135  29.266  14.895
  550    HB3  HIS  68           HB1      HIS  68  21.307  28.806  13.407
  551    HD1  HIS  68           HD1      HIS  68  21.056  26.215  12.935
  552    HD2  HIS  68           HD2      HIS  68  22.554  27.156  16.713
  553    HE1  HIS  68           HE1      HIS  68  20.887  24.099  14.321
  554    HE2  HIS  68           HE2      HIS  68  21.796  24.662  16.621
  555    H    LEU  69           HN       LEU  69  25.266  30.164  14.186
  556    HA   LEU  69           HA       LEU  69  26.568  28.059  15.900
  557    HB2  LEU  69           HB2      LEU  69  27.696  30.111  14.019
  558    HB3  LEU  69           HB1      LEU  69  28.612  29.760  15.483
  559    HG   LEU  69           HG       LEU  69  28.556  27.334  14.891
  560   HD11  LEU  69          HD11      LEU  69  27.033  28.428  12.530
  561   HD12  LEU  69          HD12      LEU  69  26.691  27.004  13.514
  562   HD13  LEU  69          HD13      LEU  69  28.008  26.970  12.346
  563   HD21  LEU  69          HD21      LEU  69  30.408  28.947  14.216
  564   HD22  LEU  69          HD22      LEU  69  29.656  29.016  12.622
  565   HD23  LEU  69          HD23      LEU  69  30.289  27.487  13.234
  566    H    VAL  70           HN       VAL  70  26.947  28.654  18.031
  567    HA   VAL  70           HA       VAL  70  26.365  31.495  18.810
  568    HB   VAL  70           HB       VAL  70  25.573  28.968  20.293
  569   HG11  VAL  70          HG11      VAL  70  26.134  30.720  21.862
  570   HG12  VAL  70          HG12      VAL  70  24.374  30.634  21.764
  571   HG13  VAL  70          HG13      VAL  70  25.243  31.915  20.920
  572   HG21  VAL  70          HG21      VAL  70  24.148  29.400  18.335
  573   HG22  VAL  70          HG22      VAL  70  23.921  31.070  18.852
  574   HG23  VAL  70          HG23      VAL  70  23.261  29.750  19.819
  575    H    LEU  71           HN       LEU  71  28.246  32.327  19.593
  576    HA   LEU  71           HA       LEU  71  30.355  30.550  20.591
  577    HB2  LEU  71           HB2      LEU  71  30.103  33.519  20.121
  578    HB3  LEU  71           HB1      LEU  71  31.454  32.888  21.061
  579    HG   LEU  71           HG       LEU  71  32.059  31.397  19.185
  580   HD11  LEU  71          HD11      LEU  71  29.667  32.734  17.909
  581   HD12  LEU  71          HD12      LEU  71  29.960  31.008  18.120
  582   HD13  LEU  71          HD13      LEU  71  30.917  31.929  16.960
  583   HD21  LEU  71          HD21      LEU  71  32.884  33.818  19.408
  584   HD22  LEU  71          HD22      LEU  71  31.719  34.219  18.146
  585   HD23  LEU  71          HD23      LEU  71  33.031  33.088  17.810
  586    H    ARG  72           HN       ARG  72  31.030  30.357  22.704
  587    HA   ARG  72           HA       ARG  72  29.264  31.569  24.808
  588    HB2  ARG  72           HB2      ARG  72  29.400  28.993  24.494
  589    HB3  ARG  72           HB1      ARG  72  31.021  29.133  25.171
  590    HG2  ARG  72           HG2      ARG  72  29.787  28.763  27.112
  591    HG3  ARG  72           HG1      ARG  72  29.779  30.525  27.065
  592    HD2  ARG  72           HD2      ARG  72  27.576  30.251  25.694
  593    HD3  ARG  72           HD1      ARG  72  27.570  28.608  26.330
  594    HE   ARG  72           HE       ARG  72  27.966  30.293  28.545
  595   HH11  ARG  72          HH11      ARG  72  26.216  30.940  29.819
  596   HH12  ARG  72          HH12      ARG  72  24.619  30.919  29.148
  597   HH21  ARG  72          HH21      ARG  72  25.650  29.754  26.048
  598   HH22  ARG  72          HH22      ARG  72  24.299  30.248  27.014
  599    H    LEU  73           HN       LEU  73  30.350  32.308  26.759
  600    HA   LEU  73           HA       LEU  73  33.240  33.016  26.323
  601    HB2  LEU  73           HB2      LEU  73  31.261  34.480  28.085
  602    HB3  LEU  73           HB1      LEU  73  32.850  35.031  27.556
  603    HG   LEU  73           HG       LEU  73  30.474  34.532  25.736
  604   HD11  LEU  73          HD11      LEU  73  30.274  36.532  27.230
  605   HD12  LEU  73          HD12      LEU  73  30.375  36.954  25.521
  606   HD13  LEU  73          HD13      LEU  73  31.789  37.138  26.560
  607   HD21  LEU  73          HD21      LEU  73  32.426  34.139  24.446
  608   HD22  LEU  73          HD22      LEU  73  33.327  35.417  25.264
  609   HD23  LEU  73          HD23      LEU  73  32.040  35.829  24.129
  610    H    ARG  74           HN       ARG  74  34.663  32.665  28.069
  611    HA   ARG  74           HA       ARG  74  33.749  31.964  30.713
  612    HB2  ARG  74           HB2      ARG  74  33.143  29.890  29.368
  613    HB3  ARG  74           HB1      ARG  74  34.872  29.656  29.107
  614    HG2  ARG  74           HG2      ARG  74  35.274  29.486  31.490
  615    HG3  ARG  74           HG1      ARG  74  33.599  29.916  31.845
  616    HD2  ARG  74           HD2      ARG  74  32.826  27.871  30.705
  617    HD3  ARG  74           HD1      ARG  74  34.497  27.439  30.344
  618    HE   ARG  74           HE       ARG  74  34.756  26.752  32.595
  619   HH11  ARG  74          HH11      ARG  74  33.940  26.343  34.662
  620   HH12  ARG  74          HH12      ARG  74  32.423  27.034  35.133
  621   HH21  ARG  74          HH21      ARG  74  31.912  28.636  32.101
  622   HH22  ARG  74          HH22      ARG  74  31.275  28.331  33.683
  623    H    GLY  75           HN       GLY  75  35.459  32.200  32.119
  624    HA2  GLY  75           HA3      GLY  75  38.170  31.545  31.588
  625    HA3  GLY  75           HA2      GLY  75  37.942  33.248  31.185
  626    H    GLY  76           HN       GLY  76  39.620  33.160  33.124
  627    HA2  GLY  76           HA3      GLY  76  38.889  32.628  35.770
  628    HA3  GLY  76           HA2      GLY  76  39.979  33.939  35.314
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1  29.024  29.067   1.677
    2    H2   MET   1           HT2      MET   1  28.286  27.590   1.280
    3    H3   MET   1           HT3      MET   1  28.781  27.891   2.877
    4    HA   MET   1           HA       MET   1  26.611  29.287   1.408
    5    HB2  MET   1           HB2      MET   1  26.687  27.263   3.653
    6    HB3  MET   1           HB1      MET   1  25.281  28.288   3.368
    7    HG2  MET   1           HG2      MET   1  26.529  26.557   1.219
    8    HG3  MET   1           HG1      MET   1  25.189  26.022   2.234
    9    HE1  MET   1           HE1      MET   1  25.198  26.484  -1.200
   10    HE2  MET   1           HE2      MET   1  23.444  26.604  -1.098
   11    HE3  MET   1           HE3      MET   1  24.305  25.487  -0.044
   12    H    GLN   2           HN       GLN   2  25.423  30.786   2.885
   13    HA   GLN   2           HA       GLN   2  27.329  32.418   4.394
   14    HB2  GLN   2           HB2      GLN   2  25.144  33.779   4.823
   15    HB3  GLN   2           HB1      GLN   2  25.784  33.713   3.181
   16    HG2  GLN   2           HG2      GLN   2  24.195  32.067   2.514
   17    HG3  GLN   2           HG1      GLN   2  23.723  31.741   4.183
   18   HE21  GLN   2          HE21      GLN   2  21.529  32.310   2.880
   19   HE22  GLN   2          HE22      GLN   2  21.043  33.931   3.004
   20    H    ILE   3           HN       ILE   3  27.849  30.970   6.159
   21    HA   ILE   3           HA       ILE   3  25.727  29.994   7.908
   22    HB   ILE   3           HB       ILE   3  27.740  29.482   9.433
   23   HG12  ILE   3          HG12      ILE   3  29.287  30.139   6.916
   24   HG13  ILE   3          HG11      ILE   3  29.162  31.261   8.270
   25   HG21  ILE   3          HG21      ILE   3  26.750  27.760   8.037
   26   HG22  ILE   3          HG22      ILE   3  28.503  27.633   7.914
   27   HG23  ILE   3          HG23      ILE   3  27.581  28.383   6.612
   28   HD11  ILE   3          HD11      ILE   3  31.215  29.920   8.457
   29   HD12  ILE   3          HD12      ILE   3  30.258  28.438   8.407
   30   HD13  ILE   3          HD13      ILE   3  30.106  29.538   9.776
   31    H    PHE   4           HN       PHE   4  24.959  30.975   9.751
   32    HA   PHE   4           HA       PHE   4  25.836  33.771  10.244
   33    HB2  PHE   4           HB2      PHE   4  23.495  32.160  11.308
   34    HB3  PHE   4           HB1      PHE   4  23.812  33.851  11.703
   35    HD1  PHE   4           HD1      PHE   4  22.693  31.505   9.114
   36    HD2  PHE   4           HD2      PHE   4  23.635  35.607   9.980
   37    HE1  PHE   4           HE1      PHE   4  21.554  32.209   7.027
   38    HE2  PHE   4           HE2      PHE   4  22.493  36.310   7.894
   39    HZ   PHE   4           HZ       PHE   4  21.454  34.609   6.416
   40    H    VAL   5           HN       VAL   5  26.489  34.481  12.333
   41    HA   VAL   5           HA       VAL   5  27.043  32.386  14.383
   42    HB   VAL   5           HB       VAL   5  29.096  34.381  13.363
   43   HG11  VAL   5          HG11      VAL   5  29.415  34.027  15.718
   44   HG12  VAL   5          HG12      VAL   5  30.601  33.017  14.890
   45   HG13  VAL   5          HG13      VAL   5  29.137  32.293  15.556
   46   HG21  VAL   5          HG21      VAL   5  30.312  32.304  12.660
   47   HG22  VAL   5          HG22      VAL   5  28.803  32.549  11.780
   48   HG23  VAL   5          HG23      VAL   5  28.880  31.365  13.085
   49    H    LYS   6           HN       LYS   6  25.932  33.174  16.123
   50    HA   LYS   6           HA       LYS   6  25.793  36.132  16.530
   51    HB2  LYS   6           HB2      LYS   6  24.202  33.861  17.758
   52    HB3  LYS   6           HB1      LYS   6  23.967  35.571  18.121
   53    HG2  LYS   6           HG2      LYS   6  23.466  36.005  15.738
   54    HG3  LYS   6           HG1      LYS   6  23.678  34.289  15.387
   55    HD2  LYS   6           HD2      LYS   6  21.843  33.751  16.964
   56    HD3  LYS   6           HD1      LYS   6  21.612  35.475  17.265
   57    HE2  LYS   6           HE2      LYS   6  21.367  34.135  14.556
   58    HE3  LYS   6           HE1      LYS   6  20.010  34.611  15.576
   59    HZ1  LYS   6           HZ1      LYS   6  20.219  36.431  14.231
   60    HZ2  LYS   6           HZ2      LYS   6  21.908  36.292  14.097
   61    HZ3  LYS   6           HZ3      LYS   6  21.213  36.900  15.523
   62    H    THR   7           HN       THR   7  27.173  36.987  17.993
   63    HA   THR   7           HA       THR   7  28.627  35.248  19.859
   64    HB   THR   7           HB       THR   7  28.679  38.270  19.617
   65    HG1  THR   7           HG1      THR   7  29.411  36.493  17.867
   66   HG21  THR   7          HG21      THR   7  31.019  37.853  20.565
   67   HG22  THR   7          HG22      THR   7  30.458  36.226  20.949
   68   HG23  THR   7          HG23      THR   7  29.672  37.625  21.679
   69    H    LEU   8           HN       LEU   8  28.701  35.836  22.215
   70    HA   LEU   8           HA       LEU   8  26.093  35.852  23.359
   71    HB2  LEU   8           HB2      LEU   8  28.041  34.928  24.537
   72    HB3  LEU   8           HB1      LEU   8  28.767  36.530  24.625
   73    HG   LEU   8           HG       LEU   8  26.908  37.322  26.027
   74   HD11  LEU   8          HD11      LEU   8  25.381  35.381  26.931
   75   HD12  LEU   8          HD12      LEU   8  25.826  34.571  25.429
   76   HD13  LEU   8          HD13      LEU   8  24.995  36.126  25.382
   77   HD21  LEU   8          HD21      LEU   8  27.402  35.964  28.026
   78   HD22  LEU   8          HD22      LEU   8  28.873  36.269  27.099
   79   HD23  LEU   8          HD23      LEU   8  28.079  34.697  27.002
   80    H    THR   9           HN       THR   9  28.379  38.458  22.681
   81    HA   THR   9           HA       THR   9  26.819  40.460  24.126
   82    HB   THR   9           HB       THR   9  28.384  42.070  23.098
   83    HG1  THR   9           HG1      THR   9  29.733  39.954  21.871
   84   HG21  THR   9          HG21      THR   9  29.209  41.030  25.078
   85   HG22  THR   9          HG22      THR   9  30.532  40.955  23.914
   86   HG23  THR   9          HG23      THR   9  29.551  39.523  24.228
   87    H    GLY  10           HN       GLY  10  26.143  38.794  21.385
   88    HA2  GLY  10           HA3      GLY  10  24.259  39.227  19.965
   89    HA3  GLY  10           HA2      GLY  10  24.334  40.931  20.411
   90    H    LYS  11           HN       LYS  11  27.380  40.656  19.904
   91    HA   LYS  11           HA       LYS  11  27.469  41.858  17.351
   92    HB2  LYS  11           HB2      LYS  11  29.373  41.839  18.971
   93    HB3  LYS  11           HB1      LYS  11  29.642  40.138  18.590
   94    HG2  LYS  11           HG2      LYS  11  30.035  40.708  16.232
   95    HG3  LYS  11           HG1      LYS  11  29.733  42.410  16.584
   96    HD2  LYS  11           HD2      LYS  11  31.645  42.436  18.141
   97    HD3  LYS  11           HD1      LYS  11  31.948  40.733  17.799
   98    HE2  LYS  11           HE2      LYS  11  32.331  41.271  15.424
   99    HE3  LYS  11           HE1      LYS  11  32.022  42.974  15.757
  100    HZ1  LYS  11           HZ1      LYS  11  34.444  41.958  15.779
  101    HZ2  LYS  11           HZ2      LYS  11  34.029  41.634  17.395
  102    HZ3  LYS  11           HZ3      LYS  11  33.992  43.228  16.809
  103    H    THR  12           HN       THR  12  26.083  40.645  15.953
  104    HA   THR  12           HA       THR  12  26.849  37.845  15.333
  105    HB   THR  12           HB       THR  12  24.556  39.552  14.319
  106    HG1  THR  12           HG1      THR  12  24.554  37.398  16.156
  107   HG21  THR  12          HG21      THR  12  23.655  37.305  13.610
  108   HG22  THR  12          HG22      THR  12  25.238  36.621  13.976
  109   HG23  THR  12          HG23      THR  12  25.074  37.833  12.706
  110    H    ILE  13           HN       ILE  13  28.173  37.403  13.647
  111    HA   ILE  13           HA       ILE  13  28.477  39.446  11.469
  112    HB   ILE  13           HB       ILE  13  30.767  38.448  11.182
  113   HG12  ILE  13          HG12      ILE  13  30.127  37.111  13.831
  114   HG13  ILE  13          HG11      ILE  13  30.218  36.269  12.283
  115   HG21  ILE  13          HG21      ILE  13  31.735  39.581  13.133
  116   HG22  ILE  13          HG22      ILE  13  30.172  39.544  13.948
  117   HG23  ILE  13          HG23      ILE  13  30.386  40.521  12.496
  118   HD11  ILE  13          HD11      ILE  13  32.471  37.812  13.604
  119   HD12  ILE  13          HD12      ILE  13  32.566  37.030  12.025
  120   HD13  ILE  13          HD13      ILE  13  32.349  36.057  13.480
  121    H    THR  14           HN       THR  14  28.805  38.542   9.319
  122    HA   THR  14           HA       THR  14  27.591  35.815   8.999
  123    HB   THR  14           HB       THR  14  26.947  36.592   6.739
  124    HG1  THR  14           HG1      THR  14  28.611  38.098   6.448
  125   HG21  THR  14          HG21      THR  14  26.092  38.659   8.769
  126   HG22  THR  14          HG22      THR  14  25.522  36.991   8.829
  127   HG23  THR  14          HG23      THR  14  25.154  37.999   7.429
  128    H    LEU  15           HN       LEU  15  28.900  34.264   8.165
  129    HA   LEU  15           HA       LEU  15  31.394  35.104   6.708
  130    HB2  LEU  15           HB2      LEU  15  31.073  32.672   8.491
  131    HB3  LEU  15           HB1      LEU  15  32.558  33.241   7.731
  132    HG   LEU  15           HG       LEU  15  30.963  34.819   9.772
  133   HD11  LEU  15          HD11      LEU  15  31.893  32.959  10.936
  134   HD12  LEU  15          HD12      LEU  15  33.017  34.289  11.212
  135   HD13  LEU  15          HD13      LEU  15  33.400  33.045  10.023
  136   HD21  LEU  15          HD21      LEU  15  33.258  36.050   9.848
  137   HD22  LEU  15          HD22      LEU  15  32.196  36.375   8.481
  138   HD23  LEU  15          HD23      LEU  15  33.562  35.275   8.293
  139    H    GLU  16           HN       GLU  16  31.311  34.426   4.635
  140    HA   GLU  16           HA       GLU  16  29.599  32.071   3.937
  141    HB2  GLU  16           HB2      GLU  16  29.182  34.230   2.746
  142    HB3  GLU  16           HB1      GLU  16  30.832  34.169   2.125
  143    HG2  GLU  16           HG2      GLU  16  30.355  32.038   1.005
  144    HG3  GLU  16           HG1      GLU  16  28.717  32.045   1.659
  145    H    VAL  17           HN       VAL  17  30.703  30.182   3.713
  146    HA   VAL  17           HA       VAL  17  33.155  30.098   2.134
  147    HB   VAL  17           HB       VAL  17  34.138  30.743   4.251
  148   HG11  VAL  17          HG11      VAL  17  33.750  29.463   6.297
  149   HG12  VAL  17          HG12      VAL  17  32.687  28.355   5.430
  150   HG13  VAL  17          HG13      VAL  17  32.208  30.036   5.664
  151   HG21  VAL  17          HG21      VAL  17  35.668  28.923   4.549
  152   HG22  VAL  17          HG22      VAL  17  35.181  28.883   2.854
  153   HG23  VAL  17          HG23      VAL  17  34.472  27.748   4.003
  154    H    GLU  18           HN       GLU  18  33.689  27.955   1.508
  155    HA   GLU  18           HA       GLU  18  31.628  26.143   1.079
  156    HB2  GLU  18           HB2      GLU  18  34.586  25.623   1.424
  157    HB3  GLU  18           HB1      GLU  18  33.450  24.410   0.838
  158    HG2  GLU  18           HG2      GLU  18  34.417  25.457  -1.101
  159    HG3  GLU  18           HG1      GLU  18  32.766  26.063  -0.959
  160    HA   PRO  19           HA       PRO  19  30.813  24.993   5.454
  161    HB2  PRO  19           HB2      PRO  19  29.357  22.823   3.963
  162    HB3  PRO  19           HB1      PRO  19  28.825  23.776   5.365
  163    HG2  PRO  19           HG2      PRO  19  27.929  24.335   2.932
  164    HG3  PRO  19           HG1      PRO  19  28.323  25.632   4.077
  165    HD2  PRO  19           HD2      PRO  19  29.837  24.736   1.657
  166    HD3  PRO  19           HD1      PRO  19  29.727  26.353   2.384
  167    H    SER  20           HN       SER  20  32.296  23.068   2.952
  168    HA   SER  20           HA       SER  20  32.875  20.784   4.660
  169    HB2  SER  20           HB2      SER  20  34.448  21.501   2.188
  170    HB3  SER  20           HB1      SER  20  34.066  19.904   2.835
  171    HG   SER  20           HG       SER  20  31.766  20.766   2.451
  172    H    ASP  21           HN       ASP  21  33.902  23.860   4.894
  173    HA   ASP  21           HA       ASP  21  36.742  23.596   5.164
  174    HB2  ASP  21           HB2      ASP  21  34.655  25.589   5.961
  175    HB3  ASP  21           HB1      ASP  21  36.201  25.683   6.791
  176    H    THR  22           HN       THR  22  37.930  23.609   7.247
  177    HA   THR  22           HA       THR  22  36.799  21.633   9.084
  178    HB   THR  22           HB       THR  22  38.983  21.729  10.183
  179    HG1  THR  22           HG1      THR  22  40.516  23.243   9.348
  180   HG21  THR  22          HG21      THR  22  38.671  20.533   7.961
  181   HG22  THR  22          HG22      THR  22  40.333  20.973   8.355
  182   HG23  THR  22          HG23      THR  22  39.416  21.937   7.197
  183    H    ILE  23           HN       ILE  23  37.047  22.089  11.517
  184    HA   ILE  23           HA       ILE  23  35.441  24.407  12.185
  185    HB   ILE  23           HB       ILE  23  37.064  22.708  14.099
  186   HG12  ILE  23          HG12      ILE  23  35.795  21.166  12.736
  187   HG13  ILE  23          HG11      ILE  23  34.954  21.331  14.275
  188   HG21  ILE  23          HG21      ILE  23  34.393  24.077  14.491
  189   HG22  ILE  23          HG22      ILE  23  35.933  24.845  14.880
  190   HG23  ILE  23          HG23      ILE  23  35.439  23.379  15.727
  191   HD11  ILE  23          HD11      ILE  23  33.580  23.188  13.093
  192   HD12  ILE  23          HD12      ILE  23  33.231  21.514  12.672
  193   HD13  ILE  23          HD13      ILE  23  34.216  22.504  11.597
  194    H    GLU  24           HN       GLU  24  38.879  23.598  12.427
  195    HA   GLU  24           HA       GLU  24  39.713  25.875  13.920
  196    HB2  GLU  24           HB2      GLU  24  41.330  24.576  11.723
  197    HB3  GLU  24           HB1      GLU  24  41.925  25.364  13.183
  198    HG2  GLU  24           HG2      GLU  24  40.344  22.783  13.051
  199    HG3  GLU  24           HG1      GLU  24  42.051  22.945  13.473
  200    H    ASN  25           HN       ASN  25  38.720  25.495  10.612
  201    HA   ASN  25           HA       ASN  25  39.947  27.931   9.621
  202    HB2  ASN  25           HB2      ASN  25  39.217  26.107   8.105
  203    HB3  ASN  25           HB1      ASN  25  37.542  26.400   8.576
  204   HD21  ASN  25          HD21      ASN  25  36.427  27.854   7.265
  205   HD22  ASN  25          HD22      ASN  25  37.153  29.012   6.259
  206    H    VAL  26           HN       VAL  26  36.723  27.045  10.844
  207    HA   VAL  26           HA       VAL  26  35.575  29.662  10.531
  208    HB   VAL  26           HB       VAL  26  34.854  27.613  12.646
  209   HG11  VAL  26          HG11      VAL  26  33.287  29.762  11.190
  210   HG12  VAL  26          HG12      VAL  26  33.757  29.780  12.891
  211   HG13  VAL  26          HG13      VAL  26  32.587  28.594  12.311
  212   HG21  VAL  26          HG21      VAL  26  34.182  27.742   9.699
  213   HG22  VAL  26          HG22      VAL  26  33.194  26.847  10.852
  214   HG23  VAL  26          HG23      VAL  26  34.879  26.392  10.594
  215    H    LYS  27           HN       LYS  27  36.593  28.030  13.547
  216    HA   LYS  27           HA       LYS  27  36.572  30.125  15.325
  217    HB2  LYS  27           HB2      LYS  27  38.692  27.980  15.011
  218    HB3  LYS  27           HB1      LYS  27  38.563  29.033  16.422
  219    HG2  LYS  27           HG2      LYS  27  36.171  28.250  16.670
  220    HG3  LYS  27           HG1      LYS  27  36.505  27.052  15.420
  221    HD2  LYS  27           HD2      LYS  27  38.280  26.070  16.775
  222    HD3  LYS  27           HD1      LYS  27  38.072  27.320  18.001
  223    HE2  LYS  27           HE2      LYS  27  35.752  26.548  18.386
  224    HE3  LYS  27           HE1      LYS  27  35.983  25.281  17.183
  225    HZ1  LYS  27           HZ1      LYS  27  37.600  24.238  18.504
  226    HZ2  LYS  27           HZ2      LYS  27  36.334  24.623  19.569
  227    HZ3  LYS  27           HZ3      LYS  27  37.743  25.571  19.544
  228    H    ALA  28           HN       ALA  28  38.744  29.721  12.633
  229    HA   ALA  28           HA       ALA  28  40.758  31.605  13.467
  230    HB1  ALA  28           HB1      ALA  28  40.826  29.904  11.504
  231    HB2  ALA  28           HB2      ALA  28  41.574  31.481  11.249
  232    HB3  ALA  28           HB3      ALA  28  39.974  31.145  10.585
  233    H    LYS  29           HN       LYS  29  38.051  31.979  11.160
  234    HA   LYS  29           HA       LYS  29  38.236  34.754  10.775
  235    HB2  LYS  29           HB2      LYS  29  35.865  32.889  10.806
  236    HB3  LYS  29           HB1      LYS  29  35.686  34.603  10.431
  237    HG2  LYS  29           HG2      LYS  29  36.964  34.450   8.468
  238    HG3  LYS  29           HG1      LYS  29  37.772  32.970   8.986
  239    HD2  LYS  29           HD2      LYS  29  35.636  31.747   8.777
  240    HD3  LYS  29           HD1      LYS  29  34.858  33.217   8.192
  241    HE2  LYS  29           HE2      LYS  29  37.282  31.976   6.866
  242    HE3  LYS  29           HE1      LYS  29  35.625  31.640   6.365
  243    HZ1  LYS  29           HZ1      LYS  29  36.907  34.317   6.448
  244    HZ2  LYS  29           HZ2      LYS  29  35.300  34.007   5.990
  245    HZ3  LYS  29           HZ3      LYS  29  36.585  33.413   5.050
  246    H    ILE  30           HN       ILE  30  37.069  32.989  13.539
  247    HA   ILE  30           HA       ILE  30  35.785  35.346  14.751
  248    HB   ILE  30           HB       ILE  30  36.290  32.494  15.617
  249   HG12  ILE  30          HG12      ILE  30  33.865  32.419  15.732
  250   HG13  ILE  30          HG11      ILE  30  33.757  34.163  15.491
  251   HG21  ILE  30          HG21      ILE  30  36.719  33.669  17.661
  252   HG22  ILE  30          HG22      ILE  30  35.032  33.165  17.756
  253   HG23  ILE  30          HG23      ILE  30  35.432  34.833  17.343
  254   HD11  ILE  30          HD11      ILE  30  34.538  33.999  13.242
  255   HD12  ILE  30          HD12      ILE  30  33.341  32.716  13.422
  256   HD13  ILE  30          HD13      ILE  30  35.060  32.331  13.471
  257    H    GLN  31           HN       GLN  31  38.408  33.232  15.924
  258    HA   GLN  31           HA       GLN  31  39.526  34.723  17.897
  259    HB2  GLN  31           HB2      GLN  31  40.362  32.520  16.963
  260    HB3  GLN  31           HB1      GLN  31  41.233  33.456  15.747
  261    HG2  GLN  31           HG2      GLN  31  42.279  34.749  17.646
  262    HG3  GLN  31           HG1      GLN  31  41.585  33.564  18.747
  263   HE21  GLN  31          HE21      GLN  31  44.225  33.473  18.958
  264   HE22  GLN  31          HE22      GLN  31  44.931  32.226  18.047
  265    H    ASP  32           HN       ASP  32  40.231  35.263  14.440
  266    HA   ASP  32           HA       ASP  32  42.019  37.485  14.936
  267    HB2  ASP  32           HB2      ASP  32  42.032  36.213  12.813
  268    HB3  ASP  32           HB1      ASP  32  40.427  36.843  12.436
  269    H    LYS  33           HN       LYS  33  38.677  37.421  13.736
  270    HA   LYS  33           HA       LYS  33  38.260  40.229  13.744
  271    HB2  LYS  33           HB2      LYS  33  36.443  37.867  13.891
  272    HB3  LYS  33           HB1      LYS  33  35.772  39.482  14.043
  273    HG2  LYS  33           HG2      LYS  33  35.843  38.469  11.690
  274    HG3  LYS  33           HG1      LYS  33  36.471  40.100  11.862
  275    HD2  LYS  33           HD2      LYS  33  38.732  39.345  11.702
  276    HD3  LYS  33           HD1      LYS  33  38.274  37.670  11.979
  277    HE2  LYS  33           HE2      LYS  33  37.434  39.290   9.564
  278    HE3  LYS  33           HE1      LYS  33  38.786  38.157   9.585
  279    HZ1  LYS  33           HZ1      LYS  33  37.248  36.397  10.210
  280    HZ2  LYS  33           HZ2      LYS  33  36.790  37.110   8.737
  281    HZ3  LYS  33           HZ3      LYS  33  35.951  37.488  10.166
  282    H    GLU  34           HN       GLU  34  37.767  37.878  16.381
  283    HA   GLU  34           HA       GLU  34  36.892  40.089  18.166
  284    HB2  GLU  34           HB2      GLU  34  37.187  37.196  18.974
  285    HB3  GLU  34           HB1      GLU  34  36.114  38.428  19.638
  286    HG2  GLU  34           HG2      GLU  34  35.908  37.159  16.894
  287    HG3  GLU  34           HG1      GLU  34  34.811  36.908  18.252
  288    H    GLY  35           HN       GLY  35  39.680  38.129  17.486
  289    HA2  GLY  35           HA3      GLY  35  41.872  38.276  18.369
  290    HA3  GLY  35           HA2      GLY  35  41.360  39.744  19.198
  291    H    ILE  36           HN       ILE  36  39.359  37.059  19.784
  292    HA   ILE  36           HA       ILE  36  40.321  36.898  22.559
  293    HB   ILE  36           HB       ILE  36  37.911  35.661  21.222
  294   HG12  ILE  36          HG12      ILE  36  38.245  38.219  22.818
  295   HG13  ILE  36          HG11      ILE  36  37.920  38.121  21.088
  296   HG21  ILE  36          HG21      ILE  36  37.094  35.354  23.478
  297   HG22  ILE  36          HG22      ILE  36  38.492  36.195  24.144
  298   HG23  ILE  36          HG23      ILE  36  38.691  34.621  23.377
  299   HD11  ILE  36          HD11      ILE  36  35.820  38.505  22.194
  300   HD12  ILE  36          HD12      ILE  36  36.132  37.202  23.341
  301   HD13  ILE  36          HD13      ILE  36  35.833  36.831  21.643
  302    HA   PRO  37           HA       PRO  37  42.320  32.994  21.474
  303    HB2  PRO  37           HB2      PRO  37  43.106  32.164  23.928
  304    HB3  PRO  37           HB1      PRO  37  43.854  33.564  23.130
  305    HG2  PRO  37           HG2      PRO  37  41.732  33.509  25.238
  306    HG3  PRO  37           HG1      PRO  37  43.175  34.534  25.127
  307    HD2  PRO  37           HD2      PRO  37  40.678  35.389  24.360
  308    HD3  PRO  37           HD1      PRO  37  42.179  36.005  23.633
  309    HA   PRO  38           HA       PRO  38  38.825  30.109  21.686
  310    HB2  PRO  38           HB2      PRO  38  41.155  28.233  21.853
  311    HB3  PRO  38           HB1      PRO  38  39.629  28.040  20.962
  312    HG2  PRO  38           HG2      PRO  38  41.765  28.855  19.696
  313    HG3  PRO  38           HG1      PRO  38  40.212  29.625  19.367
  314    HD2  PRO  38           HD2      PRO  38  42.567  30.704  20.862
  315    HD3  PRO  38           HD1      PRO  38  41.313  31.575  19.948
  316    H    ASP  39           HN       ASP  39  41.606  29.537  23.837
  317    HA   ASP  39           HA       ASP  39  40.347  27.923  25.768
  318    HB2  ASP  39           HB2      ASP  39  42.804  28.529  25.644
  319    HB3  ASP  39           HB1      ASP  39  42.388  30.067  26.401
  320    H    GLN  40           HN       GLN  40  39.517  31.094  24.951
  321    HA   GLN  40           HA       GLN  40  38.313  31.617  27.648
  322    HB2  GLN  40           HB2      GLN  40  39.187  33.418  25.386
  323    HB3  GLN  40           HB1      GLN  40  38.080  33.981  26.632
  324    HG2  GLN  40           HG2      GLN  40  40.725  32.687  27.301
  325    HG3  GLN  40           HG1      GLN  40  40.564  34.426  27.057
  326   HE21  GLN  40          HE21      GLN  40  38.698  35.450  28.445
  327   HE22  GLN  40          HE22      GLN  40  38.531  34.861  30.028
  328    H    GLN  41           HN       GLN  41  37.458  30.222  24.846
  329    HA   GLN  41           HA       GLN  41  34.624  30.970  25.199
  330    HB2  GLN  41           HB2      GLN  41  34.416  31.341  22.718
  331    HB3  GLN  41           HB1      GLN  41  35.288  32.603  23.576
  332    HG2  GLN  41           HG2      GLN  41  37.428  31.530  22.929
  333    HG3  GLN  41           HG1      GLN  41  36.526  30.303  22.038
  334   HE21  GLN  41          HE21      GLN  41  37.933  31.340  20.195
  335   HE22  GLN  41          HE22      GLN  41  37.245  32.659  19.379
  336    H    ARG  42           HN       ARG  42  33.171  29.434  24.381
  337    HA   ARG  42           HA       ARG  42  34.320  26.956  23.161
  338    HB2  ARG  42           HB2      ARG  42  32.430  27.195  25.519
  339    HB3  ARG  42           HB1      ARG  42  32.595  25.708  24.586
  340    HG2  ARG  42           HG2      ARG  42  34.950  27.136  25.844
  341    HG3  ARG  42           HG1      ARG  42  34.052  25.872  26.679
  342    HD2  ARG  42           HD2      ARG  42  35.698  24.561  25.714
  343    HD3  ARG  42           HD1      ARG  42  34.560  24.557  24.368
  344    HE   ARG  42           HE       ARG  42  36.229  26.828  24.061
  345   HH11  ARG  42          HH11      ARG  42  37.987  26.719  22.645
  346   HH12  ARG  42          HH12      ARG  42  38.635  25.174  22.206
  347   HH21  ARG  42          HH21      ARG  42  36.374  23.384  24.132
  348   HH22  ARG  42          HH22      ARG  42  37.722  23.285  23.048
  349    H    LEU  43           HN       LEU  43  32.993  26.216  21.427
  350    HA   LEU  43           HA       LEU  43  30.755  28.002  20.738
  351    HB2  LEU  43           HB2      LEU  43  31.737  25.585  19.222
  352    HB3  LEU  43           HB1      LEU  43  30.755  26.921  18.606
  353    HG   LEU  43           HG       LEU  43  33.672  26.968  19.430
  354   HD11  LEU  43          HD11      LEU  43  33.907  27.841  17.127
  355   HD12  LEU  43          HD12      LEU  43  32.159  27.718  16.923
  356   HD13  LEU  43          HD13      LEU  43  33.126  26.259  17.143
  357   HD21  LEU  43          HD21      LEU  43  32.828  28.996  20.363
  358   HD22  LEU  43          HD22      LEU  43  31.714  29.228  19.015
  359   HD23  LEU  43          HD23      LEU  43  33.445  29.460  18.774
  360    H    ILE  44           HN       ILE  44  28.651  27.463  20.762
  361    HA   ILE  44           HA       ILE  44  27.878  24.715  21.711
  362    HB   ILE  44           HB       ILE  44  26.828  27.466  22.414
  363   HG12  ILE  44          HG12      ILE  44  26.898  26.627  24.667
  364   HG13  ILE  44          HG11      ILE  44  27.077  24.964  24.115
  365   HG21  ILE  44          HG21      ILE  44  24.800  26.178  23.416
  366   HG22  ILE  44          HG22      ILE  44  25.251  24.873  22.317
  367   HG23  ILE  44          HG23      ILE  44  24.784  26.445  21.669
  368   HD11  ILE  44          HD11      ILE  44  29.304  25.270  23.506
  369   HD12  ILE  44          HD12      ILE  44  29.182  26.258  24.958
  370   HD13  ILE  44          HD13      ILE  44  29.140  27.021  23.371
  371    H    PHE  45           HN       PHE  45  26.492  23.639  20.328
  372    HA   PHE  45           HA       PHE  45  24.914  25.179  18.357
  373    HB2  PHE  45           HB2      PHE  45  26.753  24.781  16.965
  374    HB3  PHE  45           HB1      PHE  45  27.161  23.268  17.767
  375    HD1  PHE  45           HD1      PHE  45  23.911  24.473  16.355
  376    HD2  PHE  45           HD2      PHE  45  27.089  21.600  16.115
  377    HE1  PHE  45           HE1      PHE  45  22.643  23.217  14.631
  378    HE2  PHE  45           HE2      PHE  45  25.826  20.342  14.387
  379    HZ   PHE  45           HZ       PHE  45  23.602  21.149  13.648
  380    H    ALA  46           HN       ALA  46  22.942  24.470  19.099
  381    HA   ALA  46           HA       ALA  46  21.153  23.008  19.450
  382    HB1  ALA  46           HB1      ALA  46  22.761  20.826  18.132
  383    HB2  ALA  46           HB2      ALA  46  22.117  22.170  17.190
  384    HB3  ALA  46           HB3      ALA  46  21.022  21.110  18.074
  385    H    GLY  47           HN       GLY  47  23.203  23.186  21.541
  386    HA2  GLY  47           HA3      GLY  47  23.363  22.127  23.651
  387    HA3  GLY  47           HA2      GLY  47  22.427  20.778  23.014
  388    H    LYS  48           HN       LYS  48  24.870  21.381  20.844
  389    HA   LYS  48           HA       LYS  48  26.751  19.454  22.174
  390    HB2  LYS  48           HB2      LYS  48  25.974  19.609  19.270
  391    HB3  LYS  48           HB1      LYS  48  27.219  18.552  19.918
  392    HG2  LYS  48           HG2      LYS  48  25.527  17.471  21.369
  393    HG3  LYS  48           HG1      LYS  48  24.282  18.512  20.675
  394    HD2  LYS  48           HD2      LYS  48  24.770  17.583  18.432
  395    HD3  LYS  48           HD1      LYS  48  25.983  16.520  19.145
  396    HE2  LYS  48           HE2      LYS  48  23.040  16.538  19.881
  397    HE3  LYS  48           HE1      LYS  48  23.809  15.359  18.819
  398    HZ1  LYS  48           HZ1      LYS  48  25.418  15.187  20.894
  399    HZ2  LYS  48           HZ2      LYS  48  24.003  14.256  20.767
  400    HZ3  LYS  48           HZ3      LYS  48  24.013  15.668  21.712
  401    H    GLN  49           HN       GLN  49  28.998  19.898  21.801
  402    HA   GLN  49           HA       GLN  49  29.540  22.624  20.774
  403    HB2  GLN  49           HB2      GLN  49  31.382  20.887  22.371
  404    HB3  GLN  49           HB1      GLN  49  31.500  22.621  22.116
  405    HG2  GLN  49           HG2      GLN  49  29.371  22.927  23.354
  406    HG3  GLN  49           HG1      GLN  49  29.310  21.189  23.650
  407   HE21  GLN  49          HE21      GLN  49  31.221  24.129  24.358
  408   HE22  GLN  49          HE22      GLN  49  31.983  23.496  25.735
  409    H    LEU  50           HN       LEU  50  31.812  22.772  19.686
  410    HA   LEU  50           HA       LEU  50  32.102  20.464  17.789
  411    HB2  LEU  50           HB2      LEU  50  33.100  23.297  17.408
  412    HB3  LEU  50           HB1      LEU  50  32.956  22.032  16.188
  413    HG   LEU  50           HG       LEU  50  30.641  23.316  17.674
  414   HD11  LEU  50          HD11      LEU  50  30.155  24.468  15.641
  415   HD12  LEU  50          HD12      LEU  50  31.323  23.510  14.732
  416   HD13  LEU  50          HD13      LEU  50  31.883  24.697  15.909
  417   HD21  LEU  50          HD21      LEU  50  29.956  21.109  17.151
  418   HD22  LEU  50          HD22      LEU  50  30.839  21.100  15.624
  419   HD23  LEU  50          HD23      LEU  50  29.369  22.058  15.788
  420    H    GLU  51           HN       GLU  51  34.059  19.417  17.716
  421    HA   GLU  51           HA       GLU  51  36.123  20.254  19.680
  422    HB2  GLU  51           HB2      GLU  51  35.921  17.752  17.970
  423    HB3  GLU  51           HB1      GLU  51  37.090  18.033  19.262
  424    HG2  GLU  51           HG2      GLU  51  34.081  18.035  19.647
  425    HG3  GLU  51           HG1      GLU  51  35.131  16.665  20.005
  426    H    ASP  52           HN       ASP  52  38.404  20.304  18.996
  427    HA   ASP  52           HA       ASP  52  38.847  21.908  16.690
  428    HB2  ASP  52           HB2      ASP  52  40.723  20.211  18.354
  429    HB3  ASP  52           HB1      ASP  52  41.284  21.247  17.043
  430    H    GLY  53           HN       GLY  53  39.704  21.374  14.627
  431    HA2  GLY  53           HA3      GLY  53  40.193  19.991  12.781
  432    HA3  GLY  53           HA2      GLY  53  40.297  18.624  13.892
  433    H    ARG  54           HN       ARG  54  39.068  17.559  12.038
  434    HA   ARG  54           HA       ARG  54  37.062  16.548  11.390
  435    HB2  ARG  54           HB2      ARG  54  36.588  17.106  13.984
  436    HB3  ARG  54           HB1      ARG  54  35.426  18.218  13.276
  437    HG2  ARG  54           HG2      ARG  54  34.131  16.285  13.474
  438    HG3  ARG  54           HG1      ARG  54  34.725  16.123  11.824
  439    HD2  ARG  54           HD2      ARG  54  36.504  14.623  12.575
  440    HD3  ARG  54           HD1      ARG  54  36.026  14.855  14.256
  441    HE   ARG  54           HE       ARG  54  33.787  13.898  12.733
  442   HH11  ARG  54          HH11      ARG  54  33.204  11.731  12.988
  443   HH12  ARG  54          HH12      ARG  54  34.345  10.613  13.658
  444   HH21  ARG  54          HH21      ARG  54  36.832  12.996  14.075
  445   HH22  ARG  54          HH22      ARG  54  36.398  11.329  14.275
  446    H    THR  55           HN       THR  55  35.143  17.108  10.101
  447    HA   THR  55           HA       THR  55  35.154  19.960   9.153
  448    HB   THR  55           HB       THR  55  34.612  17.439   7.552
  449    HG1  THR  55           HG1      THR  55  36.597  18.091   6.538
  450   HG21  THR  55          HG21      THR  55  33.351  19.188   6.576
  451   HG22  THR  55          HG22      THR  55  34.849  19.154   5.648
  452   HG23  THR  55          HG23      THR  55  34.607  20.384   6.891
  453    H    LEU  56           HN       LEU  56  32.998  20.584   8.160
  454    HA   LEU  56           HA       LEU  56  30.857  19.964   9.988
  455    HB2  LEU  56           HB2      LEU  56  30.537  21.185   7.235
  456    HB3  LEU  56           HB1      LEU  56  29.506  21.420   8.646
  457    HG   LEU  56           HG       LEU  56  32.345  22.405   8.264
  458   HD11  LEU  56          HD11      LEU  56  30.281  23.670   7.337
  459   HD12  LEU  56          HD12      LEU  56  31.419  24.577   8.333
  460   HD13  LEU  56          HD13      LEU  56  29.901  24.006   9.026
  461   HD21  LEU  56          HD21      LEU  56  32.300  21.708  10.532
  462   HD22  LEU  56          HD22      LEU  56  30.625  22.219  10.744
  463   HD23  LEU  56          HD23      LEU  56  31.906  23.425  10.601
  464    H    SER  57           HN       SER  57  31.581  18.924   6.653
  465    HA   SER  57           HA       SER  57  29.219  17.305   6.347
  466    HB2  SER  57           HB2      SER  57  30.485  16.162   4.562
  467    HB3  SER  57           HB1      SER  57  30.695  17.907   4.439
  468    HG   SER  57           HG       SER  57  32.722  17.725   5.147
  469    H    ASP  58           HN       ASP  58  32.510  16.607   7.434
  470    HA   ASP  58           HA       ASP  58  32.287  13.870   8.012
  471    HB2  ASP  58           HB2      ASP  58  34.382  15.207   8.256
  472    HB3  ASP  58           HB1      ASP  58  33.716  15.929   9.720
  473    H    TYR  59           HN       TYR  59  31.092  16.647   9.855
  474    HA   TYR  59           HA       TYR  59  30.263  15.060  12.149
  475    HB2  TYR  59           HB2      TYR  59  29.822  17.883  11.206
  476    HB3  TYR  59           HB1      TYR  59  28.749  17.244  12.450
  477    HD1  TYR  59           HD1      TYR  59  31.728  19.013  11.968
  478    HD2  TYR  59           HD2      TYR  59  30.078  15.841  14.352
  479    HE1  TYR  59           HE1      TYR  59  33.451  19.418  13.703
  480    HE2  TYR  59           HE2      TYR  59  31.802  16.249  16.086
  481    HH   TYR  59           HH       TYR  59  34.303  18.750  15.638
  482    H    ASN  60           HN       ASN  60  29.017  15.600   8.999
  483    HA   ASN  60           HA       ASN  60  27.034  14.909   7.968
  484    HB2  ASN  60           HB2      ASN  60  27.782  12.770   9.181
  485    HB3  ASN  60           HB1      ASN  60  26.576  13.175  10.402
  486   HD21  ASN  60          HD21      ASN  60  27.008  11.570   7.433
  487   HD22  ASN  60          HD22      ASN  60  25.375  11.448   6.985
  488    H    ILE  61           HN       ILE  61  26.556  17.282   8.902
  489    HA   ILE  61           HA       ILE  61  24.714  17.574  11.065
  490    HB   ILE  61           HB       ILE  61  25.049  19.260   8.563
  491   HG12  ILE  61          HG12      ILE  61  26.124  19.726  11.358
  492   HG13  ILE  61          HG11      ILE  61  27.060  18.930  10.092
  493   HG21  ILE  61          HG21      ILE  61  23.608  19.750  11.181
  494   HG22  ILE  61          HG22      ILE  61  22.925  19.788   9.555
  495   HG23  ILE  61          HG23      ILE  61  24.051  21.044  10.069
  496   HD11  ILE  61          HD11      ILE  61  27.049  20.874   8.718
  497   HD12  ILE  61          HD12      ILE  61  27.409  21.457  10.342
  498   HD13  ILE  61          HD13      ILE  61  25.784  21.639   9.680
  499    H    GLN  62           HN       GLN  62  22.540  17.165  11.175
  500    HA   GLN  62           HA       GLN  62  21.228  15.609   9.186
  501    HB2  GLN  62           HB2      GLN  62  20.126  17.287  11.454
  502    HB3  GLN  62           HB1      GLN  62  19.130  16.220  10.465
  503    HG2  GLN  62           HG2      GLN  62  19.764  14.978  12.428
  504    HG3  GLN  62           HG1      GLN  62  20.705  14.337  11.082
  505   HE21  GLN  62          HE21      GLN  62  22.713  13.810  12.002
  506   HE22  GLN  62          HE22      GLN  62  23.648  14.874  12.939
  507    H    LYS  63           HN       LYS  63  20.839  19.082   9.979
  508    HA   LYS  63           HA       LYS  63  18.972  19.616   7.884
  509    HB2  LYS  63           HB2      LYS  63  20.926  21.423   9.329
  510    HB3  LYS  63           HB1      LYS  63  19.696  22.011   8.208
  511    HG2  LYS  63           HG2      LYS  63  17.934  20.985   9.596
  512    HG3  LYS  63           HG1      LYS  63  19.160  20.398  10.720
  513    HD2  LYS  63           HD2      LYS  63  19.849  22.703  11.209
  514    HD3  LYS  63           HD1      LYS  63  18.666  23.315  10.052
  515    HE2  LYS  63           HE2      LYS  63  17.761  23.462  12.325
  516    HE3  LYS  63           HE1      LYS  63  16.850  22.275  11.390
  517    HZ1  LYS  63           HZ1      LYS  63  19.021  20.973  12.571
  518    HZ2  LYS  63           HZ2      LYS  63  17.366  20.755  12.890
  519    HZ3  LYS  63           HZ3      LYS  63  18.262  21.892  13.779
  520    H    GLU  64           HN       GLU  64  22.450  19.286   7.872
  521    HA   GLU  64           HA       GLU  64  24.049  19.765   6.210
  522    HB2  GLU  64           HB2      GLU  64  23.563  18.539   4.118
  523    HB3  GLU  64           HB1      GLU  64  23.170  17.583   5.543
  524    HG2  GLU  64           HG2      GLU  64  20.814  18.017   5.279
  525    HG3  GLU  64           HG1      GLU  64  21.117  19.217   4.023
  526    H    SEP  65           HN       SEP  65  22.573  22.087   6.639
  527    HA   SEP  65           HA       SEP  65  22.882  23.381   4.031
  528    HB2  SEP  65           HB1      SEP  65  20.640  24.149   3.766
  529    HB3  SEP  65           HB2      SEP  65  20.180  23.588   5.370
  530    H    TPO  66           HN       TPO  66  21.086  25.609   5.051
  531    HA   TPO  66           HA       TPO  66  23.000  27.261   6.250
  532    HB   TPO  66           HB       TPO  66  21.155  28.681   6.966
  533   HG21  TPO  66          HG21      TPO  66  20.512  27.206   4.396
  534   HG22  TPO  66          HG22      TPO  66  21.586  28.594   4.554
  535   HG23  TPO  66          HG23      TPO  66  19.858  28.779   4.852
  536    H    LEU  67           HN       LEU  67  23.406  27.845   8.482
  537    HA   LEU  67           HA       LEU  67  22.161  26.240  10.602
  538    HB2  LEU  67           HB2      LEU  67  24.115  24.899   9.501
  539    HB3  LEU  67           HB1      LEU  67  25.161  26.041  10.336
  540    HG   LEU  67           HG       LEU  67  23.740  25.431  12.454
  541   HD11  LEU  67          HD11      LEU  67  21.974  24.129  11.477
  542   HD12  LEU  67          HD12      LEU  67  23.012  22.990  12.324
  543   HD13  LEU  67          HD13      LEU  67  23.115  23.135  10.574
  544   HD21  LEU  67          HD21      LEU  67  26.129  24.842  12.100
  545   HD22  LEU  67          HD22      LEU  67  25.628  23.388  11.239
  546   HD23  LEU  67          HD23      LEU  67  25.258  23.569  12.952
  547    H    HIS  68           HN       HIS  68  22.642  27.054  12.699
  548    HA   HIS  68           HA       HIS  68  23.901  29.786  12.713
  549    HB2  HIS  68           HB2      HIS  68  21.650  28.657  14.400
  550    HB3  HIS  68           HB1      HIS  68  22.389  30.239  14.647
  551    HD1  HIS  68           HD1      HIS  68  20.355  28.300  12.107
  552    HD2  HIS  68           HD2      HIS  68  21.527  32.232  12.865
  553    HE1  HIS  68           HE1      HIS  68  19.056  29.760  10.493
  554    HE2  HIS  68           HE2      HIS  68  19.762  32.154  10.946
  555    H    LEU  69           HN       LEU  69  25.522  30.146  14.157
  556    HA   LEU  69           HA       LEU  69  26.156  27.997  16.165
  557    HB2  LEU  69           HB2      LEU  69  27.914  29.625  14.328
  558    HB3  LEU  69           HB1      LEU  69  28.559  29.083  15.874
  559    HG   LEU  69           HG       LEU  69  27.894  26.735  15.260
  560   HD11  LEU  69          HD11      LEU  69  27.038  28.163  12.751
  561   HD12  LEU  69          HD12      LEU  69  26.246  26.849  13.617
  562   HD13  LEU  69          HD13      LEU  69  27.664  26.519  12.632
  563   HD21  LEU  69          HD21      LEU  69  30.196  27.601  14.953
  564   HD22  LEU  69          HD22      LEU  69  29.769  28.143  13.331
  565   HD23  LEU  69          HD23      LEU  69  29.780  26.421  13.710
  566    H    VAL  70           HN       VAL  70  26.846  28.784  18.250
  567    HA   VAL  70           HA       VAL  70  26.608  31.744  18.674
  568    HB   VAL  70           HB       VAL  70  25.372  29.579  20.406
  569   HG11  VAL  70          HG11      VAL  70  24.374  31.593  21.567
  570   HG12  VAL  70          HG12      VAL  70  25.479  32.599  20.631
  571   HG13  VAL  70          HG13      VAL  70  26.116  31.420  21.776
  572   HG21  VAL  70          HG21      VAL  70  23.228  30.665  19.701
  573   HG22  VAL  70          HG22      VAL  70  24.087  29.912  18.357
  574   HG23  VAL  70          HG23      VAL  70  24.146  31.660  18.569
  575    H    LEU  71           HN       LEU  71  28.459  32.455  19.637
  576    HA   LEU  71           HA       LEU  71  30.346  30.544  20.778
  577    HB2  LEU  71           HB2      LEU  71  30.308  33.545  20.401
  578    HB3  LEU  71           HB1      LEU  71  31.597  32.754  21.307
  579    HG   LEU  71           HG       LEU  71  32.250  31.453  19.391
  580   HD11  LEU  71          HD11      LEU  71  30.158  30.865  18.394
  581   HD12  LEU  71          HD12      LEU  71  31.003  31.834  17.188
  582   HD13  LEU  71          HD13      LEU  71  29.718  32.556  18.156
  583   HD21  LEU  71          HD21      LEU  71  31.693  34.350  18.703
  584   HD22  LEU  71          HD22      LEU  71  32.692  33.294  17.707
  585   HD23  LEU  71          HD23      LEU  71  33.183  33.671  19.359
  586    H    ARG  72           HN       ARG  72  30.964  30.446  23.002
  587    HA   ARG  72           HA       ARG  72  29.222  31.937  24.934
  588    HB2  ARG  72           HB2      ARG  72  28.606  29.453  24.540
  589    HB3  ARG  72           HB1      ARG  72  30.127  29.078  25.347
  590    HG2  ARG  72           HG2      ARG  72  29.405  30.373  27.319
  591    HG3  ARG  72           HG1      ARG  72  27.882  30.752  26.514
  592    HD2  ARG  72           HD2      ARG  72  27.449  28.279  26.331
  593    HD3  ARG  72           HD1      ARG  72  28.877  28.009  27.330
  594    HE   ARG  72           HE       ARG  72  26.291  29.010  28.262
  595   HH11  ARG  72          HH11      ARG  72  26.147  29.355  30.492
  596   HH12  ARG  72          HH12      ARG  72  27.594  29.386  31.445
  597   HH21  ARG  72          HH21      ARG  72  29.699  28.818  28.748
  598   HH22  ARG  72          HH22      ARG  72  29.604  29.081  30.457
  599    H    LEU  73           HN       LEU  73  30.295  32.111  27.109
  600    HA   LEU  73           HA       LEU  73  33.233  32.401  26.772
  601    HB2  LEU  73           HB2      LEU  73  31.219  33.390  28.798
  602    HB3  LEU  73           HB1      LEU  73  32.950  33.468  29.122
  603    HG   LEU  73           HG       LEU  73  33.311  34.820  27.129
  604   HD11  LEU  73          HD11      LEU  73  31.188  35.620  25.900
  605   HD12  LEU  73          HD12      LEU  73  30.379  34.251  26.662
  606   HD13  LEU  73          HD13      LEU  73  31.734  33.977  25.568
  607   HD21  LEU  73          HD21      LEU  73  31.010  35.751  28.873
  608   HD22  LEU  73          HD22      LEU  73  31.864  36.805  27.746
  609   HD23  LEU  73          HD23      LEU  73  32.727  36.084  29.104
  610    H    ARG  74           HN       ARG  74  34.668  31.046  27.795
  611    HA   ARG  74           HA       ARG  74  33.820  28.549  28.860
  612    HB2  ARG  74           HB2      ARG  74  36.129  29.121  27.963
  613    HB3  ARG  74           HB1      ARG  74  36.442  29.922  29.503
  614    HG2  ARG  74           HG2      ARG  74  35.772  27.732  30.630
  615    HG3  ARG  74           HG1      ARG  74  35.839  26.995  29.029
  616    HD2  ARG  74           HD2      ARG  74  37.989  26.636  30.027
  617    HD3  ARG  74           HD1      ARG  74  38.202  27.915  28.833
  618    HE   ARG  74           HE       ARG  74  37.603  29.130  31.338
  619   HH11  ARG  74          HH11      ARG  74  39.298  29.994  32.557
  620   HH12  ARG  74          HH12      ARG  74  40.921  29.463  32.258
  621   HH21  ARG  74          HH21      ARG  74  40.018  27.263  29.734
  622   HH22  ARG  74          HH22      ARG  74  41.327  27.917  30.660
  623    H    GLY  75           HN       GLY  75  34.841  31.542  30.511
  624    HA2  GLY  75           HA3      GLY  75  33.144  30.904  32.793
  625    HA3  GLY  75           HA2      GLY  75  34.863  30.763  33.161
  626    H    GLY  76           HN       GLY  76  34.707  33.032  30.797
  627    HA2  GLY  76           HA3      GLY  76  34.912  35.369  30.808
  628    HA3  GLY  76           HA2      GLY  76  33.695  35.358  32.085
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1  29.283  28.477   2.232
    2    H2   MET   1           HT2      MET   1  28.087  27.340   1.831
    3    H3   MET   1           HT3      MET   1  27.991  28.197   3.295
    4    HA   MET   1           HA       MET   1  27.939  29.552   0.666
    5    HB2  MET   1           HB2      MET   1  26.071  27.790   1.076
    6    HB3  MET   1           HB1      MET   1  25.487  28.903   2.310
    7    HG2  MET   1           HG2      MET   1  25.984  29.699  -0.576
    8    HG3  MET   1           HG1      MET   1  24.410  29.217   0.055
    9    HE1  MET   1           HE1      MET   1  23.912  32.971  -0.387
   10    HE2  MET   1           HE2      MET   1  23.714  31.349  -1.043
   11    HE3  MET   1           HE3      MET   1  25.223  32.220  -1.307
   12    H    GLN   2           HN       GLN   2  26.319  29.698   3.858
   13    HA   GLN   2           HA       GLN   2  27.700  32.198   4.520
   14    HB2  GLN   2           HB2      GLN   2  25.875  32.923   2.959
   15    HB3  GLN   2           HB1      GLN   2  24.699  32.237   4.080
   16    HG2  GLN   2           HG2      GLN   2  25.497  33.738   5.857
   17    HG3  GLN   2           HG1      GLN   2  26.703  34.409   4.760
   18   HE21  GLN   2          HE21      GLN   2  25.044  36.316   5.696
   19   HE22  GLN   2          HE22      GLN   2  23.854  36.743   4.565
   20    H    ILE   3           HN       ILE   3  28.267  30.856   6.361
   21    HA   ILE   3           HA       ILE   3  26.158  29.807   8.086
   22    HB   ILE   3           HB       ILE   3  28.462  28.799   7.888
   23   HG12  ILE   3          HG12      ILE   3  27.780  29.695  10.703
   24   HG13  ILE   3          HG11      ILE   3  26.890  28.437   9.846
   25   HG21  ILE   3          HG21      ILE   3  29.327  31.064   9.693
   26   HG22  ILE   3          HG22      ILE   3  29.568  31.116   7.948
   27   HG23  ILE   3          HG23      ILE   3  30.338  29.851   8.906
   28   HD11  ILE   3          HD11      ILE   3  28.563  27.340  11.194
   29   HD12  ILE   3          HD12      ILE   3  29.826  28.414  10.594
   30   HD13  ILE   3          HD13      ILE   3  29.088  27.232   9.514
   31    H    PHE   4           HN       PHE   4  25.179  30.872   9.752
   32    HA   PHE   4           HA       PHE   4  25.945  33.693  10.245
   33    HB2  PHE   4           HB2      PHE   4  23.586  32.004  11.117
   34    HB3  PHE   4           HB1      PHE   4  23.834  33.668  11.645
   35    HD1  PHE   4           HD1      PHE   4  23.205  31.492   8.714
   36    HD2  PHE   4           HD2      PHE   4  23.487  35.528  10.154
   37    HE1  PHE   4           HE1      PHE   4  22.198  32.315   6.604
   38    HE2  PHE   4           HE2      PHE   4  22.480  36.351   8.043
   39    HZ   PHE   4           HZ       PHE   4  21.835  34.744   6.268
   40    H    VAL   5           HN       VAL   5  26.314  34.464  12.433
   41    HA   VAL   5           HA       VAL   5  26.924  32.385  14.481
   42    HB   VAL   5           HB       VAL   5  28.854  34.564  13.615
   43   HG11  VAL   5          HG11      VAL   5  30.370  33.358  15.244
   44   HG12  VAL   5          HG12      VAL   5  28.954  32.462  15.796
   45   HG13  VAL   5          HG13      VAL   5  29.021  34.213  15.995
   46   HG21  VAL   5          HG21      VAL   5  30.292  32.593  13.013
   47   HG22  VAL   5          HG22      VAL   5  28.844  32.733  12.016
   48   HG23  VAL   5          HG23      VAL   5  28.907  31.544  13.317
   49    H    LYS   6           HN       LYS   6  25.543  33.041  16.082
   50    HA   LYS   6           HA       LYS   6  25.142  35.951  16.556
   51    HB2  LYS   6           HB2      LYS   6  23.773  33.509  17.726
   52    HB3  LYS   6           HB1      LYS   6  23.349  35.178  18.103
   53    HG2  LYS   6           HG2      LYS   6  22.854  35.592  15.719
   54    HG3  LYS   6           HG1      LYS   6  23.264  33.916  15.346
   55    HD2  LYS   6           HD2      LYS   6  21.460  33.131  16.825
   56    HD3  LYS   6           HD1      LYS   6  21.053  34.800  17.225
   57    HE2  LYS   6           HE2      LYS   6  19.541  33.977  15.483
   58    HE3  LYS   6           HE1      LYS   6  20.585  35.237  14.823
   59    HZ1  LYS   6           HZ1      LYS   6  20.418  33.293  13.363
   60    HZ2  LYS   6           HZ2      LYS   6  21.086  32.321  14.586
   61    HZ3  LYS   6           HZ3      LYS   6  22.010  33.561  13.884
   62    H    THR   7           HN       THR   7  26.518  36.888  17.973
   63    HA   THR   7           HA       THR   7  27.988  35.260  19.937
   64    HB   THR   7           HB       THR   7  28.019  38.267  19.572
   65    HG1  THR   7           HG1      THR   7  30.142  37.064  18.540
   66   HG21  THR   7          HG21      THR   7  29.012  37.507  21.663
   67   HG22  THR   7          HG22      THR   7  30.295  38.009  20.562
   68   HG23  THR   7          HG23      THR   7  29.961  36.294  20.803
   69    H    LEU   8           HN       LEU   8  27.877  35.653  22.231
   70    HA   LEU   8           HA       LEU   8  25.279  35.908  23.308
   71    HB2  LEU   8           HB2      LEU   8  27.293  34.938  24.484
   72    HB3  LEU   8           HB1      LEU   8  27.869  36.582  24.735
   73    HG   LEU   8           HG       LEU   8  25.657  37.075  25.887
   74   HD11  LEU   8          HD11      LEU   8  24.651  34.856  26.870
   75   HD12  LEU   8          HD12      LEU   8  25.376  34.103  25.452
   76   HD13  LEU   8          HD13      LEU   8  24.169  35.373  25.258
   77   HD21  LEU   8          HD21      LEU   8  27.585  36.801  27.259
   78   HD22  LEU   8          HD22      LEU   8  27.631  35.060  26.977
   79   HD23  LEU   8          HD23      LEU   8  26.355  35.758  27.974
   80    H    THR   9           HN       THR   9  27.720  38.358  22.629
   81    HA   THR   9           HA       THR   9  26.259  40.481  24.007
   82    HB   THR   9           HB       THR   9  27.934  41.971  22.977
   83    HG1  THR   9           HG1      THR   9  29.587  40.360  21.840
   84   HG21  THR   9          HG21      THR   9  29.996  40.767  23.866
   85   HG22  THR   9          HG22      THR   9  28.944  39.383  24.169
   86   HG23  THR   9          HG23      THR   9  28.650  40.911  24.997
   87    H    GLY  10           HN       GLY  10  25.720  38.828  21.157
   88    HA2  GLY  10           HA3      GLY  10  23.849  39.305  19.711
   89    HA3  GLY  10           HA2      GLY  10  23.956  41.007  20.160
   90    H    LYS  11           HN       LYS  11  27.018  40.638  19.747
   91    HA   LYS  11           HA       LYS  11  27.245  41.865  17.230
   92    HB2  LYS  11           HB2      LYS  11  29.219  40.031  18.625
   93    HB3  LYS  11           HB1      LYS  11  29.612  41.023  17.222
   94    HG2  LYS  11           HG2      LYS  11  28.985  43.053  18.476
   95    HG3  LYS  11           HG1      LYS  11  28.588  42.065  19.880
   96    HD2  LYS  11           HD2      LYS  11  30.919  41.261  19.981
   97    HD3  LYS  11           HD1      LYS  11  31.319  42.250  18.576
   98    HE2  LYS  11           HE2      LYS  11  30.696  44.284  19.821
   99    HE3  LYS  11           HE1      LYS  11  30.286  43.301  21.226
  100    HZ1  LYS  11           HZ1      LYS  11  32.698  44.377  20.788
  101    HZ2  LYS  11           HZ2      LYS  11  32.919  42.826  20.131
  102    HZ3  LYS  11           HZ3      LYS  11  32.430  43.005  21.749
  103    H    THR  12           HN       THR  12  26.404  41.055  15.366
  104    HA   THR  12           HA       THR  12  26.357  38.125  14.919
  105    HB   THR  12           HB       THR  12  25.227  40.409  13.273
  106    HG1  THR  12           HG1      THR  12  24.113  38.607  15.150
  107   HG21  THR  12          HG21      THR  12  25.570  38.565  11.806
  108   HG22  THR  12          HG22      THR  12  23.876  38.471  12.285
  109   HG23  THR  12          HG23      THR  12  25.064  37.401  13.031
  110    H    ILE  13           HN       ILE  13  27.547  37.101  13.340
  111    HA   ILE  13           HA       ILE  13  29.216  38.726  11.488
  112    HB   ILE  13           HB       ILE  13  30.366  36.472  13.163
  113   HG12  ILE  13          HG12      ILE  13  30.636  39.477  13.510
  114   HG13  ILE  13          HG11      ILE  13  29.822  38.376  14.619
  115   HG21  ILE  13          HG21      ILE  13  31.746  38.609  11.517
  116   HG22  ILE  13          HG22      ILE  13  31.362  37.004  10.894
  117   HG23  ILE  13          HG23      ILE  13  32.479  37.182  12.247
  118   HD11  ILE  13          HD11      ILE  13  32.034  37.122  14.799
  119   HD12  ILE  13          HD12      ILE  13  32.002  38.726  15.533
  120   HD13  ILE  13          HD13      ILE  13  32.771  38.489  13.964
  121    H    THR  14           HN       THR  14  29.390  37.729   9.485
  122    HA   THR  14           HA       THR  14  28.325  34.927   9.246
  123    HB   THR  14           HB       THR  14  26.710  36.374   8.236
  124    HG1  THR  14           HG1      THR  14  28.240  35.837   5.975
  125   HG21  THR  14          HG21      THR  14  27.355  38.117   6.600
  126   HG22  THR  14          HG22      THR  14  29.054  37.738   6.882
  127   HG23  THR  14          HG23      THR  14  28.074  38.414   8.183
  128    H    LEU  15           HN       LEU  15  29.601  33.512   8.133
  129    HA   LEU  15           HA       LEU  15  32.076  34.591   6.803
  130    HB2  LEU  15           HB2      LEU  15  31.795  31.880   8.121
  131    HB3  LEU  15           HB1      LEU  15  33.276  32.671   7.586
  132    HG   LEU  15           HG       LEU  15  31.472  33.703   9.799
  133   HD11  LEU  15          HD11      LEU  15  33.522  33.054  11.207
  134   HD12  LEU  15          HD12      LEU  15  34.020  32.077   9.825
  135   HD13  LEU  15          HD13      LEU  15  32.497  31.733  10.644
  136   HD21  LEU  15          HD21      LEU  15  33.618  35.076  10.241
  137   HD22  LEU  15          HD22      LEU  15  32.628  35.555   8.864
  138   HD23  LEU  15          HD23      LEU  15  34.098  34.616   8.608
  139    H    GLU  16           HN       GLU  16  31.856  34.315   4.624
  140    HA   GLU  16           HA       GLU  16  30.131  32.137   3.593
  141    HB2  GLU  16           HB2      GLU  16  31.597  34.423   2.246
  142    HB3  GLU  16           HB1      GLU  16  30.653  33.217   1.372
  143    HG2  GLU  16           HG2      GLU  16  28.637  33.844   2.582
  144    HG3  GLU  16           HG1      GLU  16  29.555  34.958   3.597
  145    H    VAL  17           HN       VAL  17  31.103  30.179   3.402
  146    HA   VAL  17           HA       VAL  17  33.520  29.916   1.802
  147    HB   VAL  17           HB       VAL  17  34.586  30.419   3.924
  148   HG11  VAL  17          HG11      VAL  17  32.934  28.141   5.053
  149   HG12  VAL  17          HG12      VAL  17  32.638  29.851   5.360
  150   HG13  VAL  17          HG13      VAL  17  34.124  29.097   5.936
  151   HG21  VAL  17          HG21      VAL  17  35.956  28.464   4.142
  152   HG22  VAL  17          HG22      VAL  17  35.444  28.520   2.457
  153   HG23  VAL  17          HG23      VAL  17  34.656  27.413   3.581
  154    H    GLU  18           HN       GLU  18  33.857  27.709   1.159
  155    HA   GLU  18           HA       GLU  18  31.655  26.139   0.653
  156    HB2  GLU  18           HB2      GLU  18  34.494  25.260   1.210
  157    HB3  GLU  18           HB1      GLU  18  33.257  24.179   0.568
  158    HG2  GLU  18           HG2      GLU  18  34.464  25.044  -1.321
  159    HG3  GLU  18           HG1      GLU  18  32.904  25.868  -1.298
  160    HA   PRO  19           HA       PRO  19  30.215  25.080   4.852
  161    HB2  PRO  19           HB2      PRO  19  29.150  22.756   3.258
  162    HB3  PRO  19           HB1      PRO  19  28.348  23.714   4.522
  163    HG2  PRO  19           HG2      PRO  19  27.824  24.148   1.957
  164    HG3  PRO  19           HG1      PRO  19  27.945  25.496   3.105
  165    HD2  PRO  19           HD2      PRO  19  29.860  24.676   0.967
  166    HD3  PRO  19           HD1      PRO  19  29.580  26.283   1.677
  167    H    SER  20           HN       SER  20  32.054  22.975   2.723
  168    HA   SER  20           HA       SER  20  32.547  20.945   4.751
  169    HB2  SER  20           HB2      SER  20  34.264  21.455   2.317
  170    HB3  SER  20           HB1      SER  20  33.993  19.933   3.167
  171    HG   SER  20           HG       SER  20  31.731  20.215   2.529
  172    H    ASP  21           HN       ASP  21  33.320  24.014   4.950
  173    HA   ASP  21           HA       ASP  21  36.124  24.227   5.204
  174    HB2  ASP  21           HB2      ASP  21  34.281  26.053   5.460
  175    HB3  ASP  21           HB1      ASP  21  34.238  25.561   7.150
  176    H    THR  22           HN       THR  22  37.375  24.288   7.290
  177    HA   THR  22           HA       THR  22  36.598  21.964   9.005
  178    HB   THR  22           HB       THR  22  38.958  21.983   9.715
  179    HG1  THR  22           HG1      THR  22  39.989  23.777   9.499
  180   HG21  THR  22          HG21      THR  22  38.769  22.230   6.703
  181   HG22  THR  22          HG22      THR  22  38.226  20.814   7.602
  182   HG23  THR  22          HG23      THR  22  39.928  21.272   7.624
  183    H    ILE  23           HN       ILE  23  36.338  22.211  11.224
  184    HA   ILE  23           HA       ILE  23  35.346  24.580  12.284
  185    HB   ILE  23           HB       ILE  23  36.825  22.347  13.684
  186   HG12  ILE  23          HG12      ILE  23  33.867  22.991  13.528
  187   HG13  ILE  23          HG11      ILE  23  34.674  21.896  12.408
  188   HG21  ILE  23          HG21      ILE  23  35.283  24.714  14.776
  189   HG22  ILE  23          HG22      ILE  23  36.923  24.213  15.185
  190   HG23  ILE  23          HG23      ILE  23  35.546  23.242  15.711
  191   HD11  ILE  23          HD11      ILE  23  33.521  20.948  14.567
  192   HD12  ILE  23          HD12      ILE  23  35.003  21.472  15.361
  193   HD13  ILE  23          HD13      ILE  23  35.071  20.302  14.044
  194    H    GLU  24           HN       GLU  24  38.710  23.507  12.198
  195    HA   GLU  24           HA       GLU  24  39.904  25.478  13.809
  196    HB2  GLU  24           HB2      GLU  24  41.106  24.492  11.219
  197    HB3  GLU  24           HB1      GLU  24  41.946  24.956  12.697
  198    HG2  GLU  24           HG2      GLU  24  40.151  22.536  12.320
  199    HG3  GLU  24           HG1      GLU  24  41.901  22.528  12.558
  200    H    ASN  25           HN       ASN  25  38.822  25.634  10.450
  201    HA   ASN  25           HA       ASN  25  39.955  28.200   9.847
  202    HB2  ASN  25           HB2      ASN  25  39.111  26.692   8.089
  203    HB3  ASN  25           HB1      ASN  25  37.474  26.861   8.723
  204   HD21  ASN  25          HD21      ASN  25  39.918  28.379   6.744
  205   HD22  ASN  25          HD22      ASN  25  39.014  29.759   6.336
  206    H    VAL  26           HN       VAL  26  36.881  27.168  11.259
  207    HA   VAL  26           HA       VAL  26  35.693  29.790  11.352
  208    HB   VAL  26           HB       VAL  26  35.171  27.490  13.252
  209   HG11  VAL  26          HG11      VAL  26  33.463  29.754  12.185
  210   HG12  VAL  26          HG12      VAL  26  34.079  29.598  13.829
  211   HG13  VAL  26          HG13      VAL  26  32.879  28.455  13.225
  212   HG21  VAL  26          HG21      VAL  26  33.405  26.862  11.536
  213   HG22  VAL  26          HG22      VAL  26  35.070  26.552  11.040
  214   HG23  VAL  26          HG23      VAL  26  34.212  27.961  10.417
  215    H    LYS  27           HN       LYS  27  36.981  27.823  14.053
  216    HA   LYS  27           HA       LYS  27  37.082  29.698  16.064
  217    HB2  LYS  27           HB2      LYS  27  39.153  27.613  15.317
  218    HB3  LYS  27           HB1      LYS  27  39.170  28.498  16.844
  219    HG2  LYS  27           HG2      LYS  27  36.793  27.686  17.216
  220    HG3  LYS  27           HG1      LYS  27  37.019  26.631  15.823
  221    HD2  LYS  27           HD2      LYS  27  38.886  25.511  16.904
  222    HD3  LYS  27           HD1      LYS  27  38.820  26.636  18.261
  223    HE2  LYS  27           HE2      LYS  27  36.529  25.845  18.787
  224    HE3  LYS  27           HE1      LYS  27  36.638  24.687  17.461
  225    HZ1  LYS  27           HZ1      LYS  27  37.677  23.295  18.808
  226    HZ2  LYS  27           HZ2      LYS  27  37.575  24.412  20.084
  227    HZ3  LYS  27           HZ3      LYS  27  38.924  24.420  19.051
  228    H    ALA  28           HN       ALA  28  39.243  29.486  13.288
  229    HA   ALA  28           HA       ALA  28  41.144  31.444  14.228
  230    HB1  ALA  28           HB1      ALA  28  40.464  30.336  11.502
  231    HB2  ALA  28           HB2      ALA  28  41.893  30.018  12.485
  232    HB3  ALA  28           HB3      ALA  28  41.687  31.590  11.713
  233    H    LYS  29           HN       LYS  29  38.574  31.724  11.737
  234    HA   LYS  29           HA       LYS  29  38.767  34.502  11.344
  235    HB2  LYS  29           HB2      LYS  29  36.425  32.611  11.171
  236    HB3  LYS  29           HB1      LYS  29  36.272  34.319  10.756
  237    HG2  LYS  29           HG2      LYS  29  37.737  34.151   8.930
  238    HG3  LYS  29           HG1      LYS  29  38.500  32.686   9.543
  239    HD2  LYS  29           HD2      LYS  29  36.375  31.457   9.150
  240    HD3  LYS  29           HD1      LYS  29  35.695  32.914   8.424
  241    HE2  LYS  29           HE2      LYS  29  38.236  31.584   7.449
  242    HE3  LYS  29           HE1      LYS  29  36.644  31.280   6.752
  243    HZ1  LYS  29           HZ1      LYS  29  36.443  33.619   6.240
  244    HZ2  LYS  29           HZ2      LYS  29  37.857  32.992   5.539
  245    HZ3  LYS  29           HZ3      LYS  29  37.952  33.939   6.946
  246    H    ILE  30           HN       ILE  30  37.264  32.730  13.950
  247    HA   ILE  30           HA       ILE  30  35.912  35.095  15.053
  248    HB   ILE  30           HB       ILE  30  36.306  32.235  15.929
  249   HG12  ILE  30          HG12      ILE  30  33.891  32.212  15.951
  250   HG13  ILE  30          HG11      ILE  30  33.816  33.968  15.829
  251   HG21  ILE  30          HG21      ILE  30  35.489  34.565  17.683
  252   HG22  ILE  30          HG22      ILE  30  36.718  33.343  18.013
  253   HG23  ILE  30          HG23      ILE  30  35.007  32.908  18.049
  254   HD11  ILE  30          HD11      ILE  30  34.506  33.962  13.575
  255   HD12  ILE  30          HD12      ILE  30  33.431  32.570  13.671
  256   HD13  ILE  30          HD13      ILE  30  35.176  32.338  13.689
  257    H    GLN  31           HN       GLN  31  38.469  33.007  16.388
  258    HA   GLN  31           HA       GLN  31  39.463  34.531  18.425
  259    HB2  GLN  31           HB2      GLN  31  40.437  32.391  17.869
  260    HB3  GLN  31           HB1      GLN  31  41.023  33.002  16.328
  261    HG2  GLN  31           HG2      GLN  31  42.598  34.436  17.387
  262    HG3  GLN  31           HG1      GLN  31  41.881  34.182  18.975
  263   HE21  GLN  31          HE21      GLN  31  42.564  31.659  16.525
  264   HE22  GLN  31          HE22      GLN  31  43.687  30.813  17.476
  265    H    ASP  32           HN       ASP  32  40.366  34.968  15.006
  266    HA   ASP  32           HA       ASP  32  42.084  37.241  15.540
  267    HB2  ASP  32           HB2      ASP  32  40.793  36.215  13.002
  268    HB3  ASP  32           HB1      ASP  32  41.889  37.597  13.035
  269    H    LYS  33           HN       LYS  33  38.854  37.061  14.032
  270    HA   LYS  33           HA       LYS  33  38.446  39.849  13.818
  271    HB2  LYS  33           HB2      LYS  33  36.485  37.605  14.163
  272    HB3  LYS  33           HB1      LYS  33  35.984  39.263  13.854
  273    HG2  LYS  33           HG2      LYS  33  37.251  39.303  11.777
  274    HG3  LYS  33           HG1      LYS  33  37.890  37.694  12.095
  275    HD2  LYS  33           HD2      LYS  33  35.623  36.757  12.004
  276    HD3  LYS  33           HD1      LYS  33  34.959  38.365  11.715
  277    HE2  LYS  33           HE2      LYS  33  36.270  38.533   9.628
  278    HE3  LYS  33           HE1      LYS  33  36.926  36.920   9.913
  279    HZ1  LYS  33           HZ1      LYS  33  34.519  37.606   8.678
  280    HZ2  LYS  33           HZ2      LYS  33  34.132  36.812  10.130
  281    HZ3  LYS  33           HZ3      LYS  33  35.132  36.054   8.984
  282    H    GLU  34           HN       GLU  34  37.722  37.711  16.581
  283    HA   GLU  34           HA       GLU  34  36.749  40.053  18.126
  284    HB2  GLU  34           HB2      GLU  34  37.073  37.246  19.198
  285    HB3  GLU  34           HB1      GLU  34  35.959  38.507  19.722
  286    HG2  GLU  34           HG2      GLU  34  35.862  37.025  17.080
  287    HG3  GLU  34           HG1      GLU  34  34.737  36.837  18.426
  288    H    GLY  35           HN       GLY  35  39.585  38.090  17.733
  289    HA2  GLY  35           HA3      GLY  35  41.745  38.365  18.653
  290    HA3  GLY  35           HA2      GLY  35  41.181  39.887  19.344
  291    H    ILE  36           HN       ILE  36  39.279  37.127  20.047
  292    HA   ILE  36           HA       ILE  36  40.175  37.200  22.870
  293    HB   ILE  36           HB       ILE  36  37.734  35.911  21.661
  294   HG12  ILE  36          HG12      ILE  36  38.122  38.663  22.888
  295   HG13  ILE  36          HG11      ILE  36  37.777  38.331  21.193
  296   HG21  ILE  36          HG21      ILE  36  38.379  36.817  24.477
  297   HG22  ILE  36          HG22      ILE  36  38.497  35.151  23.919
  298   HG23  ILE  36          HG23      ILE  36  36.931  35.956  23.958
  299   HD11  ILE  36          HD11      ILE  36  35.672  37.189  21.909
  300   HD12  ILE  36          HD12      ILE  36  35.703  38.915  22.271
  301   HD13  ILE  36          HD13      ILE  36  35.993  37.740  23.552
  302    HA   PRO  37           HA       PRO  37  42.460  33.378  21.663
  303    HB2  PRO  37           HB2      PRO  37  42.580  33.300  24.668
  304    HB3  PRO  37           HB1      PRO  37  43.859  32.961  23.481
  305    HG2  PRO  37           HG2      PRO  37  43.804  35.274  24.764
  306    HG3  PRO  37           HG1      PRO  37  44.226  35.207  23.042
  307    HD2  PRO  37           HD2      PRO  37  41.689  36.153  24.322
  308    HD3  PRO  37           HD1      PRO  37  42.473  36.710  22.826
  309    HA   PRO  38           HA       PRO  38  38.734  30.749  21.908
  310    HB2  PRO  38           HB2      PRO  38  40.958  28.751  21.694
  311    HB3  PRO  38           HB1      PRO  38  39.350  28.719  20.934
  312    HG2  PRO  38           HG2      PRO  38  41.403  29.532  19.545
  313    HG3  PRO  38           HG1      PRO  38  39.884  30.426  19.446
  314    HD2  PRO  38           HD2      PRO  38  42.431  31.191  20.822
  315    HD3  PRO  38           HD1      PRO  38  41.191  32.231  20.082
  316    H    ASP  39           HN       ASP  39  41.586  30.369  23.930
  317    HA   ASP  39           HA       ASP  39  40.643  28.412  25.743
  318    HB2  ASP  39           HB2      ASP  39  42.475  30.785  26.153
  319    HB3  ASP  39           HB1      ASP  39  42.175  29.581  27.406
  320    H    GLN  40           HN       GLN  40  39.826  31.791  25.424
  321    HA   GLN  40           HA       GLN  40  38.284  31.749  27.965
  322    HB2  GLN  40           HB2      GLN  40  38.828  33.997  26.003
  323    HB3  GLN  40           HB1      GLN  40  38.040  34.159  27.568
  324    HG2  GLN  40           HG2      GLN  40  40.146  33.147  28.590
  325    HG3  GLN  40           HG1      GLN  40  40.903  33.373  27.016
  326   HE21  GLN  40          HE21      GLN  40  42.162  35.238  27.097
  327   HE22  GLN  40          HE22      GLN  40  41.694  36.700  27.822
  328    H    GLN  41           HN       GLN  41  37.739  30.723  24.923
  329    HA   GLN  41           HA       GLN  41  34.819  31.315  25.121
  330    HB2  GLN  41           HB2      GLN  41  36.491  31.750  22.629
  331    HB3  GLN  41           HB1      GLN  41  34.730  31.834  22.698
  332    HG2  GLN  41           HG2      GLN  41  35.012  33.596  24.517
  333    HG3  GLN  41           HG1      GLN  41  36.722  33.633  24.087
  334   HE21  GLN  41          HE21      GLN  41  36.719  33.494  21.332
  335   HE22  GLN  41          HE22      GLN  41  35.857  34.794  20.665
  336    H    ARG  42           HN       ARG  42  33.502  29.710  24.296
  337    HA   ARG  42           HA       ARG  42  34.794  27.348  22.991
  338    HB2  ARG  42           HB2      ARG  42  32.870  27.333  25.347
  339    HB3  ARG  42           HB1      ARG  42  33.238  25.905  24.385
  340    HG2  ARG  42           HG2      ARG  42  35.488  27.508  25.598
  341    HG3  ARG  42           HG1      ARG  42  34.597  26.362  26.597
  342    HD2  ARG  42           HD2      ARG  42  35.084  24.581  24.894
  343    HD3  ARG  42           HD1      ARG  42  36.098  25.739  24.034
  344    HE   ARG  42           HE       ARG  42  36.955  25.649  26.747
  345   HH11  ARG  42          HH11      ARG  42  38.785  24.429  27.267
  346   HH12  ARG  42          HH12      ARG  42  39.315  23.183  26.188
  347   HH21  ARG  42          HH21      ARG  42  36.775  23.728  23.890
  348   HH22  ARG  42          HH22      ARG  42  38.176  22.785  24.276
  349    H    LEU  43           HN       LEU  43  33.523  26.528  21.320
  350    HA   LEU  43           HA       LEU  43  31.223  28.198  20.582
  351    HB2  LEU  43           HB2      LEU  43  32.628  25.887  19.202
  352    HB3  LEU  43           HB1      LEU  43  31.280  26.801  18.503
  353    HG   LEU  43           HG       LEU  43  32.644  28.897  18.813
  354   HD11  LEU  43          HD11      LEU  43  35.219  28.288  18.877
  355   HD12  LEU  43          HD12      LEU  43  34.650  26.865  19.748
  356   HD13  LEU  43          HD13      LEU  43  34.314  28.478  20.376
  357   HD21  LEU  43          HD21      LEU  43  34.028  28.472  16.842
  358   HD22  LEU  43          HD22      LEU  43  32.455  27.694  16.667
  359   HD23  LEU  43          HD23      LEU  43  33.872  26.735  17.095
  360    H    ILE  44           HN       ILE  44  29.125  27.529  20.591
  361    HA   ILE  44           HA       ILE  44  28.510  24.744  21.547
  362    HB   ILE  44           HB       ILE  44  26.978  27.310  22.102
  363   HG12  ILE  44          HG12      ILE  44  29.048  27.280  23.387
  364   HG13  ILE  44          HG11      ILE  44  27.702  26.932  24.465
  365   HG21  ILE  44          HG21      ILE  44  26.580  24.443  23.039
  366   HG22  ILE  44          HG22      ILE  44  25.503  25.355  21.984
  367   HG23  ILE  44          HG23      ILE  44  25.691  25.826  23.675
  368   HD11  ILE  44          HD11      ILE  44  29.212  25.283  25.103
  369   HD12  ILE  44          HD12      ILE  44  29.858  25.097  23.476
  370   HD13  ILE  44          HD13      ILE  44  28.290  24.410  23.882
  371    H    PHE  45           HN       PHE  45  27.104  23.618  20.187
  372    HA   PHE  45           HA       PHE  45  25.324  25.138  18.392
  373    HB2  PHE  45           HB2      PHE  45  27.268  25.035  17.000
  374    HB3  PHE  45           HB1      PHE  45  27.595  23.366  17.458
  375    HD1  PHE  45           HD1      PHE  45  25.318  25.575  15.540
  376    HD2  PHE  45           HD2      PHE  45  26.463  21.535  16.416
  377    HE1  PHE  45           HE1      PHE  45  23.944  24.776  13.635
  378    HE2  PHE  45           HE2      PHE  45  25.088  20.730  14.513
  379    HZ   PHE  45           HZ       PHE  45  23.829  22.352  13.122
  380    H    ALA  46           HN       ALA  46  23.489  24.151  19.167
  381    HA   ALA  46           HA       ALA  46  21.874  22.474  19.360
  382    HB1  ALA  46           HB1      ALA  46  23.711  20.454  18.101
  383    HB2  ALA  46           HB2      ALA  46  23.089  21.780  17.122
  384    HB3  ALA  46           HB3      ALA  46  21.971  20.663  17.901
  385    H    GLY  47           HN       GLY  47  24.152  22.829  21.367
  386    HA2  GLY  47           HA3      GLY  47  24.349  21.829  23.515
  387    HA3  GLY  47           HA2      GLY  47  23.501  20.408  22.914
  388    H    LYS  48           HN       LYS  48  25.931  21.276  20.752
  389    HA   LYS  48           HA       LYS  48  27.910  19.417  22.034
  390    HB2  LYS  48           HB2      LYS  48  27.136  19.587  19.131
  391    HB3  LYS  48           HB1      LYS  48  28.433  18.584  19.768
  392    HG2  LYS  48           HG2      LYS  48  26.792  17.391  21.189
  393    HG3  LYS  48           HG1      LYS  48  25.498  18.376  20.506
  394    HD2  LYS  48           HD2      LYS  48  26.026  17.512  18.254
  395    HD3  LYS  48           HD1      LYS  48  27.314  16.520  18.938
  396    HE2  LYS  48           HE2      LYS  48  25.666  15.326  20.328
  397    HE3  LYS  48           HE1      LYS  48  24.375  16.319  19.652
  398    HZ1  LYS  48           HZ1      LYS  48  25.301  13.958  18.636
  399    HZ2  LYS  48           HZ2      LYS  48  25.993  15.134  17.623
  400    HZ3  LYS  48           HZ3      LYS  48  24.309  15.074  17.831
  401    H    GLN  49           HN       GLN  49  30.141  19.956  21.655
  402    HA   GLN  49           HA       GLN  49  30.572  22.758  20.868
  403    HB2  GLN  49           HB2      GLN  49  31.509  21.602  23.005
  404    HB3  GLN  49           HB1      GLN  49  32.662  20.842  21.910
  405    HG2  GLN  49           HG2      GLN  49  33.113  23.266  21.064
  406    HG3  GLN  49           HG1      GLN  49  32.317  23.770  22.552
  407   HE21  GLN  49          HE21      GLN  49  33.230  22.427  24.583
  408   HE22  GLN  49          HE22      GLN  49  34.922  22.302  24.643
  409    H    LEU  50           HN       LEU  50  32.480  23.192  19.384
  410    HA   LEU  50           HA       LEU  50  32.560  21.151  17.212
  411    HB2  LEU  50           HB2      LEU  50  33.682  23.960  17.131
  412    HB3  LEU  50           HB1      LEU  50  33.224  22.932  15.777
  413    HG   LEU  50           HG       LEU  50  31.366  24.216  17.792
  414   HD11  LEU  50          HD11      LEU  50  32.330  25.532  15.795
  415   HD12  LEU  50          HD12      LEU  50  30.576  25.512  15.967
  416   HD13  LEU  50          HD13      LEU  50  31.358  24.469  14.781
  417   HD21  LEU  50          HD21      LEU  50  30.416  22.073  17.378
  418   HD22  LEU  50          HD22      LEU  50  30.894  22.100  15.680
  419   HD23  LEU  50          HD23      LEU  50  29.594  23.148  16.247
  420    H    GLU  51           HN       GLU  51  34.206  19.704  17.600
  421    HA   GLU  51           HA       GLU  51  36.726  20.647  18.848
  422    HB2  GLU  51           HB2      GLU  51  35.875  17.857  18.016
  423    HB3  GLU  51           HB1      GLU  51  37.285  18.268  18.996
  424    HG2  GLU  51           HG2      GLU  51  34.440  18.965  19.776
  425    HG3  GLU  51           HG1      GLU  51  35.280  17.518  20.336
  426    H    ASP  52           HN       ASP  52  38.778  20.307  17.846
  427    HA   ASP  52           HA       ASP  52  38.833  20.841  15.011
  428    HB2  ASP  52           HB2      ASP  52  41.290  20.668  15.273
  429    HB3  ASP  52           HB1      ASP  52  40.578  21.676  16.535
  430    H    GLY  53           HN       GLY  53  39.831  19.473  13.370
  431    HA2  GLY  53           HA3      GLY  53  40.517  17.382  12.445
  432    HA3  GLY  53           HA2      GLY  53  40.170  16.606  13.990
  433    H    ARG  54           HN       ARG  54  37.807  18.727  12.555
  434    HA   ARG  54           HA       ARG  54  36.311  16.470  11.356
  435    HB2  ARG  54           HB2      ARG  54  35.384  18.011  13.783
  436    HB3  ARG  54           HB1      ARG  54  34.250  17.185  12.716
  437    HG2  ARG  54           HG2      ARG  54  35.543  15.068  13.069
  438    HG3  ARG  54           HG1      ARG  54  36.548  15.923  14.240
  439    HD2  ARG  54           HD2      ARG  54  34.584  16.406  15.617
  440    HD3  ARG  54           HD1      ARG  54  33.539  15.618  14.433
  441    HE   ARG  54           HE       ARG  54  35.264  14.267  16.377
  442   HH11  ARG  54          HH11      ARG  54  35.100  12.012  16.389
  443   HH12  ARG  54          HH12      ARG  54  34.302  11.209  15.079
  444   HH21  ARG  54          HH21      ARG  54  33.568  14.141  13.380
  445   HH22  ARG  54          HH22      ARG  54  33.434  12.414  13.374
  446    H    THR  55           HN       THR  55  34.669  17.156   9.920
  447    HA   THR  55           HA       THR  55  34.790  20.054   9.164
  448    HB   THR  55           HB       THR  55  34.142  17.578   7.530
  449    HG1  THR  55           HG1      THR  55  36.254  19.453   7.318
  450   HG21  THR  55          HG21      THR  55  34.325  19.381   5.641
  451   HG22  THR  55          HG22      THR  55  33.928  20.517   6.927
  452   HG23  THR  55          HG23      THR  55  32.812  19.215   6.525
  453    H    LEU  56           HN       LEU  56  32.645  20.827   8.158
  454    HA   LEU  56           HA       LEU  56  30.512  20.370  10.043
  455    HB2  LEU  56           HB2      LEU  56  30.213  21.626   7.307
  456    HB3  LEU  56           HB1      LEU  56  29.254  21.941   8.752
  457    HG   LEU  56           HG       LEU  56  32.165  22.661   8.302
  458   HD11  LEU  56          HD11      LEU  56  30.217  24.103   7.377
  459   HD12  LEU  56          HD12      LEU  56  31.452  24.911   8.341
  460   HD13  LEU  56          HD13      LEU  56  29.896  24.501   9.064
  461   HD21  LEU  56          HD21      LEU  56  32.091  22.006  10.578
  462   HD22  LEU  56          HD22      LEU  56  30.465  22.652  10.801
  463   HD23  LEU  56          HD23      LEU  56  31.836  23.749  10.633
  464    H    SER  57           HN       SER  57  31.068  19.294   6.698
  465    HA   SER  57           HA       SER  57  28.572  17.906   6.397
  466    HB2  SER  57           HB2      SER  57  30.068  18.358   4.478
  467    HB3  SER  57           HB1      SER  57  31.280  17.280   5.166
  468    HG   SER  57           HG       SER  57  29.937  16.264   3.585
  469    H    ASP  58           HN       ASP  58  31.798  16.787   7.363
  470    HA   ASP  58           HA       ASP  58  31.272  14.108   7.927
  471    HB2  ASP  58           HB2      ASP  58  33.020  16.082   9.418
  472    HB3  ASP  58           HB1      ASP  58  33.005  14.355   9.780
  473    H    TYR  59           HN       TYR  59  30.438  16.941   9.904
  474    HA   TYR  59           HA       TYR  59  29.483  15.346  12.142
  475    HB2  TYR  59           HB2      TYR  59  29.524  18.231  11.384
  476    HB3  TYR  59           HB1      TYR  59  28.201  17.761  12.447
  477    HD1  TYR  59           HD1      TYR  59  31.648  18.677  12.303
  478    HD2  TYR  59           HD2      TYR  59  28.832  16.320  14.530
  479    HE1  TYR  59           HE1      TYR  59  33.185  18.676  14.247
  480    HE2  TYR  59           HE2      TYR  59  30.369  16.320  16.474
  481    HH   TYR  59           HH       TYR  59  32.444  16.811  17.175
  482    H    ASN  60           HN       ASN  60  28.206  16.198   9.066
  483    HA   ASN  60           HA       ASN  60  26.070  15.907   8.125
  484    HB2  ASN  60           HB2      ASN  60  25.963  13.759  10.266
  485    HB3  ASN  60           HB1      ASN  60  24.921  13.848   8.846
  486   HD21  ASN  60          HD21      ASN  60  27.295  11.969   9.801
  487   HD22  ASN  60          HD22      ASN  60  28.219  11.811   8.384
  488    H    ILE  61           HN       ILE  61  25.799  18.096   9.471
  489    HA   ILE  61           HA       ILE  61  24.208  18.116  11.831
  490    HB   ILE  61           HB       ILE  61  23.551  20.441  11.046
  491   HG12  ILE  61          HG12      ILE  61  25.500  19.912   8.791
  492   HG13  ILE  61          HG11      ILE  61  23.762  19.716   8.574
  493   HG21  ILE  61          HG21      ILE  61  26.513  19.819  10.864
  494   HG22  ILE  61          HG22      ILE  61  25.619  19.905  12.383
  495   HG23  ILE  61          HG23      ILE  61  25.776  21.340  11.370
  496   HD11  ILE  61          HD11      ILE  61  23.333  22.005   9.015
  497   HD12  ILE  61          HD12      ILE  61  24.749  22.009   7.963
  498   HD13  ILE  61          HD13      ILE  61  24.939  22.258   9.698
  499    H    GLN  62           HN       GLN  62  21.955  18.238  12.123
  500    HA   GLN  62           HA       GLN  62  20.313  17.312   9.789
  501    HB2  GLN  62           HB2      GLN  62  18.706  16.554  11.542
  502    HB3  GLN  62           HB1      GLN  62  20.285  15.780  11.688
  503    HG2  GLN  62           HG2      GLN  62  20.918  17.482  13.402
  504    HG3  GLN  62           HG1      GLN  62  19.285  18.143  13.306
  505   HE21  GLN  62          HE21      GLN  62  17.928  17.329  14.899
  506   HE22  GLN  62          HE22      GLN  62  18.051  15.786  15.596
  507    H    LYS  63           HN       LYS  63  20.930  20.055   9.920
  508    HA   LYS  63           HA       LYS  63  18.457  21.341  11.009
  509    HB2  LYS  63           HB2      LYS  63  21.006  22.605   9.951
  510    HB3  LYS  63           HB1      LYS  63  19.667  23.455  10.720
  511    HG2  LYS  63           HG2      LYS  63  21.096  21.212  12.155
  512    HG3  LYS  63           HG1      LYS  63  21.745  22.849  12.170
  513    HD2  LYS  63           HD2      LYS  63  19.522  23.657  13.033
  514    HD3  LYS  63           HD1      LYS  63  19.020  21.972  13.169
  515    HE2  LYS  63           HE2      LYS  63  19.863  22.755  15.326
  516    HE3  LYS  63           HE1      LYS  63  20.959  21.541  14.665
  517    HZ1  LYS  63           HZ1      LYS  63  22.123  23.500  15.534
  518    HZ2  LYS  63           HZ2      LYS  63  21.322  24.476  14.398
  519    HZ3  LYS  63           HZ3      LYS  63  22.402  23.272  13.878
  520    H    GLU  64           HN       GLU  64  19.539  19.971   8.203
  521    HA   GLU  64           HA       GLU  64  18.795  20.087   5.986
  522    HB2  GLU  64           HB2      GLU  64  16.557  20.323   7.280
  523    HB3  GLU  64           HB1      GLU  64  16.670  22.039   6.888
  524    HG2  GLU  64           HG2      GLU  64  16.794  21.516   4.498
  525    HG3  GLU  64           HG1      GLU  64  16.756  19.789   4.857
  526    H    SEP  65           HN       SEP  65  18.027  23.383   7.166
  527    HA   SEP  65           HA       SEP  65  20.238  24.467   5.506
  528    HB2  SEP  65           HB1      SEP  65  17.393  25.480   5.242
  529    HB3  SEP  65           HB2      SEP  65  18.144  24.380   4.089
  530    H    TPO  66           HN       TPO  66  19.768  27.135   5.767
  531    HA   TPO  66           HA       TPO  66  20.081  28.868   7.325
  532    HB   TPO  66           HB       TPO  66  18.002  27.300   8.882
  533   HG21  TPO  66          HG21      TPO  66  17.421  29.524   9.785
  534   HG22  TPO  66          HG22      TPO  66  18.742  30.238   8.859
  535   HG23  TPO  66          HG23      TPO  66  19.092  29.098  10.159
  536    H    LEU  67           HN       LEU  67  22.266  28.057   7.805
  537    HA   LEU  67           HA       LEU  67  22.573  26.366  10.213
  538    HB2  LEU  67           HB2      LEU  67  24.756  27.715   8.609
  539    HB3  LEU  67           HB1      LEU  67  24.903  26.312   9.669
  540    HG   LEU  67           HG       LEU  67  23.323  26.412   7.081
  541   HD11  LEU  67          HD11      LEU  67  25.677  26.371   6.588
  542   HD12  LEU  67          HD12      LEU  67  25.083  24.722   6.383
  543   HD13  LEU  67          HD13      LEU  67  25.977  25.163   7.838
  544   HD21  LEU  67          HD21      LEU  67  23.713  24.301   9.210
  545   HD22  LEU  67          HD22      LEU  67  23.329  23.852   7.548
  546   HD23  LEU  67          HD23      LEU  67  22.209  24.852   8.471
  547    H    HIS  68           HN       HIS  68  22.525  27.323  12.174
  548    HA   HIS  68           HA       HIS  68  23.671  30.088  12.471
  549    HB2  HIS  68           HB2      HIS  68  21.262  28.878  13.863
  550    HB3  HIS  68           HB1      HIS  68  21.975  30.443  14.258
  551    HD1  HIS  68           HD1      HIS  68  22.499  30.532  10.867
  552    HD2  HIS  68           HD2      HIS  68  18.969  30.656  13.087
  553    HE1  HIS  68           HE1      HIS  68  20.748  31.596   9.374
  554    HE2  HIS  68           HE2      HIS  68  18.597  31.676  10.716
  555    H    LEU  69           HN       LEU  69  25.247  30.235  13.982
  556    HA   LEU  69           HA       LEU  69  25.577  27.990  15.956
  557    HB2  LEU  69           HB2      LEU  69  27.537  29.496  14.244
  558    HB3  LEU  69           HB1      LEU  69  28.071  29.002  15.848
  559    HG   LEU  69           HG       LEU  69  27.387  26.657  15.305
  560   HD11  LEU  69          HD11      LEU  69  27.163  26.263  12.739
  561   HD12  LEU  69          HD12      LEU  69  26.721  27.969  12.669
  562   HD13  LEU  69          HD13      LEU  69  25.752  26.843  13.618
  563   HD21  LEU  69          HD21      LEU  69  29.719  27.471  15.001
  564   HD22  LEU  69          HD22      LEU  69  29.331  27.904  13.337
  565   HD23  LEU  69          HD23      LEU  69  29.301  26.214  13.838
  566    H    VAL  70           HN       VAL  70  26.606  28.758  18.046
  567    HA   VAL  70           HA       VAL  70  26.178  31.673  18.575
  568    HB   VAL  70           HB       VAL  70  25.146  29.432  20.342
  569   HG11  VAL  70          HG11      VAL  70  24.996  32.454  20.477
  570   HG12  VAL  70          HG12      VAL  70  25.732  31.364  21.651
  571   HG13  VAL  70          HG13      VAL  70  23.980  31.391  21.452
  572   HG21  VAL  70          HG21      VAL  70  23.778  31.248  18.345
  573   HG22  VAL  70          HG22      VAL  70  22.895  30.464  19.655
  574   HG23  VAL  70          HG23      VAL  70  23.714  29.488  18.436
  575    H    LEU  71           HN       LEU  71  28.046  32.443  19.465
  576    HA   LEU  71           HA       LEU  71  30.028  30.596  20.551
  577    HB2  LEU  71           HB2      LEU  71  30.147  33.614  20.685
  578    HB3  LEU  71           HB1      LEU  71  31.483  32.465  20.631
  579    HG   LEU  71           HG       LEU  71  29.594  33.223  18.392
  580   HD11  LEU  71          HD11      LEU  71  31.762  33.718  17.264
  581   HD12  LEU  71          HD12      LEU  71  32.602  33.280  18.753
  582   HD13  LEU  71          HD13      LEU  71  31.526  34.678  18.724
  583   HD21  LEU  71          HD21      LEU  71  31.493  30.883  18.640
  584   HD22  LEU  71          HD22      LEU  71  30.977  31.511  17.076
  585   HD23  LEU  71          HD23      LEU  71  29.788  30.844  18.195
  586    H    ARG  72           HN       ARG  72  30.832  30.674  22.750
  587    HA   ARG  72           HA       ARG  72  28.939  31.922  24.717
  588    HB2  ARG  72           HB2      ARG  72  28.963  29.336  24.514
  589    HB3  ARG  72           HB1      ARG  72  30.572  29.424  25.224
  590    HG2  ARG  72           HG2      ARG  72  29.644  30.664  27.157
  591    HG3  ARG  72           HG1      ARG  72  28.032  30.537  26.453
  592    HD2  ARG  72           HD2      ARG  72  28.332  28.022  26.462
  593    HD3  ARG  72           HD1      ARG  72  29.801  28.272  27.406
  594    HE   ARG  72           HE       ARG  72  27.054  28.582  28.379
  595   HH11  ARG  72          HH11      ARG  72  26.873  29.057  30.581
  596   HH12  ARG  72          HH12      ARG  72  28.277  29.557  31.464
  597   HH21  ARG  72          HH21      ARG  72  30.395  29.362  28.725
  598   HH22  ARG  72          HH22      ARG  72  30.271  29.730  30.413
  599    H    LEU  73           HN       LEU  73  30.017  32.736  26.663
  600    HA   LEU  73           HA       LEU  73  32.875  33.441  26.163
  601    HB2  LEU  73           HB2      LEU  73  31.041  34.575  28.286
  602    HB3  LEU  73           HB1      LEU  73  32.538  35.269  27.661
  603    HG   LEU  73           HG       LEU  73  29.974  34.883  26.088
  604   HD11  LEU  73          HD11      LEU  73  29.887  37.342  26.109
  605   HD12  LEU  73          HD12      LEU  73  31.356  37.395  27.082
  606   HD13  LEU  73          HD13      LEU  73  29.877  36.710  27.754
  607   HD21  LEU  73          HD21      LEU  73  31.751  34.673  24.529
  608   HD22  LEU  73          HD22      LEU  73  32.732  35.885  25.354
  609   HD23  LEU  73          HD23      LEU  73  31.306  36.376  24.440
  610    H    ARG  74           HN       ARG  74  34.273  33.477  28.165
  611    HA   ARG  74           HA       ARG  74  34.337  30.908  29.402
  612    HB2  ARG  74           HB2      ARG  74  36.003  31.990  30.963
  613    HB3  ARG  74           HB1      ARG  74  36.367  32.214  29.252
  614    HG2  ARG  74           HG2      ARG  74  35.413  34.447  29.286
  615    HG3  ARG  74           HG1      ARG  74  34.869  34.230  30.949
  616    HD2  ARG  74           HD2      ARG  74  37.780  34.015  30.159
  617    HD3  ARG  74           HD1      ARG  74  37.043  35.542  30.648
  618    HE   ARG  74           HE       ARG  74  36.446  33.575  32.627
  619   HH11  ARG  74          HH11      ARG  74  37.650  33.577  34.542
  620   HH12  ARG  74          HH12      ARG  74  39.194  34.359  34.576
  621   HH21  ARG  74          HH21      ARG  74  39.059  35.361  31.259
  622   HH22  ARG  74          HH22      ARG  74  39.992  35.369  32.718
  623    H    GLY  75           HN       GLY  75  32.770  33.910  30.313
  624    HA2  GLY  75           HA3      GLY  75  30.957  32.692  32.108
  625    HA3  GLY  75           HA2      GLY  75  32.301  33.304  33.071
  626    H    GLY  76           HN       GLY  76  30.274  34.617  33.849
  627    HA2  GLY  76           HA3      GLY  76  30.542  37.293  32.704
  628    HA3  GLY  76           HA2      GLY  76  28.943  36.586  32.465
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1  27.108  26.750   5.656
    2    H2   MET   1           HT2      MET   1  28.668  26.458   5.045
    3    H3   MET   1           HT3      MET   1  27.314  25.743   4.307
    4    HA   MET   1           HA       MET   1  28.516  28.156   3.659
    5    HB2  MET   1           HB2      MET   1  26.704  28.214   1.962
    6    HB3  MET   1           HB1      MET   1  27.427  26.610   2.090
    7    HG2  MET   1           HG2      MET   1  25.578  25.974   3.670
    8    HG3  MET   1           HG1      MET   1  24.820  27.531   3.331
    9    HE1  MET   1           HE1      MET   1  22.470  26.384   2.200
   10    HE2  MET   1           HE2      MET   1  23.328  25.198   3.182
   11    HE3  MET   1           HE3      MET   1  22.729  24.744   1.588
   12    H    GLN   2           HN       GLN   2  27.918  30.296   3.938
   13    HA   GLN   2           HA       GLN   2  26.929  32.110   5.061
   14    HB2  GLN   2           HB2      GLN   2  25.171  31.415   3.349
   15    HB3  GLN   2           HB1      GLN   2  24.364  30.553   4.661
   16    HG2  GLN   2           HG2      GLN   2  24.107  32.606   5.928
   17    HG3  GLN   2           HG1      GLN   2  25.063  33.500   4.745
   18   HE21  GLN   2          HE21      GLN   2  21.979  33.332   5.651
   19   HE22  GLN   2          HE22      GLN   2  21.184  33.440   4.155
   20    H    ILE   3           HN       ILE   3  28.069  30.749   6.965
   21    HA   ILE   3           HA       ILE   3  26.093  29.750   8.929
   22    HB   ILE   3           HB       ILE   3  29.081  30.072   9.295
   23   HG12  ILE   3          HG12      ILE   3  27.486  27.763   8.136
   24   HG13  ILE   3          HG11      ILE   3  28.710  28.721   7.299
   25   HG21  ILE   3          HG21      ILE   3  28.803  28.468  11.052
   26   HG22  ILE   3          HG22      ILE   3  27.155  28.100  10.544
   27   HG23  ILE   3          HG23      ILE   3  27.523  29.660  11.279
   28   HD11  ILE   3          HD11      ILE   3  29.112  26.808   9.604
   29   HD12  ILE   3          HD12      ILE   3  30.341  27.973   9.115
   30   HD13  ILE   3          HD13      ILE   3  29.818  26.721   7.988
   31    H    PHE   4           HN       PHE   4  25.244  31.034  10.462
   32    HA   PHE   4           HA       PHE   4  26.259  33.802  10.762
   33    HB2  PHE   4           HB2      PHE   4  23.819  32.381  11.864
   34    HB3  PHE   4           HB1      PHE   4  24.211  34.067  12.200
   35    HD1  PHE   4           HD1      PHE   4  22.997  31.687   9.702
   36    HD2  PHE   4           HD2      PHE   4  24.226  35.746  10.377
   37    HE1  PHE   4           HE1      PHE   4  21.955  32.359   7.554
   38    HE2  PHE   4           HE2      PHE   4  23.183  36.419   8.229
   39    HZ   PHE   4           HZ       PHE   4  22.049  34.724   6.818
   40    H    VAL   5           HN       VAL   5  26.658  34.699  12.924
   41    HA   VAL   5           HA       VAL   5  27.288  32.695  15.049
   42    HB   VAL   5           HB       VAL   5  29.201  34.840  14.068
   43   HG11  VAL   5          HG11      VAL   5  29.331  32.827  16.327
   44   HG12  VAL   5          HG12      VAL   5  29.423  34.584  16.451
   45   HG13  VAL   5          HG13      VAL   5  30.746  33.682  15.710
   46   HG21  VAL   5          HG21      VAL   5  29.310  31.810  13.916
   47   HG22  VAL   5          HG22      VAL   5  30.623  32.893  13.455
   48   HG23  VAL   5          HG23      VAL   5  29.109  32.910  12.552
   49    H    LYS   6           HN       LYS   6  25.761  33.451  16.510
   50    HA   LYS   6           HA       LYS   6  25.546  36.383  16.976
   51    HB2  LYS   6           HB2      LYS   6  23.886  34.033  17.936
   52    HB3  LYS   6           HB1      LYS   6  23.575  35.714  18.370
   53    HG2  LYS   6           HG2      LYS   6  23.209  36.307  16.049
   54    HG3  LYS   6           HG1      LYS   6  23.689  34.694  15.518
   55    HD2  LYS   6           HD2      LYS   6  21.778  33.732  16.775
   56    HD3  LYS   6           HD1      LYS   6  21.282  35.360  17.240
   57    HE2  LYS   6           HE2      LYS   6  21.556  34.404  14.377
   58    HE3  LYS   6           HE1      LYS   6  20.030  34.499  15.257
   59    HZ1  LYS   6           HZ1      LYS   6  21.836  36.725  14.512
   60    HZ2  LYS   6           HZ2      LYS   6  20.582  36.899  15.645
   61    HZ3  LYS   6           HZ3      LYS   6  20.227  36.487  14.035
   62    H    THR   7           HN       THR   7  26.529  37.298  18.714
   63    HA   THR   7           HA       THR   7  27.803  35.536  20.737
   64    HB   THR   7           HB       THR   7  28.968  37.569  21.453
   65    HG1  THR   7           HG1      THR   7  27.424  38.873  19.466
   66   HG21  THR   7          HG21      THR   7  30.027  38.184  19.220
   67   HG22  THR   7          HG22      THR   7  28.845  37.114  18.466
   68   HG23  THR   7          HG23      THR   7  30.019  36.464  19.611
   69    H    LEU   8           HN       LEU   8  27.593  36.320  23.085
   70    HA   LEU   8           HA       LEU   8  24.785  36.469  23.773
   71    HB2  LEU   8           HB2      LEU   8  27.209  36.946  25.536
   72    HB3  LEU   8           HB1      LEU   8  25.571  36.606  26.093
   73    HG   LEU   8           HG       LEU   8  27.274  34.740  24.412
   74   HD11  LEU   8          HD11      LEU   8  26.386  34.330  27.271
   75   HD12  LEU   8          HD12      LEU   8  27.902  35.146  26.886
   76   HD13  LEU   8          HD13      LEU   8  27.648  33.477  26.382
   77   HD21  LEU   8          HD21      LEU   8  24.441  34.633  25.444
   78   HD22  LEU   8          HD22      LEU   8  25.354  33.135  25.257
   79   HD23  LEU   8          HD23      LEU   8  25.065  34.170  23.861
   80    H    THR   9           HN       THR   9  27.316  38.827  23.303
   81    HA   THR   9           HA       THR   9  25.885  40.980  24.664
   82    HB   THR   9           HB       THR   9  27.645  42.425  23.688
   83    HG1  THR   9           HG1      THR   9  28.848  40.151  22.594
   84   HG21  THR   9          HG21      THR   9  28.884  39.856  24.689
   85   HG22  THR   9          HG22      THR   9  28.015  40.967  25.749
   86   HG23  THR   9          HG23      THR   9  29.475  41.503  24.914
   87    H    GLY  10           HN       GLY  10  25.193  39.350  21.911
   88    HA2  GLY  10           HA3      GLY  10  23.456  39.925  20.370
   89    HA3  GLY  10           HA2      GLY  10  23.632  41.619  20.830
   90    H    LYS  11           HN       LYS  11  26.678  41.104  20.517
   91    HA   LYS  11           HA       LYS  11  26.934  42.232  17.904
   92    HB2  LYS  11           HB2      LYS  11  28.977  40.749  19.586
   93    HB3  LYS  11           HB1      LYS  11  29.359  41.679  18.138
   94    HG2  LYS  11           HG2      LYS  11  28.171  43.649  19.302
   95    HG3  LYS  11           HG1      LYS  11  28.286  42.687  20.777
   96    HD2  LYS  11           HD2      LYS  11  30.654  43.411  19.025
   97    HD3  LYS  11           HD1      LYS  11  30.198  44.281  20.490
   98    HE2  LYS  11           HE2      LYS  11  30.347  42.041  21.707
   99    HE3  LYS  11           HE1      LYS  11  31.117  41.408  20.252
  100    HZ1  LYS  11           HZ1      LYS  11  32.087  43.846  21.621
  101    HZ2  LYS  11           HZ2      LYS  11  32.897  42.893  20.469
  102    HZ3  LYS  11           HZ3      LYS  11  32.637  42.297  22.039
  103    H    THR  12           HN       THR  12  25.862  40.967  16.365
  104    HA   THR  12           HA       THR  12  26.762  38.138  16.009
  105    HB   THR  12           HB       THR  12  24.446  39.657  14.766
  106    HG1  THR  12           HG1      THR  12  24.788  38.137  17.044
  107   HG21  THR  12          HG21      THR  12  25.281  36.747  14.600
  108   HG22  THR  12          HG22      THR  12  25.226  37.903  13.270
  109   HG23  THR  12          HG23      THR  12  23.732  37.371  14.036
  110    H    ILE  13           HN       ILE  13  28.241  37.734  14.424
  111    HA   ILE  13           HA       ILE  13  28.680  39.811  12.315
  112    HB   ILE  13           HB       ILE  13  30.480  37.588  13.331
  113   HG12  ILE  13          HG12      ILE  13  30.798  40.595  13.562
  114   HG13  ILE  13          HG11      ILE  13  30.107  39.593  14.840
  115   HG21  ILE  13          HG21      ILE  13  30.935  37.961  10.995
  116   HG22  ILE  13          HG22      ILE  13  32.187  38.806  11.906
  117   HG23  ILE  13          HG23      ILE  13  30.848  39.711  11.200
  118   HD11  ILE  13          HD11      ILE  13  32.868  39.225  13.640
  119   HD12  ILE  13          HD12      ILE  13  32.174  38.274  14.954
  120   HD13  ILE  13          HD13      ILE  13  32.530  39.984  15.195
  121    H    THR  14           HN       THR  14  28.984  39.021  10.114
  122    HA   THR  14           HA       THR  14  27.441  36.520   9.585
  123    HB   THR  14           HB       THR  14  28.277  38.770   7.724
  124    HG1  THR  14           HG1      THR  14  25.638  38.397   8.092
  125   HG21  THR  14          HG21      THR  14  26.619  36.272   7.342
  126   HG22  THR  14          HG22      THR  14  28.045  36.775   6.435
  127   HG23  THR  14          HG23      THR  14  26.525  37.650   6.246
  128    H    LEU  15           HN       LEU  15  28.693  34.746   9.291
  129    HA   LEU  15           HA       LEU  15  31.393  35.069   8.017
  130    HB2  LEU  15           HB2      LEU  15  31.028  34.175  10.504
  131    HB3  LEU  15           HB1      LEU  15  30.635  32.671   9.678
  132    HG   LEU  15           HG       LEU  15  32.886  33.162   8.356
  133   HD11  LEU  15          HD11      LEU  15  34.504  34.453   9.501
  134   HD12  LEU  15          HD12      LEU  15  33.566  34.467  10.997
  135   HD13  LEU  15          HD13      LEU  15  33.040  35.429   9.615
  136   HD21  LEU  15          HD21      LEU  15  32.600  32.083  11.167
  137   HD22  LEU  15          HD22      LEU  15  34.137  32.009  10.303
  138   HD23  LEU  15          HD23      LEU  15  32.721  31.181   9.656
  139    H    GLU  16           HN       GLU  16  31.274  34.391   5.925
  140    HA   GLU  16           HA       GLU  16  29.392  32.166   5.227
  141    HB2  GLU  16           HB2      GLU  16  29.145  34.320   3.989
  142    HB3  GLU  16           HB1      GLU  16  30.802  34.146   3.410
  143    HG2  GLU  16           HG2      GLU  16  30.228  32.044   2.297
  144    HG3  GLU  16           HG1      GLU  16  28.585  32.131   2.935
  145    H    VAL  17           HN       VAL  17  30.331  30.206   4.979
  146    HA   VAL  17           HA       VAL  17  32.865  29.952   3.532
  147    HB   VAL  17           HB       VAL  17  33.769  30.383   5.725
  148   HG11  VAL  17          HG11      VAL  17  33.076  29.056   7.689
  149   HG12  VAL  17          HG12      VAL  17  31.883  28.216   6.699
  150   HG13  VAL  17          HG13      VAL  17  31.709  29.942   7.012
  151   HG21  VAL  17          HG21      VAL  17  34.636  28.402   4.340
  152   HG22  VAL  17          HG22      VAL  17  33.752  27.373   5.468
  153   HG23  VAL  17          HG23      VAL  17  35.054  28.406   6.052
  154    H    GLU  18           HN       GLU  18  33.168  27.835   2.756
  155    HA   GLU  18           HA       GLU  18  30.808  26.270   2.406
  156    HB2  GLU  18           HB2      GLU  18  33.741  25.706   1.935
  157    HB3  GLU  18           HB1      GLU  18  32.491  24.523   1.551
  158    HG2  GLU  18           HG2      GLU  18  31.390  26.142   0.067
  159    HG3  GLU  18           HG1      GLU  18  32.603  27.356   0.474
  160    HA   PRO  19           HA       PRO  19  30.849  23.841   6.131
  161    HB2  PRO  19           HB2      PRO  19  29.608  21.545   5.305
  162    HB3  PRO  19           HB1      PRO  19  28.745  23.082   5.512
  163    HG2  PRO  19           HG2      PRO  19  29.794  21.831   3.008
  164    HG3  PRO  19           HG1      PRO  19  28.238  22.630   3.297
  165    HD2  PRO  19           HD2      PRO  19  30.313  23.898   2.062
  166    HD3  PRO  19           HD1      PRO  19  29.138  24.766   3.075
  167    H    SER  20           HN       SER  20  32.467  22.723   3.280
  168    HA   SER  20           HA       SER  20  33.599  20.331   4.491
  169    HB2  SER  20           HB2      SER  20  35.160  20.455   2.491
  170    HB3  SER  20           HB1      SER  20  33.440  20.361   2.114
  171    HG   SER  20           HG       SER  20  33.435  22.468   1.573
  172    H    ASP  21           HN       ASP  21  34.066  23.544   5.084
  173    HA   ASP  21           HA       ASP  21  36.933  23.659   5.369
  174    HB2  ASP  21           HB2      ASP  21  34.598  25.284   6.365
  175    HB3  ASP  21           HB1      ASP  21  36.209  25.591   6.993
  176    H    THR  22           HN       THR  22  38.046  23.695   7.546
  177    HA   THR  22           HA       THR  22  37.027  21.516   9.229
  178    HB   THR  22           HB       THR  22  39.477  23.181   9.820
  179    HG1  THR  22           HG1      THR  22  38.961  21.571   7.627
  180   HG21  THR  22          HG21      THR  22  38.832  20.231  10.065
  181   HG22  THR  22          HG22      THR  22  38.854  21.393  11.389
  182   HG23  THR  22          HG23      THR  22  40.347  20.987  10.549
  183    H    ILE  23           HN       ILE  23  37.139  21.924  11.726
  184    HA   ILE  23           HA       ILE  23  35.467  24.245  12.323
  185    HB   ILE  23           HB       ILE  23  36.700  22.024  13.968
  186   HG12  ILE  23          HG12      ILE  23  34.449  21.305  14.259
  187   HG13  ILE  23          HG11      ILE  23  33.796  22.822  13.649
  188   HG21  ILE  23          HG21      ILE  23  35.303  23.020  15.877
  189   HG22  ILE  23          HG22      ILE  23  35.253  24.503  14.922
  190   HG23  ILE  23          HG23      ILE  23  36.800  23.865  15.480
  191   HD11  ILE  23          HD11      ILE  23  33.707  20.871  12.029
  192   HD12  ILE  23          HD12      ILE  23  35.465  20.933  11.981
  193   HD13  ILE  23          HD13      ILE  23  34.521  22.308  11.412
  194    H    GLU  24           HN       GLU  24  38.769  23.197  13.181
  195    HA   GLU  24           HA       GLU  24  39.540  25.478  14.659
  196    HB2  GLU  24           HB2      GLU  24  41.894  24.849  13.682
  197    HB3  GLU  24           HB1      GLU  24  41.074  23.705  14.743
  198    HG2  GLU  24           HG2      GLU  24  40.351  22.367  12.910
  199    HG3  GLU  24           HG1      GLU  24  40.758  23.622  11.739
  200    H    ASN  25           HN       ASN  25  39.026  25.065  11.248
  201    HA   ASN  25           HA       ASN  25  40.606  27.340  10.387
  202    HB2  ASN  25           HB2      ASN  25  39.861  25.498   8.851
  203    HB3  ASN  25           HB1      ASN  25  38.202  26.070   9.031
  204   HD21  ASN  25          HD21      ASN  25  39.696  26.066   6.504
  205   HD22  ASN  25          HD22      ASN  25  39.845  27.684   6.017
  206    H    VAL  26           HN       VAL  26  37.113  26.810  10.944
  207    HA   VAL  26           HA       VAL  26  36.230  29.458  10.514
  208    HB   VAL  26           HB       VAL  26  35.244  27.531  12.645
  209   HG11  VAL  26          HG11      VAL  26  33.848  29.764  11.147
  210   HG12  VAL  26          HG12      VAL  26  34.374  29.842  12.828
  211   HG13  VAL  26          HG13      VAL  26  33.107  28.711  12.351
  212   HG21  VAL  26          HG21      VAL  26  35.231  26.344  10.573
  213   HG22  VAL  26          HG22      VAL  26  34.660  27.757   9.686
  214   HG23  VAL  26          HG23      VAL  26  33.581  26.923  10.804
  215    H    LYS  27           HN       LYS  27  36.886  27.963  13.677
  216    HA   LYS  27           HA       LYS  27  36.879  30.098  15.377
  217    HB2  LYS  27           HB2      LYS  27  38.964  27.898  15.246
  218    HB3  LYS  27           HB1      LYS  27  38.729  28.965  16.632
  219    HG2  LYS  27           HG2      LYS  27  36.362  28.204  16.779
  220    HG3  LYS  27           HG1      LYS  27  36.672  27.077  15.458
  221    HD2  LYS  27           HD2      LYS  27  38.386  25.941  16.785
  222    HD3  LYS  27           HD1      LYS  27  38.164  27.097  18.098
  223    HE2  LYS  27           HE2      LYS  27  35.912  25.381  17.034
  224    HE3  LYS  27           HE1      LYS  27  36.939  24.881  18.376
  225    HZ1  LYS  27           HZ1      LYS  27  35.488  25.994  19.628
  226    HZ2  LYS  27           HZ2      LYS  27  34.829  26.835  18.307
  227    HZ3  LYS  27           HZ3      LYS  27  36.246  27.400  19.055
  228    H    ALA  28           HN       ALA  28  39.270  29.481  12.897
  229    HA   ALA  28           HA       ALA  28  41.235  31.377  13.816
  230    HB1  ALA  28           HB1      ALA  28  41.426  29.523  11.987
  231    HB2  ALA  28           HB2      ALA  28  42.308  31.033  11.752
  232    HB3  ALA  28           HB3      ALA  28  40.790  30.756  10.897
  233    H    LYS  29           HN       LYS  29  38.859  31.702  11.146
  234    HA   LYS  29           HA       LYS  29  39.241  34.456  10.680
  235    HB2  LYS  29           HB2      LYS  29  36.704  32.803  10.458
  236    HB3  LYS  29           HB1      LYS  29  36.849  34.452   9.860
  237    HG2  LYS  29           HG2      LYS  29  37.491  33.429   7.903
  238    HG3  LYS  29           HG1      LYS  29  39.060  33.326   8.684
  239    HD2  LYS  29           HD2      LYS  29  38.738  31.109   8.030
  240    HD3  LYS  29           HD1      LYS  29  38.103  31.071   9.671
  241    HE2  LYS  29           HE2      LYS  29  35.815  31.407   8.793
  242    HE3  LYS  29           HE1      LYS  29  36.455  31.422   7.151
  243    HZ1  LYS  29           HZ1      LYS  29  36.375  29.226   7.135
  244    HZ2  LYS  29           HZ2      LYS  29  35.759  29.213   8.718
  245    HZ3  LYS  29           HZ3      LYS  29  37.436  29.153   8.455
  246    H    ILE  30           HN       ILE  30  37.539  32.863  13.265
  247    HA   ILE  30           HA       ILE  30  36.208  35.311  14.181
  248    HB   ILE  30           HB       ILE  30  36.582  32.576  15.440
  249   HG12  ILE  30          HG12      ILE  30  34.086  33.911  14.354
  250   HG13  ILE  30          HG11      ILE  30  35.105  32.841  13.388
  251   HG21  ILE  30          HG21      ILE  30  36.331  34.116  17.261
  252   HG22  ILE  30          HG22      ILE  30  34.729  33.433  16.985
  253   HG23  ILE  30          HG23      ILE  30  35.112  35.048  16.389
  254   HD11  ILE  30          HD11      ILE  30  33.804  32.079  16.020
  255   HD12  ILE  30          HD12      ILE  30  34.753  31.017  14.980
  256   HD13  ILE  30          HD13      ILE  30  33.194  31.630  14.425
  257    H    GLN  31           HN       GLN  31  38.530  33.177  15.812
  258    HA   GLN  31           HA       GLN  31  39.397  34.711  17.886
  259    HB2  GLN  31           HB2      GLN  31  40.258  32.426  17.154
  260    HB3  GLN  31           HB1      GLN  31  41.378  33.292  16.101
  261    HG2  GLN  31           HG2      GLN  31  42.066  34.610  18.181
  262    HG3  GLN  31           HG1      GLN  31  41.208  33.387  19.113
  263   HE21  GLN  31          HE21      GLN  31  44.189  33.937  18.945
  264   HE22  GLN  31          HE22      GLN  31  44.879  32.459  18.478
  265    H    ASP  32           HN       ASP  32  40.622  35.059  14.557
  266    HA   ASP  32           HA       ASP  32  42.442  37.215  15.230
  267    HB2  ASP  32           HB2      ASP  32  41.252  36.316  12.594
  268    HB3  ASP  32           HB1      ASP  32  42.442  37.612  12.726
  269    H    LYS  33           HN       LYS  33  39.335  37.253  13.502
  270    HA   LYS  33           HA       LYS  33  39.077  40.071  13.335
  271    HB2  LYS  33           HB2      LYS  33  37.135  37.807  13.297
  272    HB3  LYS  33           HB1      LYS  33  36.529  39.455  13.291
  273    HG2  LYS  33           HG2      LYS  33  36.889  38.352  11.013
  274    HG3  LYS  33           HG1      LYS  33  37.582  39.952  11.222
  275    HD2  LYS  33           HD2      LYS  33  39.791  39.074  11.417
  276    HD3  LYS  33           HD1      LYS  33  39.203  37.440  11.697
  277    HE2  LYS  33           HE2      LYS  33  38.397  37.281   9.414
  278    HE3  LYS  33           HE1      LYS  33  38.803  38.971   9.117
  279    HZ1  LYS  33           HZ1      LYS  33  40.712  36.786   9.748
  280    HZ2  LYS  33           HZ2      LYS  33  41.135  38.422   9.572
  281    HZ3  LYS  33           HZ3      LYS  33  40.521  37.553   8.247
  282    H    GLU  34           HN       GLU  34  38.055  37.877  15.953
  283    HA   GLU  34           HA       GLU  34  37.044  40.201  17.500
  284    HB2  GLU  34           HB2      GLU  34  37.159  37.304  18.373
  285    HB3  GLU  34           HB1      GLU  34  36.153  38.593  19.030
  286    HG2  GLU  34           HG2      GLU  34  35.119  38.786  16.700
  287    HG3  GLU  34           HG1      GLU  34  35.919  37.259  16.331
  288    H    GLY  35           HN       GLY  35  39.855  38.218  17.215
  289    HA2  GLY  35           HA3      GLY  35  41.929  38.355  18.326
  290    HA3  GLY  35           HA2      GLY  35  41.361  39.858  19.047
  291    H    ILE  36           HN       ILE  36  39.212  37.307  19.567
  292    HA   ILE  36           HA       ILE  36  39.891  37.224  22.410
  293    HB   ILE  36           HB       ILE  36  37.677  35.913  20.837
  294   HG12  ILE  36          HG12      ILE  36  37.748  38.433  22.524
  295   HG13  ILE  36          HG11      ILE  36  37.709  38.398  20.763
  296   HG21  ILE  36          HG21      ILE  36  36.630  35.716  23.093
  297   HG22  ILE  36          HG22      ILE  36  38.125  36.315  23.807
  298   HG23  ILE  36          HG23      ILE  36  38.110  34.774  22.956
  299   HD11  ILE  36          HD11      ILE  36  35.569  37.162  20.854
  300   HD12  ILE  36          HD12      ILE  36  35.454  38.737  21.639
  301   HD13  ILE  36          HD13      ILE  36  35.601  37.274  22.612
  302    HA   PRO  37           HA       PRO  37  42.565  33.589  21.610
  303    HB2  PRO  37           HB2      PRO  37  41.917  33.221  24.528
  304    HB3  PRO  37           HB1      PRO  37  43.479  33.058  23.695
  305    HG2  PRO  37           HG2      PRO  37  42.917  35.233  25.113
  306    HG3  PRO  37           HG1      PRO  37  43.809  35.345  23.584
  307    HD2  PRO  37           HD2      PRO  37  40.980  36.112  24.167
  308    HD3  PRO  37           HD1      PRO  37  42.106  36.782  22.965
  309    HA   PRO  38           HA       PRO  38  39.447  30.437  21.198
  310    HB2  PRO  38           HB2      PRO  38  40.912  28.190  20.992
  311    HB3  PRO  38           HB1      PRO  38  40.998  29.468  19.756
  312    HG2  PRO  38           HG2      PRO  38  42.798  28.996  22.085
  313    HG3  PRO  38           HG1      PRO  38  43.240  29.243  20.385
  314    HD2  PRO  38           HD2      PRO  38  43.332  31.270  22.187
  315    HD3  PRO  38           HD1      PRO  38  42.849  31.551  20.497
  316    H    ASP  39           HN       ASP  39  41.535  30.400  23.949
  317    HA   ASP  39           HA       ASP  39  40.151  28.143  25.247
  318    HB2  ASP  39           HB2      ASP  39  42.323  30.045  26.159
  319    HB3  ASP  39           HB1      ASP  39  41.638  28.791  27.193
  320    H    GLN  40           HN       GLN  40  39.723  31.524  24.950
  321    HA   GLN  40           HA       GLN  40  38.182  31.724  27.485
  322    HB2  GLN  40           HB2      GLN  40  39.172  33.731  25.455
  323    HB3  GLN  40           HB1      GLN  40  38.006  34.167  26.701
  324    HG2  GLN  40           HG2      GLN  40  40.623  32.809  27.355
  325    HG3  GLN  40           HG1      GLN  40  40.468  34.564  27.278
  326   HE21  GLN  40          HE21      GLN  40  38.666  35.507  28.725
  327   HE22  GLN  40          HE22      GLN  40  38.377  34.741  30.211
  328    H    GLN  41           HN       GLN  41  37.521  30.550  24.540
  329    HA   GLN  41           HA       GLN  41  34.690  31.489  24.636
  330    HB2  GLN  41           HB2      GLN  41  34.743  31.579  22.135
  331    HB3  GLN  41           HB1      GLN  41  35.721  32.822  22.903
  332    HG2  GLN  41           HG2      GLN  41  37.724  31.362  22.601
  333    HG3  GLN  41           HG1      GLN  41  36.715  30.206  21.736
  334   HE21  GLN  41          HE21      GLN  41  38.277  33.360  21.512
  335   HE22  GLN  41          HE22      GLN  41  37.938  33.614  19.868
  336    H    ARG  42           HN       ARG  42  33.212  29.921  24.172
  337    HA   ARG  42           HA       ARG  42  34.174  27.278  23.154
  338    HB2  ARG  42           HB2      ARG  42  32.399  27.844  25.539
  339    HB3  ARG  42           HB1      ARG  42  32.450  26.270  24.757
  340    HG2  ARG  42           HG2      ARG  42  34.888  27.703  25.846
  341    HG3  ARG  42           HG1      ARG  42  33.987  26.494  26.753
  342    HD2  ARG  42           HD2      ARG  42  35.781  26.140  24.371
  343    HD3  ARG  42           HD1      ARG  42  35.659  25.167  25.829
  344    HE   ARG  42           HE       ARG  42  33.249  24.681  24.629
  345   HH11  ARG  42          HH11      ARG  42  32.906  23.096  23.056
  346   HH12  ARG  42          HH12      ARG  42  34.225  22.589  22.056
  347   HH21  ARG  42          HH21      ARG  42  36.521  24.720  23.538
  348   HH22  ARG  42          HH22      ARG  42  36.270  23.506  22.327
  349    H    LEU  43           HN       LEU  43  32.927  26.658  21.409
  350    HA   LEU  43           HA       LEU  43  30.592  28.328  20.757
  351    HB2  LEU  43           HB2      LEU  43  31.663  25.993  19.181
  352    HB3  LEU  43           HB1      LEU  43  30.669  27.341  18.601
  353    HG   LEU  43           HG       LEU  43  33.570  27.401  19.481
  354   HD11  LEU  43          HD11      LEU  43  32.102  28.222  16.968
  355   HD12  LEU  43          HD12      LEU  43  33.085  26.770  17.155
  356   HD13  LEU  43          HD13      LEU  43  33.841  28.364  17.220
  357   HD21  LEU  43          HD21      LEU  43  32.666  29.374  20.474
  358   HD22  LEU  43          HD22      LEU  43  31.583  29.646  19.110
  359   HD23  LEU  43          HD23      LEU  43  33.318  29.911  18.924
  360    H    ILE  44           HN       ILE  44  28.513  27.607  20.570
  361    HA   ILE  44           HA       ILE  44  27.884  24.840  21.567
  362    HB   ILE  44           HB       ILE  44  26.305  27.402  22.001
  363   HG12  ILE  44          HG12      ILE  44  28.289  27.371  23.418
  364   HG13  ILE  44          HG11      ILE  44  26.872  27.035  24.407
  365   HG21  ILE  44          HG21      ILE  44  25.840  24.534  22.902
  366   HG22  ILE  44          HG22      ILE  44  24.825  25.464  21.801
  367   HG23  ILE  44          HG23      ILE  44  24.925  25.915  23.505
  368   HD11  ILE  44          HD11      ILE  44  29.076  25.180  23.564
  369   HD12  ILE  44          HD12      ILE  44  27.481  24.508  23.891
  370   HD13  ILE  44          HD13      ILE  44  28.343  25.388  25.150
  371    H    PHE  45           HN       PHE  45  26.529  23.683  20.199
  372    HA   PHE  45           HA       PHE  45  24.962  25.158  18.156
  373    HB2  PHE  45           HB2      PHE  45  27.023  24.726  16.989
  374    HB3  PHE  45           HB1      PHE  45  27.095  23.076  17.602
  375    HD1  PHE  45           HD1      PHE  45  25.326  25.363  15.295
  376    HD2  PHE  45           HD2      PHE  45  25.796  21.310  16.615
  377    HE1  PHE  45           HE1      PHE  45  24.024  24.579  13.335
  378    HE2  PHE  45           HE2      PHE  45  24.495  20.518  14.657
  379    HZ   PHE  45           HZ       PHE  45  23.609  22.154  13.016
  380    H    ALA  46           HN       ALA  46  22.977  24.420  18.786
  381    HA   ALA  46           HA       ALA  46  21.212  22.927  19.113
  382    HB1  ALA  46           HB1      ALA  46  22.931  20.788  17.861
  383    HB2  ALA  46           HB2      ALA  46  22.249  22.096  16.895
  384    HB3  ALA  46           HB3      ALA  46  21.182  20.995  17.766
  385    H    GLY  47           HN       GLY  47  23.435  23.079  21.186
  386    HA2  GLY  47           HA3      GLY  47  23.428  22.062  23.343
  387    HA3  GLY  47           HA2      GLY  47  22.564  20.680  22.676
  388    H    LYS  48           HN       LYS  48  25.093  21.359  20.600
  389    HA   LYS  48           HA       LYS  48  26.996  19.559  22.060
  390    HB2  LYS  48           HB2      LYS  48  26.272  19.471  19.140
  391    HB3  LYS  48           HB1      LYS  48  27.506  18.484  19.906
  392    HG2  LYS  48           HG2      LYS  48  25.785  17.500  21.387
  393    HG3  LYS  48           HG1      LYS  48  24.551  18.471  20.585
  394    HD2  LYS  48           HD2      LYS  48  25.122  17.382  18.427
  395    HD3  LYS  48           HD1      LYS  48  26.297  16.372  19.269
  396    HE2  LYS  48           HE2      LYS  48  23.330  16.463  19.885
  397    HE3  LYS  48           HE1      LYS  48  24.131  15.200  18.951
  398    HZ1  LYS  48           HZ1      LYS  48  24.812  15.923  21.749
  399    HZ2  LYS  48           HZ2      LYS  48  25.472  14.643  20.846
  400    HZ3  LYS  48           HZ3      LYS  48  23.835  14.609  21.302
  401    H    GLN  49           HN       GLN  49  29.244  19.976  21.578
  402    HA   GLN  49           HA       GLN  49  29.732  22.683  20.495
  403    HB2  GLN  49           HB2      GLN  49  31.665  20.935  21.960
  404    HB3  GLN  49           HB1      GLN  49  31.767  22.671  21.713
  405    HG2  GLN  49           HG2      GLN  49  29.718  22.965  23.081
  406    HG3  GLN  49           HG1      GLN  49  29.676  21.225  23.367
  407   HE21  GLN  49          HE21      GLN  49  30.859  20.473  25.143
  408   HE22  GLN  49          HE22      GLN  49  32.027  21.380  25.978
  409    H    LEU  50           HN       LEU  50  31.832  22.887  19.196
  410    HA   LEU  50           HA       LEU  50  32.021  20.592  17.281
  411    HB2  LEU  50           HB2      LEU  50  33.070  23.404  16.891
  412    HB3  LEU  50           HB1      LEU  50  32.783  22.176  15.661
  413    HG   LEU  50           HG       LEU  50  30.640  23.503  17.347
  414   HD11  LEU  50          HD11      LEU  50  30.005  24.640  15.297
  415   HD12  LEU  50          HD12      LEU  50  31.239  23.770  14.387
  416   HD13  LEU  50          HD13      LEU  50  31.712  24.956  15.604
  417   HD21  LEU  50          HD21      LEU  50  30.596  21.353  15.220
  418   HD22  LEU  50          HD22      LEU  50  29.176  22.345  15.552
  419   HD23  LEU  50          HD23      LEU  50  29.853  21.326  16.819
  420    H    GLU  51           HN       GLU  51  33.908  19.441  17.204
  421    HA   GLU  51           HA       GLU  51  36.137  20.300  18.968
  422    HB2  GLU  51           HB2      GLU  51  35.722  17.726  17.413
  423    HB3  GLU  51           HB1      GLU  51  36.997  18.026  18.595
  424    HG2  GLU  51           HG2      GLU  51  35.253  18.429  20.329
  425    HG3  GLU  51           HG1      GLU  51  34.014  18.022  19.140
  426    H    ASP  52           HN       ASP  52  38.363  20.233  18.125
  427    HA   ASP  52           HA       ASP  52  38.630  21.629  15.626
  428    HB2  ASP  52           HB2      ASP  52  40.736  20.183  17.266
  429    HB3  ASP  52           HB1      ASP  52  41.058  21.349  15.982
  430    H    GLY  53           HN       GLY  53  39.726  20.843  13.689
  431    HA2  GLY  53           HA3      GLY  53  40.370  19.185  12.118
  432    HA3  GLY  53           HA2      GLY  53  40.112  17.954  13.356
  433    H    ARG  54           HN       ARG  54  39.124  17.152  11.061
  434    HA   ARG  54           HA       ARG  54  37.201  16.528   9.904
  435    HB2  ARG  54           HB2      ARG  54  36.029  17.146  12.629
  436    HB3  ARG  54           HB1      ARG  54  35.122  16.380  11.325
  437    HG2  ARG  54           HG2      ARG  54  36.551  14.475  11.305
  438    HG3  ARG  54           HG1      ARG  54  37.770  15.285  12.288
  439    HD2  ARG  54           HD2      ARG  54  36.258  15.303  14.210
  440    HD3  ARG  54           HD1      ARG  54  34.979  14.580  13.233
  441    HE   ARG  54           HE       ARG  54  37.090  12.791  13.016
  442   HH11  ARG  54          HH11      ARG  54  37.337  11.050  14.435
  443   HH12  ARG  54          HH12      ARG  54  36.647  11.138  16.022
  444   HH21  ARG  54          HH21      ARG  54  35.324  14.309  15.559
  445   HH22  ARG  54          HH22      ARG  54  35.508  12.982  16.657
  446    H    THR  55           HN       THR  55  35.154  17.368   8.947
  447    HA   THR  55           HA       THR  55  34.999  20.364   9.046
  448    HB   THR  55           HB       THR  55  34.452  20.306   6.674
  449    HG1  THR  55           HG1      THR  55  33.494  18.475   6.211
  450   HG21  THR  55          HG21      THR  55  36.942  18.824   7.514
  451   HG22  THR  55          HG22      THR  55  36.788  20.498   6.988
  452   HG23  THR  55          HG23      THR  55  36.621  19.186   5.821
  453    H    LEU  56           HN       LEU  56  32.788  21.187   8.401
  454    HA   LEU  56           HA       LEU  56  30.733  19.928   9.920
  455    HB2  LEU  56           HB2      LEU  56  30.697  22.046   7.766
  456    HB3  LEU  56           HB1      LEU  56  29.196  21.442   8.459
  457    HG   LEU  56           HG       LEU  56  30.091  22.014  10.738
  458   HD11  LEU  56          HD11      LEU  56  32.012  23.701  10.689
  459   HD12  LEU  56          HD12      LEU  56  32.323  23.154   9.041
  460   HD13  LEU  56          HD13      LEU  56  32.451  22.021  10.387
  461   HD21  LEU  56          HD21      LEU  56  28.624  23.539   9.316
  462   HD22  LEU  56          HD22      LEU  56  30.098  24.397   8.870
  463   HD23  LEU  56          HD23      LEU  56  29.581  24.351  10.555
  464    H    SER  57           HN       SER  57  31.333  19.901   6.377
  465    HA   SER  57           HA       SER  57  29.084  18.237   5.749
  466    HB2  SER  57           HB2      SER  57  30.375  19.438   4.012
  467    HB3  SER  57           HB1      SER  57  31.777  18.429   4.355
  468    HG   SER  57           HG       SER  57  29.304  17.747   3.187
  469    H    ASP  58           HN       ASP  58  32.504  17.442   6.285
  470    HA   ASP  58           HA       ASP  58  32.395  14.660   6.103
  471    HB2  ASP  58           HB2      ASP  58  33.993  16.432   7.960
  472    HB3  ASP  58           HB1      ASP  58  34.226  14.686   7.894
  473    H    TYR  59           HN       TYR  59  31.256  16.706   8.781
  474    HA   TYR  59           HA       TYR  59  30.833  14.450  10.569
  475    HB2  TYR  59           HB2      TYR  59  30.004  17.347  10.547
  476    HB3  TYR  59           HB1      TYR  59  29.206  16.244  11.664
  477    HD1  TYR  59           HD1      TYR  59  31.874  18.482  11.383
  478    HD2  TYR  59           HD2      TYR  59  30.939  14.574  12.906
  479    HE1  TYR  59           HE1      TYR  59  33.784  18.637  12.955
  480    HE2  TYR  59           HE2      TYR  59  32.849  14.732  14.478
  481    HH   TYR  59           HH       TYR  59  34.153  16.721  15.588
  482    H    ASN  60           HN       ASN  60  29.052  15.855   7.921
  483    HA   ASN  60           HA       ASN  60  27.041  15.187   6.931
  484    HB2  ASN  60           HB2      ASN  60  26.884  12.838   8.818
  485    HB3  ASN  60           HB1      ASN  60  26.376  12.947   7.134
  486   HD21  ASN  60          HD21      ASN  60  28.443  13.644   5.650
  487   HD22  ASN  60          HD22      ASN  60  29.829  12.705   5.932
  488    H    ILE  61           HN       ILE  61  26.757  17.164   8.699
  489    HA   ILE  61           HA       ILE  61  24.812  16.463  10.794
  490    HB   ILE  61           HB       ILE  61  25.776  19.178   9.843
  491   HG12  ILE  61          HG12      ILE  61  26.654  17.581  12.265
  492   HG13  ILE  61          HG11      ILE  61  27.545  17.603  10.742
  493   HG21  ILE  61          HG21      ILE  61  23.669  19.338  11.046
  494   HG22  ILE  61          HG22      ILE  61  24.967  19.884  12.109
  495   HG23  ILE  61          HG23      ILE  61  24.274  18.274  12.317
  496   HD11  ILE  61          HD11      ILE  61  28.456  19.265  12.331
  497   HD12  ILE  61          HD12      ILE  61  26.875  20.042  12.417
  498   HD13  ILE  61          HD13      ILE  61  27.779  20.050  10.903
  499    H    GLN  62           HN       GLN  62  22.623  17.180  10.799
  500    HA   GLN  62           HA       GLN  62  21.527  18.465   8.382
  501    HB2  GLN  62           HB2      GLN  62  19.789  16.541   8.247
  502    HB3  GLN  62           HB1      GLN  62  21.389  16.248   7.564
  503    HG2  GLN  62           HG2      GLN  62  22.087  15.090   9.599
  504    HG3  GLN  62           HG1      GLN  62  20.542  15.453  10.366
  505   HE21  GLN  62          HE21      GLN  62  19.225  13.635  10.347
  506   HE22  GLN  62          HE22      GLN  62  19.120  12.514   9.076
  507    H    LYS  63           HN       LYS  63  21.211  20.005  10.245
  508    HA   LYS  63           HA       LYS  63  18.889  19.259  11.992
  509    HB2  LYS  63           HB2      LYS  63  20.979  20.001  13.140
  510    HB3  LYS  63           HB1      LYS  63  20.855  21.546  12.300
  511    HG2  LYS  63           HG2      LYS  63  18.663  21.956  13.337
  512    HG3  LYS  63           HG1      LYS  63  18.746  20.392  14.150
  513    HD2  LYS  63           HD2      LYS  63  20.768  21.120  15.357
  514    HD3  LYS  63           HD1      LYS  63  20.698  22.682  14.537
  515    HE2  LYS  63           HE2      LYS  63  18.479  23.108  15.532
  516    HE3  LYS  63           HE1      LYS  63  18.553  21.550  16.358
  517    HZ1  LYS  63           HZ1      LYS  63  20.855  23.245  16.763
  518    HZ2  LYS  63           HZ2      LYS  63  19.965  22.331  17.884
  519    HZ3  LYS  63           HZ3      LYS  63  19.411  23.864  17.402
  520    H    GLU  64           HN       GLU  64  20.047  21.563   9.589
  521    HA   GLU  64           HA       GLU  64  17.385  22.336   8.846
  522    HB2  GLU  64           HB2      GLU  64  17.427  23.591  10.958
  523    HB3  GLU  64           HB1      GLU  64  18.952  24.347  10.495
  524    HG2  GLU  64           HG2      GLU  64  17.915  25.517   8.674
  525    HG3  GLU  64           HG1      GLU  64  16.424  24.591   8.847
  526    H    SEP  65           HN       SEP  65  17.441  23.937   7.075
  527    HA   SEP  65           HA       SEP  65  19.554  23.572   5.250
  528    HB2  SEP  65           HB1      SEP  65  18.594  25.359   3.968
  529    HB3  SEP  65           HB2      SEP  65  17.858  26.073   5.399
  530    H    TPO  66           HN       TPO  66  18.923  26.679   6.916
  531    HA   TPO  66           HA       TPO  66  21.700  27.498   6.535
  532    HB   TPO  66           HB       TPO  66  21.042  29.562   7.578
  533   HG21  TPO  66          HG21      TPO  66  20.109  29.165   5.326
  534   HG22  TPO  66          HG22      TPO  66  19.023  30.152   6.304
  535   HG23  TPO  66          HG23      TPO  66  18.675  28.441   6.053
  536    H    LEU  67           HN       LEU  67  23.349  27.245   7.989
  537    HA   LEU  67           HA       LEU  67  22.769  25.778  10.493
  538    HB2  LEU  67           HB2      LEU  67  25.293  26.497   8.991
  539    HB3  LEU  67           HB1      LEU  67  25.357  25.863  10.635
  540    HG   LEU  67           HG       LEU  67  24.012  23.893   9.885
  541   HD11  LEU  67          HD11      LEU  67  22.829  24.682   7.988
  542   HD12  LEU  67          HD12      LEU  67  24.025  23.573   7.320
  543   HD13  LEU  67          HD13      LEU  67  24.291  25.314   7.232
  544   HD21  LEU  67          HD21      LEU  67  26.639  24.511   8.515
  545   HD22  LEU  67          HD22      LEU  67  25.880  22.921   8.433
  546   HD23  LEU  67          HD23      LEU  67  26.379  23.579   9.991
  547    H    HIS  68           HN       HIS  68  22.530  26.820  12.386
  548    HA   HIS  68           HA       HIS  68  23.494  29.648  12.630
  549    HB2  HIS  68           HB2      HIS  68  21.871  29.757  14.535
  550    HB3  HIS  68           HB1      HIS  68  21.099  29.411  12.987
  551    HD1  HIS  68           HD1      HIS  68  22.234  27.673  16.162
  552    HD2  HIS  68           HD2      HIS  68  19.793  26.934  12.860
  553    HE1  HIS  68           HE1      HIS  68  21.006  25.508  16.646
  554    HE2  HIS  68           HE2      HIS  68  19.518  25.050  14.642
  555    H    LEU  69           HN       LEU  69  25.025  30.118  14.152
  556    HA   LEU  69           HA       LEU  69  25.756  28.016  16.167
  557    HB2  LEU  69           HB2      LEU  69  27.542  29.566  14.280
  558    HB3  LEU  69           HB1      LEU  69  28.163  28.979  15.819
  559    HG   LEU  69           HG       LEU  69  27.362  26.669  15.170
  560   HD11  LEU  69          HD11      LEU  69  25.897  26.642  13.424
  561   HD12  LEU  69          HD12      LEU  69  27.332  26.698  12.413
  562   HD13  LEU  69          HD13      LEU  69  26.457  28.182  12.780
  563   HD21  LEU  69          HD21      LEU  69  29.432  28.072  13.455
  564   HD22  LEU  69          HD22      LEU  69  29.274  26.320  13.583
  565   HD23  LEU  69          HD23      LEU  69  29.707  27.272  15.003
  566    H    VAL  70           HN       VAL  70  26.569  28.916  18.180
  567    HA   VAL  70           HA       VAL  70  26.333  31.886  18.455
  568    HB   VAL  70           HB       VAL  70  24.211  30.719  19.187
  569   HG11  VAL  70          HG11      VAL  70  25.611  28.719  20.109
  570   HG12  VAL  70          HG12      VAL  70  24.187  29.237  21.009
  571   HG13  VAL  70          HG13      VAL  70  25.793  29.718  21.551
  572   HG21  VAL  70          HG21      VAL  70  25.924  32.255  21.149
  573   HG22  VAL  70          HG22      VAL  70  24.254  31.821  21.510
  574   HG23  VAL  70          HG23      VAL  70  24.615  32.861  20.134
  575    H    LEU  71           HN       LEU  71  28.200  32.621  19.320
  576    HA   LEU  71           HA       LEU  71  30.076  30.757  20.589
  577    HB2  LEU  71           HB2      LEU  71  30.744  32.625  19.018
  578    HB3  LEU  71           HB1      LEU  71  30.291  33.772  20.273
  579    HG   LEU  71           HG       LEU  71  32.173  31.587  21.107
  580   HD11  LEU  71          HD11      LEU  71  33.052  32.238  18.878
  581   HD12  LEU  71          HD12      LEU  71  34.128  32.733  20.184
  582   HD13  LEU  71          HD13      LEU  71  33.088  33.922  19.401
  583   HD21  LEU  71          HD21      LEU  71  32.045  34.585  21.585
  584   HD22  LEU  71          HD22      LEU  71  33.217  33.498  22.326
  585   HD23  LEU  71          HD23      LEU  71  31.505  33.333  22.701
  586    H    ARG  72           HN       ARG  72  30.714  30.846  22.813
  587    HA   ARG  72           HA       ARG  72  28.929  32.470  24.597
  588    HB2  ARG  72           HB2      ARG  72  28.711  29.874  24.553
  589    HB3  ARG  72           HB1      ARG  72  30.269  29.873  25.375
  590    HG2  ARG  72           HG2      ARG  72  28.836  29.909  27.211
  591    HG3  ARG  72           HG1      ARG  72  29.074  31.638  26.971
  592    HD2  ARG  72           HD2      ARG  72  26.739  31.459  27.150
  593    HD3  ARG  72           HD1      ARG  72  26.982  31.454  25.403
  594    HE   ARG  72           HE       ARG  72  27.065  28.762  26.192
  595   HH11  ARG  72          HH11      ARG  72  25.209  27.475  26.101
  596   HH12  ARG  72          HH12      ARG  72  23.648  28.226  26.132
  597   HH21  ARG  72          HH21      ARG  72  24.912  31.449  26.334
  598   HH22  ARG  72          HH22      ARG  72  23.480  30.476  26.265
  599    H    LEU  73           HN       LEU  73  29.996  33.206  26.600
  600    HA   LEU  73           HA       LEU  73  32.851  33.838  26.133
  601    HB2  LEU  73           HB2      LEU  73  31.058  34.694  28.423
  602    HB3  LEU  73           HB1      LEU  73  32.601  35.409  27.960
  603    HG   LEU  73           HG       LEU  73  30.132  35.353  26.199
  604   HD11  LEU  73          HD11      LEU  73  29.877  37.705  26.745
  605   HD12  LEU  73          HD12      LEU  73  31.349  37.678  27.719
  606   HD13  LEU  73          HD13      LEU  73  29.922  36.787  28.251
  607   HD21  LEU  73          HD21      LEU  73  32.005  35.515  24.764
  608   HD22  LEU  73          HD22      LEU  73  32.915  36.498  25.913
  609   HD23  LEU  73          HD23      LEU  73  31.557  37.199  25.033
  610    H    ARG  74           HN       ARG  74  34.517  33.125  27.494
  611    HA   ARG  74           HA       ARG  74  35.590  31.536  28.855
  612    HB2  ARG  74           HB2      ARG  74  33.172  32.123  30.592
  613    HB3  ARG  74           HB1      ARG  74  34.683  31.397  31.142
  614    HG2  ARG  74           HG2      ARG  74  35.883  33.460  30.341
  615    HG3  ARG  74           HG1      ARG  74  34.309  34.185  30.017
  616    HD2  ARG  74           HD2      ARG  74  33.698  33.763  32.421
  617    HD3  ARG  74           HD1      ARG  74  35.360  33.243  32.698
  618    HE   ARG  74           HE       ARG  74  36.048  35.510  32.568
  619   HH11  ARG  74          HH11      ARG  74  35.590  37.721  32.452
  620   HH12  ARG  74          HH12      ARG  74  34.023  38.241  31.930
  621   HH21  ARG  74          HH21      ARG  74  32.818  35.024  31.463
  622   HH22  ARG  74          HH22      ARG  74  32.454  36.716  31.369
  623    H    GLY  75           HN       GLY  75  34.247  29.705  30.700
  624    HA2  GLY  75           HA3      GLY  75  32.212  28.113  29.787
  625    HA3  GLY  75           HA2      GLY  75  33.562  27.623  28.763
  626    H    GLY  76           HN       GLY  76  33.313  25.500  29.868
  627    HA2  GLY  76           HA3      GLY  76  35.152  25.327  32.142
  628    HA3  GLY  76           HA2      GLY  76  33.493  24.866  32.530
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1  27.944  27.616   1.955
    2    H2   MET   1           HT2      MET   1  27.747  28.476   3.408
    3    H3   MET   1           HT3      MET   1  29.284  27.909   2.955
    4    HA   MET   1           HA       MET   1  29.705  29.774   1.872
    5    HB2  MET   1           HB2      MET   1  27.059  29.299   0.463
    6    HB3  MET   1           HB1      MET   1  28.339  30.383  -0.081
    7    HG2  MET   1           HG2      MET   1  29.886  28.464  -0.263
    8    HG3  MET   1           HG1      MET   1  28.599  27.381   0.269
    9    HE1  MET   1           HE1      MET   1  29.200  29.405  -3.767
   10    HE2  MET   1           HE2      MET   1  30.343  29.170  -2.448
   11    HE3  MET   1           HE3      MET   1  29.078  30.387  -2.302
   12    H    GLN   2           HN       GLN   2  27.473  29.562   4.155
   13    HA   GLN   2           HA       GLN   2  27.272  32.432   4.512
   14    HB2  GLN   2           HB2      GLN   2  24.723  32.423   4.483
   15    HB3  GLN   2           HB1      GLN   2  25.498  32.322   2.902
   16    HG2  GLN   2           HG2      GLN   2  25.219  29.873   2.911
   17    HG3  GLN   2           HG1      GLN   2  24.455  29.962   4.499
   18   HE21  GLN   2          HE21      GLN   2  23.666  29.661   1.300
   19   HE22  GLN   2          HE22      GLN   2  22.138  30.401   1.307
   20    H    ILE   3           HN       ILE   3  28.381  30.815   6.279
   21    HA   ILE   3           HA       ILE   3  26.451  29.668   8.151
   22    HB   ILE   3           HB       ILE   3  29.429  30.181   8.398
   23   HG12  ILE   3          HG12      ILE   3  27.915  27.586   7.990
   24   HG13  ILE   3          HG11      ILE   3  28.624  28.513   6.667
   25   HG21  ILE   3          HG21      ILE   3  27.448  28.769  10.202
   26   HG22  ILE   3          HG22      ILE   3  28.531  30.097  10.620
   27   HG23  ILE   3          HG23      ILE   3  29.187  28.494  10.297
   28   HD11  ILE   3          HD11      ILE   3  30.195  27.542   9.065
   29   HD12  ILE   3          HD12      ILE   3  30.841  28.268   7.594
   30   HD13  ILE   3          HD13      ILE   3  30.104  26.666   7.538
   31    H    PHE   4           HN       PHE   4  25.521  30.705   9.844
   32    HA   PHE   4           HA       PHE   4  26.215  33.561  10.294
   33    HB2  PHE   4           HB2      PHE   4  23.895  31.848  11.232
   34    HB3  PHE   4           HB1      PHE   4  24.114  33.539  11.676
   35    HD1  PHE   4           HD1      PHE   4  23.257  31.208   8.977
   36    HD2  PHE   4           HD2      PHE   4  23.953  35.324   9.984
   37    HE1  PHE   4           HE1      PHE   4  22.209  31.907   6.841
   38    HE2  PHE   4           HE2      PHE   4  22.906  36.025   7.848
   39    HZ   PHE   4           HZ       PHE   4  22.033  34.315   6.277
   40    H    VAL   5           HN       VAL   5  26.733  34.347  12.398
   41    HA   VAL   5           HA       VAL   5  27.249  32.329  14.529
   42    HB   VAL   5           HB       VAL   5  29.300  34.296  13.459
   43   HG11  VAL   5          HG11      VAL   5  30.748  33.166  15.232
   44   HG12  VAL   5          HG12      VAL   5  29.255  32.523  15.912
   45   HG13  VAL   5          HG13      VAL   5  29.514  34.266  15.844
   46   HG21  VAL   5          HG21      VAL   5  29.113  31.270  13.511
   47   HG22  VAL   5          HG22      VAL   5  30.613  32.137  13.174
   48   HG23  VAL   5          HG23      VAL   5  29.228  32.314  12.094
   49    H    LYS   6           HN       LYS   6  26.106  33.132  16.236
   50    HA   LYS   6           HA       LYS   6  25.855  36.096  16.541
   51    HB2  LYS   6           HB2      LYS   6  23.766  34.735  16.492
   52    HB3  LYS   6           HB1      LYS   6  24.328  33.867  17.922
   53    HG2  LYS   6           HG2      LYS   6  24.380  35.954  19.203
   54    HG3  LYS   6           HG1      LYS   6  23.895  36.865  17.773
   55    HD2  LYS   6           HD2      LYS   6  21.783  35.573  17.679
   56    HD3  LYS   6           HD1      LYS   6  22.262  34.705  19.139
   57    HE2  LYS   6           HE2      LYS   6  21.921  37.713  18.954
   58    HE3  LYS   6           HE1      LYS   6  20.728  36.605  19.633
   59    HZ1  LYS   6           HZ1      LYS   6  23.329  37.419  20.695
   60    HZ2  LYS   6           HZ2      LYS   6  22.798  35.839  21.022
   61    HZ3  LYS   6           HZ3      LYS   6  21.860  37.171  21.505
   62    H    THR   7           HN       THR   7  27.146  37.047  18.036
   63    HA   THR   7           HA       THR   7  28.642  35.391  19.953
   64    HB   THR   7           HB       THR   7  29.775  37.481  20.537
   65    HG1  THR   7           HG1      THR   7  29.025  39.399  19.857
   66   HG21  THR   7          HG21      THR   7  30.481  38.174  18.173
   67   HG22  THR   7          HG22      THR   7  29.318  36.984  17.592
   68   HG23  THR   7          HG23      THR   7  30.682  36.473  18.585
   69    H    LEU   8           HN       LEU   8  28.735  36.268  22.294
   70    HA   LEU   8           HA       LEU   8  26.099  36.118  23.428
   71    HB2  LEU   8           HB2      LEU   8  28.262  35.421  24.543
   72    HB3  LEU   8           HB1      LEU   8  28.626  37.126  24.775
   73    HG   LEU   8           HG       LEU   8  25.931  36.197  25.728
   74   HD11  LEU   8          HD11      LEU   8  27.321  34.363  26.519
   75   HD12  LEU   8          HD12      LEU   8  26.916  35.410  27.878
   76   HD13  LEU   8          HD13      LEU   8  28.518  35.496  27.145
   77   HD21  LEU   8          HD21      LEU   8  26.574  38.531  26.058
   78   HD22  LEU   8          HD22      LEU   8  28.077  38.043  26.837
   79   HD23  LEU   8          HD23      LEU   8  26.533  37.727  27.624
   80    H    THR   9           HN       THR   9  28.245  38.803  22.622
   81    HA   THR   9           HA       THR   9  26.581  40.790  23.964
   82    HB   THR   9           HB       THR   9  28.057  42.426  22.853
   83    HG1  THR   9           HG1      THR   9  29.441  40.265  21.710
   84   HG21  THR   9          HG21      THR   9  30.155  41.714  23.875
   85   HG22  THR   9          HG22      THR   9  29.598  40.041  23.911
   86   HG23  THR   9          HG23      THR   9  28.808  41.255  24.918
   87    H    GLY  10           HN       GLY  10  26.033  38.959  21.286
   88    HA2  GLY  10           HA3      GLY  10  24.124  39.208  19.852
   89    HA3  GLY  10           HA2      GLY  10  24.086  40.930  20.226
   90    H    LYS  11           HN       LYS  11  27.154  40.826  19.722
   91    HA   LYS  11           HA       LYS  11  27.149  41.917  17.116
   92    HB2  LYS  11           HB2      LYS  11  29.049  42.063  18.774
   93    HB3  LYS  11           HB1      LYS  11  29.461  40.400  18.360
   94    HG2  LYS  11           HG2      LYS  11  29.760  41.042  16.004
   95    HG3  LYS  11           HG1      LYS  11  29.329  42.707  16.398
   96    HD2  LYS  11           HD2      LYS  11  31.257  42.852  17.927
   97    HD3  LYS  11           HD1      LYS  11  31.692  41.187  17.542
   98    HE2  LYS  11           HE2      LYS  11  31.989  41.806  15.173
   99    HE3  LYS  11           HE1      LYS  11  31.551  43.472  15.552
  100    HZ1  LYS  11           HZ1      LYS  11  33.570  42.593  17.311
  101    HZ2  LYS  11           HZ2      LYS  11  33.617  43.870  16.192
  102    HZ3  LYS  11           HZ3      LYS  11  34.062  42.301  15.714
  103    H    THR  12           HN       THR  12  25.901  40.591  15.726
  104    HA   THR  12           HA       THR  12  26.834  37.808  15.250
  105    HB   THR  12           HB       THR  12  24.445  39.330  14.166
  106    HG1  THR  12           HG1      THR  12  24.906  37.630  16.334
  107   HG21  THR  12          HG21      THR  12  25.073  37.630  12.583
  108   HG22  THR  12          HG22      THR  12  23.703  37.007  13.502
  109   HG23  THR  12          HG23      THR  12  25.337  36.453  13.871
  110    H    ILE  13           HN       ILE  13  28.160  37.355  13.554
  111    HA   ILE  13           HA       ILE  13  28.394  39.360  11.334
  112    HB   ILE  13           HB       ILE  13  30.727  38.458  11.082
  113   HG12  ILE  13          HG12      ILE  13  30.125  37.151  13.756
  114   HG13  ILE  13          HG11      ILE  13  30.270  36.282  12.227
  115   HG21  ILE  13          HG21      ILE  13  31.637  39.705  12.963
  116   HG22  ILE  13          HG22      ILE  13  30.113  39.562  13.839
  117   HG23  ILE  13          HG23      ILE  13  30.200  40.538  12.372
  118   HD11  ILE  13          HD11      ILE  13  32.421  37.856  13.661
  119   HD12  ILE  13          HD12      ILE  13  32.586  37.301  11.994
  120   HD13  ILE  13          HD13      ILE  13  32.410  36.129  13.300
  121    H    THR  14           HN       THR  14  28.779  38.422   9.207
  122    HA   THR  14           HA       THR  14  27.679  35.641   8.941
  123    HB   THR  14           HB       THR  14  27.718  37.922   6.939
  124    HG1  THR  14           HG1      THR  14  25.974  38.464   7.938
  125   HG21  THR  14          HG21      THR  14  26.663  35.092   6.843
  126   HG22  THR  14          HG22      THR  14  27.797  35.865   5.734
  127   HG23  THR  14          HG23      THR  14  26.102  36.351   5.742
  128    H    LEU  15           HN       LEU  15  29.064  34.122   8.180
  129    HA   LEU  15           HA       LEU  15  31.565  35.023   6.765
  130    HB2  LEU  15           HB2      LEU  15  31.258  32.528   8.458
  131    HB3  LEU  15           HB1      LEU  15  32.750  33.214   7.813
  132    HG   LEU  15           HG       LEU  15  30.953  34.584   9.840
  133   HD11  LEU  15          HD11      LEU  15  31.983  32.730  10.943
  134   HD12  LEU  15          HD12      LEU  15  32.965  34.136  11.351
  135   HD13  LEU  15          HD13      LEU  15  33.518  33.002  10.118
  136   HD21  LEU  15          HD21      LEU  15  32.117  36.277   8.653
  137   HD22  LEU  15          HD22      LEU  15  33.576  35.297   8.511
  138   HD23  LEU  15          HD23      LEU  15  33.123  35.987  10.070
  139    H    GLU  16           HN       GLU  16  31.411  34.454   4.653
  140    HA   GLU  16           HA       GLU  16  29.780  32.080   3.887
  141    HB2  GLU  16           HB2      GLU  16  31.112  34.119   2.082
  142    HB3  GLU  16           HB1      GLU  16  29.843  32.974   1.650
  143    HG2  GLU  16           HG2      GLU  16  28.299  34.096   3.224
  144    HG3  GLU  16           HG1      GLU  16  29.565  35.254   3.630
  145    H    VAL  17           HN       VAL  17  30.908  30.192   3.780
  146    HA   VAL  17           HA       VAL  17  33.397  30.081   2.226
  147    HB   VAL  17           HB       VAL  17  34.630  28.912   4.096
  148   HG11  VAL  17          HG11      VAL  17  34.886  31.385   3.463
  149   HG12  VAL  17          HG12      VAL  17  35.435  30.922   5.073
  150   HG13  VAL  17          HG13      VAL  17  33.884  31.735   4.872
  151   HG21  VAL  17          HG21      VAL  17  32.700  28.346   5.488
  152   HG22  VAL  17          HG22      VAL  17  32.339  30.056   5.720
  153   HG23  VAL  17          HG23      VAL  17  33.809  29.365   6.404
  154    H    GLU  18           HN       GLU  18  33.819  27.950   1.489
  155    HA   GLU  18           HA       GLU  18  31.764  26.216   0.962
  156    HB2  GLU  18           HB2      GLU  18  34.641  25.498   1.551
  157    HB3  GLU  18           HB1      GLU  18  33.485  24.410   0.782
  158    HG2  GLU  18           HG2      GLU  18  33.168  25.993  -1.056
  159    HG3  GLU  18           HG1      GLU  18  34.248  27.148  -0.274
  160    HA   PRO  19           HA       PRO  19  30.461  25.024   5.189
  161    HB2  PRO  19           HB2      PRO  19  29.306  22.795   3.529
  162    HB3  PRO  19           HB1      PRO  19  28.563  23.701   4.866
  163    HG2  PRO  19           HG2      PRO  19  27.942  24.264   2.353
  164    HG3  PRO  19           HG1      PRO  19  28.146  25.559   3.548
  165    HD2  PRO  19           HD2      PRO  19  29.960  24.772   1.308
  166    HD3  PRO  19           HD1      PRO  19  29.722  26.365   2.062
  167    H    SER  20           HN       SER  20  32.372  23.171   2.953
  168    HA   SER  20           HA       SER  20  32.828  20.943   4.796
  169    HB2  SER  20           HB2      SER  20  34.712  20.450   3.095
  170    HB3  SER  20           HB1      SER  20  33.050  20.356   2.520
  171    HG   SER  20           HG       SER  20  35.033  22.272   2.032
  172    H    ASP  21           HN       ASP  21  33.520  23.902   5.421
  173    HA   ASP  21           HA       ASP  21  36.385  24.000   5.689
  174    HB2  ASP  21           HB2      ASP  21  34.048  25.591   6.694
  175    HB3  ASP  21           HB1      ASP  21  35.598  25.816   7.491
  176    H    THR  22           HN       THR  22  37.629  23.677   7.616
  177    HA   THR  22           HA       THR  22  36.525  21.606   9.391
  178    HB   THR  22           HB       THR  22  38.807  21.485  10.285
  179    HG1  THR  22           HG1      THR  22  39.593  23.457   8.454
  180   HG21  THR  22          HG21      THR  22  38.489  20.204   8.299
  181   HG22  THR  22          HG22      THR  22  40.007  21.071   8.068
  182   HG23  THR  22          HG23      THR  22  38.537  21.642   7.280
  183    H    ILE  23           HN       ILE  23  36.268  21.865  11.652
  184    HA   ILE  23           HA       ILE  23  35.188  24.246  12.618
  185    HB   ILE  23           HB       ILE  23  36.813  22.360  14.341
  186   HG12  ILE  23          HG12      ILE  23  35.354  20.960  13.016
  187   HG13  ILE  23          HG11      ILE  23  34.618  21.128  14.605
  188   HG21  ILE  23          HG21      ILE  23  35.288  23.033  16.089
  189   HG22  ILE  23          HG22      ILE  23  34.291  23.927  14.940
  190   HG23  ILE  23          HG23      ILE  23  35.913  24.497  15.329
  191   HD11  ILE  23          HD11      ILE  23  33.805  22.428  12.011
  192   HD12  ILE  23          HD12      ILE  23  33.332  23.135  13.554
  193   HD13  ILE  23          HD13      ILE  23  32.815  21.504  13.138
  194    H    GLU  24           HN       GLU  24  38.585  23.185  13.013
  195    HA   GLU  24           HA       GLU  24  39.614  25.341  14.435
  196    HB2  GLU  24           HB2      GLU  24  41.738  24.969  13.111
  197    HB3  GLU  24           HB1      GLU  24  41.065  23.511  13.839
  198    HG2  GLU  24           HG2      GLU  24  39.957  22.975  11.679
  199    HG3  GLU  24           HG1      GLU  24  40.707  24.402  10.962
  200    H    ASN  25           HN       ASN  25  38.684  25.230  11.032
  201    HA   ASN  25           HA       ASN  25  39.842  27.762  10.296
  202    HB2  ASN  25           HB2      ASN  25  38.996  26.003   8.677
  203    HB3  ASN  25           HB1      ASN  25  37.356  26.485   9.113
  204   HD21  ASN  25          HD21      ASN  25  40.426  27.867   7.834
  205   HD22  ASN  25          HD22      ASN  25  39.670  29.084   6.925
  206    H    VAL  26           HN       VAL  26  36.652  26.784  11.518
  207    HA   VAL  26           HA       VAL  26  35.418  29.351  11.434
  208    HB   VAL  26           HB       VAL  26  35.006  27.200  13.536
  209   HG11  VAL  26          HG11      VAL  26  33.161  29.322  12.399
  210   HG12  VAL  26          HG12      VAL  26  33.932  29.384  13.983
  211   HG13  VAL  26          HG13      VAL  26  32.735  28.136  13.634
  212   HG21  VAL  26          HG21      VAL  26  33.836  27.503  10.754
  213   HG22  VAL  26          HG22      VAL  26  33.216  26.391  11.973
  214   HG23  VAL  26          HG23      VAL  26  34.848  26.180  11.336
  215    H    LYS  27           HN       LYS  27  36.810  27.698  14.279
  216    HA   LYS  27           HA       LYS  27  36.902  29.688  16.152
  217    HB2  LYS  27           HB2      LYS  27  39.130  27.763  15.414
  218    HB3  LYS  27           HB1      LYS  27  39.081  28.693  16.913
  219    HG2  LYS  27           HG2      LYS  27  36.878  27.646  17.443
  220    HG3  LYS  27           HG1      LYS  27  37.036  26.655  15.992
  221    HD2  LYS  27           HD2      LYS  27  39.131  25.693  16.862
  222    HD3  LYS  27           HD1      LYS  27  38.986  26.682  18.314
  223    HE2  LYS  27           HE2      LYS  27  36.854  25.577  18.865
  224    HE3  LYS  27           HE1      LYS  27  36.985  24.592  17.409
  225    HZ1  LYS  27           HZ1      LYS  27  39.195  23.849  18.330
  226    HZ2  LYS  27           HZ2      LYS  27  37.817  23.280  19.143
  227    HZ3  LYS  27           HZ3      LYS  27  38.728  24.554  19.799
  228    H    ALA  28           HN       ALA  28  38.818  29.542  13.223
  229    HA   ALA  28           HA       ALA  28  40.713  31.595  13.944
  230    HB1  ALA  28           HB1      ALA  28  40.816  29.856  12.014
  231    HB2  ALA  28           HB2      ALA  28  41.448  31.474  11.708
  232    HB3  ALA  28           HB3      ALA  28  39.851  31.022  11.110
  233    H    LYS  29           HN       LYS  29  37.881  31.738  11.743
  234    HA   LYS  29           HA       LYS  29  37.892  34.521  11.320
  235    HB2  LYS  29           HB2      LYS  29  35.672  32.477  11.399
  236    HB3  LYS  29           HB1      LYS  29  35.301  34.181  11.134
  237    HG2  LYS  29           HG2      LYS  29  35.563  33.089   8.975
  238    HG3  LYS  29           HG1      LYS  29  36.916  34.189   9.223
  239    HD2  LYS  29           HD2      LYS  29  38.394  32.393   9.786
  240    HD3  LYS  29           HD1      LYS  29  37.056  31.250   9.923
  241    HE2  LYS  29           HE2      LYS  29  36.611  31.427   7.528
  242    HE3  LYS  29           HE1      LYS  29  37.865  32.655   7.361
  243    HZ1  LYS  29           HZ1      LYS  29  39.503  31.139   7.506
  244    HZ2  LYS  29           HZ2      LYS  29  38.299  30.076   6.954
  245    HZ3  LYS  29           HZ3      LYS  29  38.670  30.158   8.610
  246    H    ILE  30           HN       ILE  30  36.743  32.699  14.088
  247    HA   ILE  30           HA       ILE  30  35.460  35.010  15.333
  248    HB   ILE  30           HB       ILE  30  36.401  32.511  16.760
  249   HG12  ILE  30          HG12      ILE  30  35.220  31.688  14.827
  250   HG13  ILE  30          HG11      ILE  30  34.105  31.600  16.187
  251   HG21  ILE  30          HG21      ILE  30  33.906  34.178  17.167
  252   HG22  ILE  30          HG22      ILE  30  35.428  34.545  17.977
  253   HG23  ILE  30          HG23      ILE  30  34.617  33.007  18.277
  254   HD11  ILE  30          HD11      ILE  30  32.845  32.548  14.404
  255   HD12  ILE  30          HD12      ILE  30  34.156  33.637  13.955
  256   HD13  ILE  30          HD13      ILE  30  33.261  33.905  15.451
  257    H    GLN  31           HN       GLN  31  38.225  33.052  16.391
  258    HA   GLN  31           HA       GLN  31  39.343  34.648  18.300
  259    HB2  GLN  31           HB2      GLN  31  40.263  32.475  17.600
  260    HB3  GLN  31           HB1      GLN  31  40.865  33.205  16.115
  261    HG2  GLN  31           HG2      GLN  31  42.336  34.652  17.343
  262    HG3  GLN  31           HG1      GLN  31  41.645  34.149  18.882
  263   HE21  GLN  31          HE21      GLN  31  43.712  33.286  19.649
  264   HE22  GLN  31          HE22      GLN  31  44.365  31.859  19.001
  265    H    ASP  32           HN       ASP  32  39.977  35.037  14.800
  266    HA   ASP  32           HA       ASP  32  41.673  37.354  15.192
  267    HB2  ASP  32           HB2      ASP  32  40.247  36.255  12.763
  268    HB3  ASP  32           HB1      ASP  32  41.285  37.680  12.698
  269    H    LYS  33           HN       LYS  33  38.361  37.107  13.885
  270    HA   LYS  33           HA       LYS  33  37.885  39.874  13.686
  271    HB2  LYS  33           HB2      LYS  33  35.886  37.718  14.321
  272    HB3  LYS  33           HB1      LYS  33  35.489  39.319  13.723
  273    HG2  LYS  33           HG2      LYS  33  37.412  37.573  12.184
  274    HG3  LYS  33           HG1      LYS  33  35.677  37.310  12.024
  275    HD2  LYS  33           HD2      LYS  33  36.791  40.088  11.717
  276    HD3  LYS  33           HD1      LYS  33  36.909  38.957  10.378
  277    HE2  LYS  33           HE2      LYS  33  34.264  39.375  11.763
  278    HE3  LYS  33           HE1      LYS  33  34.811  40.505  10.524
  279    HZ1  LYS  33           HZ1      LYS  33  33.615  38.906   9.363
  280    HZ2  LYS  33           HZ2      LYS  33  34.249  37.617  10.267
  281    HZ3  LYS  33           HZ3      LYS  33  35.225  38.428   9.137
  282    H    GLU  34           HN       GLU  34  37.297  37.746  16.486
  283    HA   GLU  34           HA       GLU  34  36.417  40.085  18.080
  284    HB2  GLU  34           HB2      GLU  34  36.848  37.263  19.085
  285    HB3  GLU  34           HB1      GLU  34  35.818  38.519  19.768
  286    HG2  GLU  34           HG2      GLU  34  35.404  37.158  17.091
  287    HG3  GLU  34           HG1      GLU  34  34.460  36.872  18.553
  288    H    GLY  35           HN       GLY  35  39.260  38.223  17.472
  289    HA2  GLY  35           HA3      GLY  35  41.472  38.567  18.235
  290    HA3  GLY  35           HA2      GLY  35  40.901  40.021  19.053
  291    H    ILE  36           HN       ILE  36  39.043  37.318  19.808
  292    HA   ILE  36           HA       ILE  36  40.176  37.206  22.522
  293    HB   ILE  36           HB       ILE  36  37.691  35.952  21.350
  294   HG12  ILE  36          HG12      ILE  36  38.108  38.533  22.889
  295   HG13  ILE  36          HG11      ILE  36  37.689  38.409  21.183
  296   HG21  ILE  36          HG21      ILE  36  38.440  36.525  24.224
  297   HG22  ILE  36          HG22      ILE  36  38.593  34.941  23.469
  298   HG23  ILE  36          HG23      ILE  36  37.006  35.678  23.655
  299   HD11  ILE  36          HD11      ILE  36  35.629  37.161  21.837
  300   HD12  ILE  36          HD12      ILE  36  35.665  38.821  22.428
  301   HD13  ILE  36          HD13      ILE  36  36.022  37.488  23.524
  302    HA   PRO  37           HA       PRO  37  42.164  33.324  21.369
  303    HB2  PRO  37           HB2      PRO  37  42.939  32.439  23.826
  304    HB3  PRO  37           HB1      PRO  37  43.729  33.805  23.012
  305    HG2  PRO  37           HG2      PRO  37  41.646  33.834  25.155
  306    HG3  PRO  37           HG1      PRO  37  43.112  34.822  24.999
  307    HD2  PRO  37           HD2      PRO  37  40.631  35.743  24.295
  308    HD3  PRO  37           HD1      PRO  37  42.119  36.297  23.500
  309    HA   PRO  38           HA       PRO  38  38.604  30.503  21.520
  310    HB2  PRO  38           HB2      PRO  38  40.918  28.604  21.442
  311    HB3  PRO  38           HB1      PRO  38  39.349  28.485  20.614
  312    HG2  PRO  38           HG2      PRO  38  41.429  29.374  19.305
  313    HG3  PRO  38           HG1      PRO  38  39.871  30.182  19.113
  314    HD2  PRO  38           HD2      PRO  38  42.310  31.123  20.567
  315    HD3  PRO  38           HD1      PRO  38  41.027  32.072  19.779
  316    H    ASP  39           HN       ASP  39  41.453  29.910  23.547
  317    HA   ASP  39           HA       ASP  39  40.456  28.071  25.379
  318    HB2  ASP  39           HB2      ASP  39  42.767  28.978  25.427
  319    HB3  ASP  39           HB1      ASP  39  42.135  30.492  26.076
  320    H    GLN  40           HN       GLN  40  40.001  31.593  25.473
  321    HA   GLN  40           HA       GLN  40  38.256  31.402  27.820
  322    HB2  GLN  40           HB2      GLN  40  38.910  33.737  25.999
  323    HB3  GLN  40           HB1      GLN  40  38.046  33.842  27.531
  324    HG2  GLN  40           HG2      GLN  40  40.021  32.868  28.687
  325    HG3  GLN  40           HG1      GLN  40  40.889  32.867  27.151
  326   HE21  GLN  40          HE21      GLN  40  39.608  34.955  29.709
  327   HE22  GLN  40          HE22      GLN  40  40.389  36.370  29.188
  328    H    GLN  41           HN       GLN  41  37.710  30.504  24.759
  329    HA   GLN  41           HA       GLN  41  34.827  31.335  24.862
  330    HB2  GLN  41           HB2      GLN  41  36.568  31.244  22.382
  331    HB3  GLN  41           HB1      GLN  41  34.844  31.608  22.419
  332    HG2  GLN  41           HG2      GLN  41  35.301  33.568  23.861
  333    HG3  GLN  41           HG1      GLN  41  37.028  33.217  23.773
  334   HE21  GLN  41          HE21      GLN  41  34.534  34.967  22.261
  335   HE22  GLN  41          HE22      GLN  41  35.318  35.284  20.790
  336    H    ARG  42           HN       ARG  42  33.376  29.757  24.264
  337    HA   ARG  42           HA       ARG  42  34.423  27.170  23.200
  338    HB2  ARG  42           HB2      ARG  42  32.680  27.629  25.636
  339    HB3  ARG  42           HB1      ARG  42  32.632  26.104  24.757
  340    HG2  ARG  42           HG2      ARG  42  35.294  27.225  25.624
  341    HG3  ARG  42           HG1      ARG  42  34.282  26.389  26.801
  342    HD2  ARG  42           HD2      ARG  42  34.174  24.425  25.256
  343    HD3  ARG  42           HD1      ARG  42  35.291  25.253  24.173
  344    HE   ARG  42           HE       ARG  42  36.509  25.219  26.716
  345   HH11  ARG  42          HH11      ARG  42  38.026  23.617  27.216
  346   HH12  ARG  42          HH12      ARG  42  38.024  22.132  26.323
  347   HH21  ARG  42          HH21      ARG  42  35.357  23.044  24.304
  348   HH22  ARG  42          HH22      ARG  42  36.512  21.809  24.675
  349    H    LEU  43           HN       LEU  43  33.145  26.515  21.471
  350    HA   LEU  43           HA       LEU  43  30.816  28.203  20.856
  351    HB2  LEU  43           HB2      LEU  43  31.556  25.918  19.059
  352    HB3  LEU  43           HB1      LEU  43  31.001  27.555  18.655
  353    HG   LEU  43           HG       LEU  43  33.349  28.226  19.801
  354   HD11  LEU  43          HD11      LEU  43  34.986  26.628  19.798
  355   HD12  LEU  43          HD12      LEU  43  34.296  25.744  18.438
  356   HD13  LEU  43          HD13      LEU  43  33.614  25.553  20.051
  357   HD21  LEU  43          HD21      LEU  43  32.636  28.766  17.490
  358   HD22  LEU  43          HD22      LEU  43  33.110  27.149  16.970
  359   HD23  LEU  43          HD23      LEU  43  34.330  28.284  17.549
  360    H    ILE  44           HN       ILE  44  28.774  27.498  20.647
  361    HA   ILE  44           HA       ILE  44  28.094  24.742  21.647
  362    HB   ILE  44           HB       ILE  44  26.610  27.341  22.173
  363   HG12  ILE  44          HG12      ILE  44  28.650  27.203  23.510
  364   HG13  ILE  44          HG11      ILE  44  27.252  26.934  24.543
  365   HG21  ILE  44          HG21      ILE  44  25.035  25.496  22.008
  366   HG22  ILE  44          HG22      ILE  44  25.252  25.862  23.722
  367   HG23  ILE  44          HG23      ILE  44  26.066  24.470  23.007
  368   HD11  ILE  44          HD11      ILE  44  27.754  24.371  23.938
  369   HD12  ILE  44          HD12      ILE  44  28.592  25.191  25.250
  370   HD13  ILE  44          HD13      ILE  44  29.373  25.013  23.683
  371    H    PHE  45           HN       PHE  45  26.658  23.618  20.340
  372    HA   PHE  45           HA       PHE  45  24.917  25.100  18.481
  373    HB2  PHE  45           HB2      PHE  45  26.856  24.901  17.098
  374    HB3  PHE  45           HB1      PHE  45  27.154  23.247  17.625
  375    HD1  PHE  45           HD1      PHE  45  24.728  25.396  15.774
  376    HD2  PHE  45           HD2      PHE  45  26.170  21.420  16.500
  377    HE1  PHE  45           HE1      PHE  45  23.331  24.551  13.905
  378    HE2  PHE  45           HE2      PHE  45  24.775  20.570  14.630
  379    HZ   PHE  45           HZ       PHE  45  23.355  22.137  13.333
  380    H    ALA  46           HN       ALA  46  22.976  24.131  18.696
  381    HA   ALA  46           HA       ALA  46  21.354  22.503  19.152
  382    HB1  ALA  46           HB1      ALA  46  21.896  20.236  18.112
  383    HB2  ALA  46           HB2      ALA  46  23.445  20.932  17.636
  384    HB3  ALA  46           HB3      ALA  46  21.942  21.617  17.017
  385    H    GLY  47           HN       GLY  47  23.458  22.935  21.242
  386    HA2  GLY  47           HA3      GLY  47  23.698  21.985  23.395
  387    HA3  GLY  47           HA2      GLY  47  22.799  20.573  22.839
  388    H    LYS  48           HN       LYS  48  25.210  21.226  20.620
  389    HA   LYS  48           HA       LYS  48  27.162  19.389  21.970
  390    HB2  LYS  48           HB2      LYS  48  26.522  19.459  19.032
  391    HB3  LYS  48           HB1      LYS  48  27.589  18.325  19.845
  392    HG2  LYS  48           HG2      LYS  48  24.633  18.591  20.463
  393    HG3  LYS  48           HG1      LYS  48  25.288  17.411  19.332
  394    HD2  LYS  48           HD2      LYS  48  26.818  16.663  21.276
  395    HD3  LYS  48           HD1      LYS  48  25.736  17.590  22.315
  396    HE2  LYS  48           HE2      LYS  48  25.012  15.253  22.240
  397    HE3  LYS  48           HE1      LYS  48  23.812  16.280  21.456
  398    HZ1  LYS  48           HZ1      LYS  48  25.957  14.820  20.016
  399    HZ2  LYS  48           HZ2      LYS  48  24.669  15.685  19.323
  400    HZ3  LYS  48           HZ3      LYS  48  24.367  14.253  20.186
  401    H    GLN  49           HN       GLN  49  29.391  19.861  21.533
  402    HA   GLN  49           HA       GLN  49  29.857  22.599  20.523
  403    HB2  GLN  49           HB2      GLN  49  31.813  20.834  21.939
  404    HB3  GLN  49           HB1      GLN  49  31.880  22.580  21.756
  405    HG2  GLN  49           HG2      GLN  49  29.819  22.777  23.128
  406    HG3  GLN  49           HG1      GLN  49  29.822  21.029  23.355
  407   HE21  GLN  49          HE21      GLN  49  30.953  20.290  25.161
  408   HE22  GLN  49          HE22      GLN  49  32.126  21.182  26.003
  409    H    LEU  50           HN       LEU  50  31.948  22.865  19.238
  410    HA   LEU  50           HA       LEU  50  32.219  20.597  17.295
  411    HB2  LEU  50           HB2      LEU  50  33.060  23.476  16.885
  412    HB3  LEU  50           HB1      LEU  50  32.842  22.226  15.661
  413    HG   LEU  50           HG       LEU  50  30.640  23.410  17.379
  414   HD11  LEU  50          HD11      LEU  50  29.879  24.462  15.316
  415   HD12  LEU  50          HD12      LEU  50  31.182  23.694  14.408
  416   HD13  LEU  50          HD13      LEU  50  31.555  24.927  15.613
  417   HD21  LEU  50          HD21      LEU  50  30.707  21.238  15.274
  418   HD22  LEU  50          HD22      LEU  50  29.229  22.133  15.621
  419   HD23  LEU  50          HD23      LEU  50  29.997  21.178  16.887
  420    H    GLU  51           HN       GLU  51  34.142  19.521  17.325
  421    HA   GLU  51           HA       GLU  51  36.357  20.614  18.973
  422    HB2  GLU  51           HB2      GLU  51  36.045  17.918  17.616
  423    HB3  GLU  51           HB1      GLU  51  37.324  18.364  18.746
  424    HG2  GLU  51           HG2      GLU  51  34.367  18.400  19.410
  425    HG3  GLU  51           HG1      GLU  51  35.467  17.090  19.836
  426    H    ASP  52           HN       ASP  52  38.567  20.599  18.089
  427    HA   ASP  52           HA       ASP  52  38.758  21.878  15.549
  428    HB2  ASP  52           HB2      ASP  52  41.243  21.344  15.794
  429    HB3  ASP  52           HB1      ASP  52  40.520  22.245  17.127
  430    H    GLY  53           HN       GLY  53  39.664  21.055  13.555
  431    HA2  GLY  53           HA3      GLY  53  40.206  19.376  11.972
  432    HA3  GLY  53           HA2      GLY  53  40.073  18.168  13.251
  433    H    ARG  54           HN       ARG  54  38.936  17.211  11.173
  434    HA   ARG  54           HA       ARG  54  36.951  16.463  10.188
  435    HB2  ARG  54           HB2      ARG  54  35.793  17.433  12.821
  436    HB3  ARG  54           HB1      ARG  54  34.973  16.377  11.673
  437    HG2  ARG  54           HG2      ARG  54  36.811  14.723  11.911
  438    HG3  ARG  54           HG1      ARG  54  37.569  15.766  13.115
  439    HD2  ARG  54           HD2      ARG  54  35.572  15.590  14.543
  440    HD3  ARG  54           HD1      ARG  54  34.790  14.569  13.336
  441    HE   ARG  54           HE       ARG  54  37.301  13.404  14.047
  442   HH11  ARG  54          HH11      ARG  54  37.293  11.635  15.453
  443   HH12  ARG  54          HH12      ARG  54  35.911  11.350  16.458
  444   HH21  ARG  54          HH21      ARG  54  34.153  14.094  15.272
  445   HH22  ARG  54          HH22      ARG  54  34.134  12.743  16.355
  446    H    THR  55           HN       THR  55  34.974  17.202   9.137
  447    HA   THR  55           HA       THR  55  34.703  20.192   9.040
  448    HB   THR  55           HB       THR  55  34.148  19.959   6.670
  449    HG1  THR  55           HG1      THR  55  33.786  18.069   5.798
  450   HG21  THR  55          HG21      THR  55  36.690  18.576   7.543
  451   HG22  THR  55          HG22      THR  55  36.486  20.265   7.076
  452   HG23  THR  55          HG23      THR  55  36.356  18.992   5.862
  453    H    LEU  56           HN       LEU  56  32.415  20.687   7.981
  454    HA   LEU  56           HA       LEU  56  30.424  19.722   9.780
  455    HB2  LEU  56           HB2      LEU  56  30.311  21.177   7.138
  456    HB3  LEU  56           HB1      LEU  56  28.827  20.645   7.922
  457    HG   LEU  56           HG       LEU  56  29.525  21.870   9.988
  458   HD11  LEU  56          HD11      LEU  56  31.798  22.725   8.180
  459   HD12  LEU  56          HD12      LEU  56  31.913  21.945   9.753
  460   HD13  LEU  56          HD13      LEU  56  31.349  23.609   9.634
  461   HD21  LEU  56          HD21      LEU  56  28.006  22.959   8.434
  462   HD22  LEU  56          HD22      LEU  56  29.352  23.464   7.414
  463   HD23  LEU  56          HD23      LEU  56  29.158  24.157   9.023
  464    H    SER  57           HN       SER  57  31.330  18.705   6.498
  465    HA   SER  57           HA       SER  57  29.218  16.783   6.162
  466    HB2  SER  57           HB2      SER  57  32.032  16.844   5.026
  467    HB3  SER  57           HB1      SER  57  30.775  15.728   4.500
  468    HG   SER  57           HG       SER  57  29.556  17.906   4.319
  469    H    ASP  58           HN       ASP  58  32.542  16.508   7.373
  470    HA   ASP  58           HA       ASP  58  32.586  13.756   7.978
  471    HB2  ASP  58           HB2      ASP  58  34.529  15.334   8.212
  472    HB3  ASP  58           HB1      ASP  58  33.790  15.949   9.693
  473    H    TYR  59           HN       TYR  59  31.179  16.450   9.804
  474    HA   TYR  59           HA       TYR  59  30.428  14.763  12.064
  475    HB2  TYR  59           HB2      TYR  59  29.732  17.584  11.223
  476    HB3  TYR  59           HB1      TYR  59  28.962  16.818  12.612
  477    HD1  TYR  59           HD1      TYR  59  31.690  18.812  11.624
  478    HD2  TYR  59           HD2      TYR  59  30.672  15.570  14.253
  479    HE1  TYR  59           HE1      TYR  59  33.669  19.327  13.026
  480    HE2  TYR  59           HE2      TYR  59  32.649  16.089  15.657
  481    HH   TYR  59           HH       TYR  59  34.178  17.792  16.120
  482    H    ASN  60           HN       ASN  60  29.259  15.124   8.931
  483    HA   ASN  60           HA       ASN  60  27.408  14.147   7.893
  484    HB2  ASN  60           HB2      ASN  60  27.689  12.498   9.944
  485    HB3  ASN  60           HB1      ASN  60  26.239  13.302  10.539
  486   HD21  ASN  60          HD21      ASN  60  24.728  11.602  10.160
  487   HD22  ASN  60          HD22      ASN  60  24.374  11.006   8.612
  488    H    ILE  61           HN       ILE  61  27.433  16.894   8.707
  489    HA   ILE  61           HA       ILE  61  24.679  17.441   9.672
  490    HB   ILE  61           HB       ILE  61  26.978  19.287   8.949
  491   HG12  ILE  61          HG12      ILE  61  25.746  18.676  11.651
  492   HG13  ILE  61          HG11      ILE  61  27.173  17.844  11.033
  493   HG21  ILE  61          HG21      ILE  61  25.490  20.980  10.155
  494   HG22  ILE  61          HG22      ILE  61  24.182  19.811   9.976
  495   HG23  ILE  61          HG23      ILE  61  24.954  20.495   8.547
  496   HD11  ILE  61          HD11      ILE  61  26.910  20.836  11.461
  497   HD12  ILE  61          HD12      ILE  61  28.328  20.023  10.796
  498   HD13  ILE  61          HD13      ILE  61  27.842  19.725  12.465
  499    H    GLN  62           HN       GLN  62  23.038  17.780   8.237
  500    HA   GLN  62           HA       GLN  62  23.619  18.955   5.583
  501    HB2  GLN  62           HB2      GLN  62  23.895  16.538   5.207
  502    HB3  GLN  62           HB1      GLN  62  22.305  16.238   5.910
  503    HG2  GLN  62           HG2      GLN  62  21.212  17.457   4.136
  504    HG3  GLN  62           HG1      GLN  62  22.760  18.018   3.500
  505   HE21  GLN  62          HE21      GLN  62  20.394  15.653   3.064
  506   HE22  GLN  62          HE22      GLN  62  21.325  14.510   2.223
  507    H    LYS  63           HN       LYS  63  21.078  17.444   7.615
  508    HA   LYS  63           HA       LYS  63  18.915  18.867   6.385
  509    HB2  LYS  63           HB2      LYS  63  18.853  16.801   7.968
  510    HB3  LYS  63           HB1      LYS  63  18.917  17.980   9.274
  511    HG2  LYS  63           HG2      LYS  63  16.610  17.757   9.007
  512    HG3  LYS  63           HG1      LYS  63  16.928  19.124   7.944
  513    HD2  LYS  63           HD2      LYS  63  16.986  17.637   5.997
  514    HD3  LYS  63           HD1      LYS  63  16.784  16.228   7.039
  515    HE2  LYS  63           HE2      LYS  63  14.791  18.500   6.779
  516    HE3  LYS  63           HE1      LYS  63  14.637  16.922   6.003
  517    HZ1  LYS  63           HZ1      LYS  63  14.803  17.399   8.931
  518    HZ2  LYS  63           HZ2      LYS  63  14.645  15.884   8.179
  519    HZ3  LYS  63           HZ3      LYS  63  13.389  17.023   8.071
  520    H    GLU  64           HN       GLU  64  21.455  19.997   8.255
  521    HA   GLU  64           HA       GLU  64  19.934  22.148   9.592
  522    HB2  GLU  64           HB2      GLU  64  22.930  21.711   9.403
  523    HB3  GLU  64           HB1      GLU  64  22.102  22.828  10.489
  524    HG2  GLU  64           HG2      GLU  64  21.681  19.826  10.482
  525    HG3  GLU  64           HG1      GLU  64  22.737  20.681  11.605
  526    H    SEP  65           HN       SEP  65  19.167  22.829   7.323
  527    HA   SEP  65           HA       SEP  65  20.786  23.884   5.313
  528    HB2  SEP  65           HB1      SEP  65  18.907  25.501   4.883
  529    HB3  SEP  65           HB2      SEP  65  18.163  24.958   6.384
  530    H    TPO  66           HN       TPO  66  19.163  26.223   7.431
  531    HA   TPO  66           HA       TPO  66  21.277  28.149   7.133
  532    HB   TPO  66           HB       TPO  66  20.037  29.497   8.685
  533   HG21  TPO  66          HG21      TPO  66  17.779  29.379   7.774
  534   HG22  TPO  66          HG22      TPO  66  18.056  27.722   7.234
  535   HG23  TPO  66          HG23      TPO  66  18.944  29.053   6.490
  536    H    LEU  67           HN       LEU  67  23.277  27.426   7.856
  537    HA   LEU  67           HA       LEU  67  23.558  26.015  10.400
  538    HB2  LEU  67           HB2      LEU  67  25.682  27.281   8.643
  539    HB3  LEU  67           HB1      LEU  67  25.965  26.119   9.937
  540    HG   LEU  67           HG       LEU  67  24.183  25.501   7.567
  541   HD11  LEU  67          HD11      LEU  67  27.168  25.130   7.897
  542   HD12  LEU  67          HD12      LEU  67  26.319  25.960   6.591
  543   HD13  LEU  67          HD13      LEU  67  26.216  24.205   6.737
  544   HD21  LEU  67          HD21      LEU  67  25.546  23.860   9.723
  545   HD22  LEU  67          HD22      LEU  67  24.908  23.135   8.251
  546   HD23  LEU  67          HD23      LEU  67  23.823  23.961   9.365
  547    H    HIS  68           HN       HIS  68  23.463  27.063  12.309
  548    HA   HIS  68           HA       HIS  68  24.592  29.842  12.496
  549    HB2  HIS  68           HB2      HIS  68  22.798  30.414  14.054
  550    HB3  HIS  68           HB1      HIS  68  22.097  29.864  12.531
  551    HD1  HIS  68           HD1      HIS  68  21.267  27.299  12.500
  552    HD2  HIS  68           HD2      HIS  68  22.055  28.894  16.272
  553    HE1  HIS  68           HE1      HIS  68  20.165  25.750  14.176
  554    HE2  HIS  68           HE2      HIS  68  20.639  26.713  16.477
  555    H    LEU  69           HN       LEU  69  25.978  30.139  14.173
  556    HA   LEU  69           HA       LEU  69  26.183  27.993  16.271
  557    HB2  LEU  69           HB2      LEU  69  28.500  29.609  15.170
  558    HB3  LEU  69           HB1      LEU  69  28.578  28.198  16.221
  559    HG   LEU  69           HG       LEU  69  27.468  28.145  13.398
  560   HD11  LEU  69          HD11      LEU  69  29.578  27.107  12.754
  561   HD12  LEU  69          HD12      LEU  69  30.167  27.207  14.412
  562   HD13  LEU  69          HD13      LEU  69  29.906  28.680  13.478
  563   HD21  LEU  69          HD21      LEU  69  26.564  26.335  14.672
  564   HD22  LEU  69          HD22      LEU  69  28.104  26.037  15.476
  565   HD23  LEU  69          HD23      LEU  69  27.912  25.647  13.768
  566    H    VAL  70           HN       VAL  70  27.035  28.827  18.358
  567    HA   VAL  70           HA       VAL  70  26.837  31.795  18.667
  568    HB   VAL  70           HB       VAL  70  25.423  31.608  20.592
  569   HG11  VAL  70          HG11      VAL  70  23.408  30.533  19.640
  570   HG12  VAL  70          HG12      VAL  70  24.412  29.740  18.425
  571   HG13  VAL  70          HG13      VAL  70  24.255  31.497  18.430
  572   HG21  VAL  70          HG21      VAL  70  25.985  28.652  20.328
  573   HG22  VAL  70          HG22      VAL  70  24.587  29.235  21.231
  574   HG23  VAL  70          HG23      VAL  70  26.215  29.687  21.734
  575    H    LEU  71           HN       LEU  71  28.605  32.525  19.679
  576    HA   LEU  71           HA       LEU  71  30.485  30.631  20.899
  577    HB2  LEU  71           HB2      LEU  71  30.535  33.612  20.397
  578    HB3  LEU  71           HB1      LEU  71  31.801  32.808  21.320
  579    HG   LEU  71           HG       LEU  71  32.351  33.071  18.889
  580   HD11  LEU  71          HD11      LEU  71  33.038  31.034  20.466
  581   HD12  LEU  71          HD12      LEU  71  33.448  31.038  18.753
  582   HD13  LEU  71          HD13      LEU  71  32.061  30.114  19.319
  583   HD21  LEU  71          HD21      LEU  71  29.889  32.680  18.221
  584   HD22  LEU  71          HD22      LEU  71  30.255  30.961  18.372
  585   HD23  LEU  71          HD23      LEU  71  31.128  31.947  17.202
  586    H    ARG  72           HN       ARG  72  31.117  30.639  23.113
  587    HA   ARG  72           HA       ARG  72  29.262  32.092  24.975
  588    HB2  ARG  72           HB2      ARG  72  28.885  29.622  24.916
  589    HB3  ARG  72           HB1      ARG  72  30.576  29.378  25.352
  590    HG2  ARG  72           HG2      ARG  72  30.276  30.408  27.486
  591    HG3  ARG  72           HG1      ARG  72  28.690  31.039  27.037
  592    HD2  ARG  72           HD2      ARG  72  27.742  28.823  26.992
  593    HD3  ARG  72           HD1      ARG  72  29.332  28.081  27.177
  594    HE   ARG  72           HE       ARG  72  27.726  29.266  29.321
  595   HH11  ARG  72          HH11      ARG  72  28.609  29.061  31.394
  596   HH12  ARG  72          HH12      ARG  72  30.265  28.585  31.571
  597   HH21  ARG  72          HH21      ARG  72  30.834  28.340  28.159
  598   HH22  ARG  72          HH22      ARG  72  31.525  28.177  29.738
  599    H    LEU  73           HN       LEU  73  30.350  32.498  27.148
  600    HA   LEU  73           HA       LEU  73  33.277  33.048  26.762
  601    HB2  LEU  73           HB2      LEU  73  31.393  34.401  28.709
  602    HB3  LEU  73           HB1      LEU  73  33.016  34.915  28.246
  603    HG   LEU  73           HG       LEU  73  30.622  34.785  26.387
  604   HD11  LEU  73          HD11      LEU  73  30.622  37.196  26.485
  605   HD12  LEU  73          HD12      LEU  73  32.096  37.209  27.453
  606   HD13  LEU  73          HD13      LEU  73  30.591  36.602  28.144
  607   HD21  LEU  73          HD21      LEU  73  33.529  35.524  26.012
  608   HD22  LEU  73          HD22      LEU  73  32.282  36.175  24.948
  609   HD23  LEU  73          HD23      LEU  73  32.538  34.435  25.041
  610    H    ARG  74           HN       ARG  74  34.691  32.282  28.324
  611    HA   ARG  74           HA       ARG  74  33.706  31.276  30.890
  612    HB2  ARG  74           HB2      ARG  74  33.189  29.389  29.358
  613    HB3  ARG  74           HB1      ARG  74  34.886  29.336  28.876
  614    HG2  ARG  74           HG2      ARG  74  35.578  28.777  31.124
  615    HG3  ARG  74           HG1      ARG  74  33.945  29.031  31.740
  616    HD2  ARG  74           HD2      ARG  74  33.116  27.158  30.397
  617    HD3  ARG  74           HD1      ARG  74  34.720  26.925  29.700
  618    HE   ARG  74           HE       ARG  74  35.071  26.756  32.476
  619   HH11  ARG  74          HH11      ARG  74  35.054  24.753  33.526
  620   HH12  ARG  74          HH12      ARG  74  34.249  23.410  32.785
  621   HH21  ARG  74          HH21      ARG  74  33.248  25.208  29.994
  622   HH22  ARG  74          HH22      ARG  74  33.226  23.667  30.786
  623    H    GLY  75           HN       GLY  75  35.416  31.019  32.381
  624    HA2  GLY  75           HA3      GLY  75  37.661  31.035  33.142
  625    HA3  GLY  75           HA2      GLY  75  38.201  31.096  31.463
  626    H    GLY  76           HN       GLY  76  35.844  33.414  31.849
  627    HA2  GLY  76           HA3      GLY  76  37.575  35.613  31.438
  628    HA3  GLY  76           HA2      GLY  76  35.921  35.753  32.038
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1  29.121  27.433   2.332
    2    H2   MET   1           HT2      MET   1  27.626  27.983   2.924
    3    H3   MET   1           HT3      MET   1  29.039  28.205   3.840
    4    HA   MET   1           HA       MET   1  29.924  29.713   2.186
    5    HB2  MET   1           HB2      MET   1  27.257  29.242   0.817
    6    HB3  MET   1           HB1      MET   1  28.485  30.398   0.304
    7    HG2  MET   1           HG2      MET   1  30.085  28.572  -0.058
    8    HG3  MET   1           HG1      MET   1  28.894  27.400   0.505
    9    HE1  MET   1           HE1      MET   1  28.945  25.930  -1.614
   10    HE2  MET   1           HE2      MET   1  30.309  26.945  -2.073
   11    HE3  MET   1           HE3      MET   1  29.046  26.594  -3.251
   12    H    GLN   2           HN       GLN   2  27.604  29.316   4.424
   13    HA   GLN   2           HA       GLN   2  27.399  32.193   4.924
   14    HB2  GLN   2           HB2      GLN   2  24.836  32.016   5.064
   15    HB3  GLN   2           HB1      GLN   2  25.538  32.099   3.448
   16    HG2  GLN   2           HG2      GLN   2  25.400  29.667   3.225
   17    HG3  GLN   2           HG1      GLN   2  24.779  29.532   4.870
   18   HE21  GLN   2          HE21      GLN   2  22.548  29.276   4.891
   19   HE22  GLN   2          HE22      GLN   2  21.472  29.972   3.779
   20    H    ILE   3           HN       ILE   3  28.672  30.881   6.672
   21    HA   ILE   3           HA       ILE   3  27.004  29.387   8.564
   22    HB   ILE   3           HB       ILE   3  29.884  30.338   8.640
   23   HG12  ILE   3          HG12      ILE   3  30.287  27.851   8.567
   24   HG13  ILE   3          HG11      ILE   3  28.553  27.623   8.348
   25   HG21  ILE   3          HG21      ILE   3  29.207  30.326  10.928
   26   HG22  ILE   3          HG22      ILE   3  30.001  28.774  10.666
   27   HG23  ILE   3          HG23      ILE   3  28.240  28.867  10.711
   28   HD11  ILE   3          HD11      ILE   3  30.119  27.717   6.243
   29   HD12  ILE   3          HD12      ILE   3  30.055  29.461   6.492
   30   HD13  ILE   3          HD13      ILE   3  28.570  28.554   6.203
   31    H    PHE   4           HN       PHE   4  25.692  30.416   9.984
   32    HA   PHE   4           HA       PHE   4  26.086  33.280  10.560
   33    HB2  PHE   4           HB2      PHE   4  23.970  31.271  11.368
   34    HB3  PHE   4           HB1      PHE   4  23.974  32.943  11.928
   35    HD1  PHE   4           HD1      PHE   4  23.503  30.717   9.042
   36    HD2  PHE   4           HD2      PHE   4  23.611  34.802  10.365
   37    HE1  PHE   4           HE1      PHE   4  22.437  31.432   6.921
   38    HE2  PHE   4           HE2      PHE   4  22.542  35.516   8.243
   39    HZ   PHE   4           HZ       PHE   4  21.956  33.831   6.521
   40    H    VAL   5           HN       VAL   5  26.493  34.110  12.657
   41    HA   VAL   5           HA       VAL   5  27.132  32.167  14.820
   42    HB   VAL   5           HB       VAL   5  29.083  34.283  13.887
   43   HG11  VAL   5          HG11      VAL   5  29.195  33.925  16.288
   44   HG12  VAL   5          HG12      VAL   5  30.586  33.145  15.535
   45   HG13  VAL   5          HG13      VAL   5  29.207  32.177  16.059
   46   HG21  VAL   5          HG21      VAL   5  30.495  32.201  13.398
   47   HG22  VAL   5          HG22      VAL   5  29.163  32.516  12.285
   48   HG23  VAL   5          HG23      VAL   5  28.994  31.284  13.535
   49    H    LYS   6           HN       LYS   6  25.698  32.940  16.342
   50    HA   LYS   6           HA       LYS   6  25.352  35.877  16.638
   51    HB2  LYS   6           HB2      LYS   6  23.910  33.516  17.882
   52    HB3  LYS   6           HB1      LYS   6  23.531  35.206  18.220
   53    HG2  LYS   6           HG2      LYS   6  22.849  35.612  15.976
   54    HG3  LYS   6           HG1      LYS   6  23.572  34.110  15.404
   55    HD2  LYS   6           HD2      LYS   6  21.167  33.798  15.550
   56    HD3  LYS   6           HD1      LYS   6  21.934  32.845  16.820
   57    HE2  LYS   6           HE2      LYS   6  21.347  34.428  18.504
   58    HE3  LYS   6           HE1      LYS   6  20.917  35.650  17.308
   59    HZ1  LYS   6           HZ1      LYS   6  19.472  33.182  17.015
   60    HZ2  LYS   6           HZ2      LYS   6  18.897  34.780  17.043
   61    HZ3  LYS   6           HZ3      LYS   6  19.185  33.951  18.498
   62    H    THR   7           HN       THR   7  26.566  36.932  18.126
   63    HA   THR   7           HA       THR   7  28.092  35.412  20.130
   64    HB   THR   7           HB       THR   7  29.068  37.616  20.688
   65    HG1  THR   7           HG1      THR   7  27.652  39.151  20.365
   66   HG21  THR   7          HG21      THR   7  29.941  38.131  18.340
   67   HG22  THR   7          HG22      THR   7  28.862  36.859  17.770
   68   HG23  THR   7          HG23      THR   7  30.157  36.474  18.903
   69    H    LEU   8           HN       LEU   8  28.071  36.264  22.444
   70    HA   LEU   8           HA       LEU   8  25.400  36.109  23.493
   71    HB2  LEU   8           HB2      LEU   8  27.362  35.342  24.771
   72    HB3  LEU   8           HB1      LEU   8  27.978  36.991  24.833
   73    HG   LEU   8           HG       LEU   8  25.995  37.696  26.120
   74   HD11  LEU   8          HD11      LEU   8  24.601  35.665  27.052
   75   HD12  LEU   8          HD12      LEU   8  25.160  34.848  25.592
   76   HD13  LEU   8          HD13      LEU   8  24.208  36.328  25.467
   77   HD21  LEU   8          HD21      LEU   8  26.463  36.300  28.178
   78   HD22  LEU   8          HD22      LEU   8  27.900  36.972  27.409
   79   HD23  LEU   8          HD23      LEU   8  27.483  35.274  27.171
   80    H    THR   9           HN       THR   9  27.599  38.807  22.849
   81    HA   THR   9           HA       THR   9  25.853  40.772  24.115
   82    HB   THR   9           HB       THR   9  28.136  41.200  22.163
   83    HG1  THR   9           HG1      THR   9  28.526  40.032  24.219
   84   HG21  THR   9          HG21      THR   9  28.215  43.403  23.542
   85   HG22  THR   9          HG22      THR   9  26.557  43.005  23.990
   86   HG23  THR   9          HG23      THR   9  26.981  43.242  22.294
   87    H    GLY  10           HN       GLY  10  25.516  38.997  21.355
   88    HA2  GLY  10           HA3      GLY  10  23.683  39.270  19.817
   89    HA3  GLY  10           HA2      GLY  10  23.642  40.993  20.197
   90    H    LYS  11           HN       LYS  11  26.731  40.853  19.910
   91    HA   LYS  11           HA       LYS  11  26.951  41.976  17.337
   92    HB2  LYS  11           HB2      LYS  11  28.719  41.918  19.196
   93    HB3  LYS  11           HB1      LYS  11  29.147  40.317  18.595
   94    HG2  LYS  11           HG2      LYS  11  29.344  41.432  16.278
   95    HG3  LYS  11           HG1      LYS  11  29.333  42.964  17.152
   96    HD2  LYS  11           HD2      LYS  11  31.295  40.691  17.588
   97    HD3  LYS  11           HD1      LYS  11  31.643  42.209  16.760
   98    HE2  LYS  11           HE2      LYS  11  30.997  41.794  19.684
   99    HE3  LYS  11           HE1      LYS  11  32.449  42.504  18.983
  100    HZ1  LYS  11           HZ1      LYS  11  31.006  44.293  18.086
  101    HZ2  LYS  11           HZ2      LYS  11  31.083  44.257  19.784
  102    HZ3  LYS  11           HZ3      LYS  11  29.714  43.651  18.978
  103    H    THR  12           HN       THR  12  26.050  40.897  15.611
  104    HA   THR  12           HA       THR  12  26.528  37.988  15.291
  105    HB   THR  12           HB       THR  12  24.894  39.935  13.633
  106    HG1  THR  12           HG1      THR  12  24.060  37.909  15.427
  107   HG21  THR  12          HG21      THR  12  23.880  37.727  12.816
  108   HG22  THR  12          HG22      THR  12  25.300  36.944  13.512
  109   HG23  THR  12          HG23      THR  12  25.490  38.122  12.214
  110    H    ILE  13           HN       ILE  13  27.534  37.117  13.431
  111    HA   ILE  13           HA       ILE  13  28.850  38.949  11.531
  112    HB   ILE  13           HB       ILE  13  31.074  37.951  11.854
  113   HG12  ILE  13          HG12      ILE  13  29.734  36.495  14.153
  114   HG13  ILE  13          HG11      ILE  13  30.408  35.758  12.695
  115   HG21  ILE  13          HG21      ILE  13  31.647  39.111  13.865
  116   HG22  ILE  13          HG22      ILE  13  30.033  38.881  14.539
  117   HG23  ILE  13          HG23      ILE  13  30.274  39.980  13.181
  118   HD11  ILE  13          HD11      ILE  13  32.635  36.807  13.345
  119   HD12  ILE  13          HD12      ILE  13  32.075  35.503  14.392
  120   HD13  ILE  13          HD13      ILE  13  31.902  37.182  14.905
  121    H    THR  14           HN       THR  14  29.360  37.860   9.543
  122    HA   THR  14           HA       THR  14  28.336  35.038   9.349
  123    HB   THR  14           HB       THR  14  27.493  35.617   7.110
  124    HG1  THR  14           HG1      THR  14  27.450  38.138   6.979
  125   HG21  THR  14          HG21      THR  14  25.929  35.865   8.942
  126   HG22  THR  14          HG22      THR  14  25.697  37.218   7.835
  127   HG23  THR  14          HG23      THR  14  26.583  37.452   9.341
  128    H    LEU  15           HN       LEU  15  29.651  33.628   8.255
  129    HA   LEU  15           HA       LEU  15  32.127  34.742   6.960
  130    HB2  LEU  15           HB2      LEU  15  31.892  32.015   8.253
  131    HB3  LEU  15           HB1      LEU  15  33.359  32.874   7.787
  132    HG   LEU  15           HG       LEU  15  31.441  33.796   9.953
  133   HD11  LEU  15          HD11      LEU  15  32.769  31.658  10.399
  134   HD12  LEU  15          HD12      LEU  15  33.007  32.973  11.547
  135   HD13  LEU  15          HD13      LEU  15  34.219  32.658  10.306
  136   HD21  LEU  15          HD21      LEU  15  34.101  34.797   8.914
  137   HD22  LEU  15          HD22      LEU  15  33.487  35.242  10.507
  138   HD23  LEU  15          HD23      LEU  15  32.587  35.690   9.058
  139    H    GLU  16           HN       GLU  16  31.933  34.451   4.772
  140    HA   GLU  16           HA       GLU  16  30.251  32.246   3.734
  141    HB2  GLU  16           HB2      GLU  16  31.773  34.429   2.277
  142    HB3  GLU  16           HB1      GLU  16  30.619  33.313   1.547
  143    HG2  GLU  16           HG2      GLU  16  28.848  34.185   3.045
  144    HG3  GLU  16           HG1      GLU  16  30.003  35.327   3.729
  145    H    VAL  17           HN       VAL  17  31.235  30.297   3.556
  146    HA   VAL  17           HA       VAL  17  33.730  30.064   2.032
  147    HB   VAL  17           HB       VAL  17  34.840  28.696   3.837
  148   HG11  VAL  17          HG11      VAL  17  35.779  30.572   4.954
  149   HG12  VAL  17          HG12      VAL  17  34.300  31.513   4.792
  150   HG13  VAL  17          HG13      VAL  17  35.294  31.178   3.373
  151   HG21  VAL  17          HG21      VAL  17  32.597  29.887   5.496
  152   HG22  VAL  17          HG22      VAL  17  34.018  29.091   6.170
  153   HG23  VAL  17          HG23      VAL  17  32.879  28.175   5.183
  154    H    GLU  18           HN       GLU  18  33.972  27.922   1.194
  155    HA   GLU  18           HA       GLU  18  31.775  26.423   0.554
  156    HB2  GLU  18           HB2      GLU  18  34.615  25.552   1.099
  157    HB3  GLU  18           HB1      GLU  18  33.406  24.404   0.528
  158    HG2  GLU  18           HG2      GLU  18  32.973  25.817  -1.439
  159    HG3  GLU  18           HG1      GLU  18  34.155  26.994  -0.864
  160    HA   PRO  19           HA       PRO  19  30.231  24.587   4.279
  161    HB2  PRO  19           HB2      PRO  19  29.163  22.230   3.340
  162    HB3  PRO  19           HB1      PRO  19  28.416  23.818   3.070
  163    HG2  PRO  19           HG2      PRO  19  30.146  22.213   1.235
  164    HG3  PRO  19           HG1      PRO  19  28.660  23.113   0.877
  165    HD2  PRO  19           HD2      PRO  19  31.112  24.123   0.303
  166    HD3  PRO  19           HD1      PRO  19  29.763  25.168   0.799
  167    H    SER  20           HN       SER  20  32.424  22.633   2.309
  168    HA   SER  20           HA       SER  20  32.859  20.651   4.393
  169    HB2  SER  20           HB2      SER  20  34.962  20.187   2.893
  170    HB3  SER  20           HB1      SER  20  33.356  19.820   2.267
  171    HG   SER  20           HG       SER  20  34.285  21.021   0.705
  172    H    ASP  21           HN       ASP  21  33.319  23.670   4.854
  173    HA   ASP  21           HA       ASP  21  36.043  24.237   5.257
  174    HB2  ASP  21           HB2      ASP  21  35.026  25.584   7.309
  175    HB3  ASP  21           HB1      ASP  21  34.652  26.068   5.661
  176    H    THR  22           HN       THR  22  36.671  24.588   7.852
  177    HA   THR  22           HA       THR  22  36.246  21.970   9.242
  178    HB   THR  22           HB       THR  22  38.627  21.777   9.708
  179    HG1  THR  22           HG1      THR  22  38.621  24.317   8.553
  180   HG21  THR  22          HG21      THR  22  39.430  21.255   7.494
  181   HG22  THR  22          HG22      THR  22  38.280  22.375   6.760
  182   HG23  THR  22          HG23      THR  22  37.703  20.898   7.532
  183    H    ILE  23           HN       ILE  23  36.249  22.141  11.489
  184    HA   ILE  23           HA       ILE  23  35.463  24.542  12.700
  185    HB   ILE  23           HB       ILE  23  37.069  22.380  14.091
  186   HG12  ILE  23          HG12      ILE  23  35.289  21.257  12.896
  187   HG13  ILE  23          HG11      ILE  23  34.796  21.382  14.581
  188   HG21  ILE  23          HG21      ILE  23  35.001  24.385  15.026
  189   HG22  ILE  23          HG22      ILE  23  36.706  24.328  15.474
  190   HG23  ILE  23          HG23      ILE  23  35.609  23.059  16.019
  191   HD11  ILE  23          HD11      ILE  23  33.804  22.956  12.212
  192   HD12  ILE  23          HD12      ILE  23  33.632  23.593  13.848
  193   HD13  ILE  23          HD13      ILE  23  32.873  22.062  13.413
  194    H    GLU  24           HN       GLU  24  38.596  23.652  11.630
  195    HA   GLU  24           HA       GLU  24  40.005  25.507  13.425
  196    HB2  GLU  24           HB2      GLU  24  41.151  24.242  10.938
  197    HB3  GLU  24           HB1      GLU  24  41.995  24.738  12.403
  198    HG2  GLU  24           HG2      GLU  24  40.037  22.438  12.136
  199    HG3  GLU  24           HG1      GLU  24  41.776  22.311  12.401
  200    H    ASN  25           HN       ASN  25  38.868  25.429  10.070
  201    HA   ASN  25           HA       ASN  25  40.137  27.910   9.321
  202    HB2  ASN  25           HB2      ASN  25  37.975  26.147   8.177
  203    HB3  ASN  25           HB1      ASN  25  38.297  27.722   7.475
  204   HD21  ASN  25          HD21      ASN  25  39.292  24.459   7.452
  205   HD22  ASN  25          HD22      ASN  25  40.757  24.663   6.618
  206    H    VAL  26           HN       VAL  26  37.020  26.979  10.685
  207    HA   VAL  26           HA       VAL  26  35.839  29.620  10.417
  208    HB   VAL  26           HB       VAL  26  35.048  27.439  12.364
  209   HG11  VAL  26          HG11      VAL  26  32.904  28.467  12.327
  210   HG12  VAL  26          HG12      VAL  26  33.311  29.440  10.912
  211   HG13  VAL  26          HG13      VAL  26  34.051  29.798  12.472
  212   HG21  VAL  26          HG21      VAL  26  35.141  26.345  10.245
  213   HG22  VAL  26          HG22      VAL  26  34.486  27.753   9.407
  214   HG23  VAL  26          HG23      VAL  26  33.450  26.794  10.465
  215    H    LYS  27           HN       LYS  27  36.776  27.785  13.350
  216    HA   LYS  27           HA       LYS  27  36.684  29.859  15.191
  217    HB2  LYS  27           HB2      LYS  27  38.626  27.542  14.977
  218    HB3  LYS  27           HB1      LYS  27  38.527  28.598  16.389
  219    HG2  LYS  27           HG2      LYS  27  36.067  28.050  16.519
  220    HG3  LYS  27           HG1      LYS  27  36.323  26.860  15.255
  221    HD2  LYS  27           HD2      LYS  27  36.438  25.694  17.362
  222    HD3  LYS  27           HD1      LYS  27  38.073  25.781  16.714
  223    HE2  LYS  27           HE2      LYS  27  38.768  27.331  18.314
  224    HE3  LYS  27           HE1      LYS  27  37.140  27.958  18.570
  225    HZ1  LYS  27           HZ1      LYS  27  36.624  26.301  19.998
  226    HZ2  LYS  27           HZ2      LYS  27  38.302  26.328  20.266
  227    HZ3  LYS  27           HZ3      LYS  27  37.620  25.160  19.239
  228    H    ALA  28           HN       ALA  28  39.227  29.190  12.831
  229    HA   ALA  28           HA       ALA  28  41.104  31.118  13.889
  230    HB1  ALA  28           HB1      ALA  28  42.045  30.998  11.499
  231    HB2  ALA  28           HB2      ALA  28  40.776  29.817  11.180
  232    HB3  ALA  28           HB3      ALA  28  42.000  29.485  12.405
  233    H    LYS  29           HN       LYS  29  38.985  31.292  11.009
  234    HA   LYS  29           HA       LYS  29  39.396  34.019  10.443
  235    HB2  LYS  29           HB2      LYS  29  37.032  32.198  10.010
  236    HB3  LYS  29           HB1      LYS  29  37.005  33.877   9.474
  237    HG2  LYS  29           HG2      LYS  29  38.723  33.556   7.910
  238    HG3  LYS  29           HG1      LYS  29  39.347  32.128   8.734
  239    HD2  LYS  29           HD2      LYS  29  37.300  30.890   8.090
  240    HD3  LYS  29           HD1      LYS  29  36.740  32.305   7.197
  241    HE2  LYS  29           HE2      LYS  29  39.423  31.014   6.662
  242    HE3  LYS  29           HE1      LYS  29  37.954  30.513   5.824
  243    HZ1  LYS  29           HZ1      LYS  29  37.713  32.590   4.840
  244    HZ2  LYS  29           HZ2      LYS  29  39.384  32.301   4.742
  245    HZ3  LYS  29           HZ3      LYS  29  38.769  33.349   5.929
  246    H    ILE  30           HN       ILE  30  37.417  32.529  12.907
  247    HA   ILE  30           HA       ILE  30  35.991  35.008  13.554
  248    HB   ILE  30           HB       ILE  30  36.229  32.330  14.959
  249   HG12  ILE  30          HG12      ILE  30  33.886  33.701  13.598
  250   HG13  ILE  30          HG11      ILE  30  34.926  32.515  12.810
  251   HG21  ILE  30          HG21      ILE  30  35.877  33.963  16.703
  252   HG22  ILE  30          HG22      ILE  30  34.303  33.248  16.361
  253   HG23  ILE  30          HG23      ILE  30  34.704  34.840  15.721
  254   HD11  ILE  30          HD11      ILE  30  34.333  30.851  14.542
  255   HD12  ILE  30          HD12      ILE  30  32.901  31.433  13.689
  256   HD13  ILE  30          HD13      ILE  30  33.271  32.036  15.303
  257    H    GLN  31           HN       GLN  31  38.226  33.003  15.446
  258    HA   GLN  31           HA       GLN  31  38.900  34.575  17.547
  259    HB2  GLN  31           HB2      GLN  31  39.965  32.369  16.861
  260    HB3  GLN  31           HB1      GLN  31  41.057  33.311  15.845
  261    HG2  GLN  31           HG2      GLN  31  41.582  34.673  17.936
  262    HG3  GLN  31           HG1      GLN  31  40.770  33.405  18.848
  263   HE21  GLN  31          HE21      GLN  31  43.221  33.572  16.190
  264   HE22  GLN  31          HE22      GLN  31  44.227  32.377  16.853
  265    H    ASP  32           HN       ASP  32  40.140  35.080  14.260
  266    HA   ASP  32           HA       ASP  32  41.854  37.304  14.959
  267    HB2  ASP  32           HB2      ASP  32  40.549  36.585  12.317
  268    HB3  ASP  32           HB1      ASP  32  41.793  37.820  12.513
  269    H    LYS  33           HN       LYS  33  38.670  37.257  13.391
  270    HA   LYS  33           HA       LYS  33  38.229  40.052  13.424
  271    HB2  LYS  33           HB2      LYS  33  36.190  37.849  13.610
  272    HB3  LYS  33           HB1      LYS  33  35.830  39.514  13.190
  273    HG2  LYS  33           HG2      LYS  33  37.627  37.631  11.637
  274    HG3  LYS  33           HG1      LYS  33  36.017  38.147  11.155
  275    HD2  LYS  33           HD2      LYS  33  37.121  40.565  11.450
  276    HD3  LYS  33           HD1      LYS  33  38.601  39.671  11.141
  277    HE2  LYS  33           HE2      LYS  33  37.718  40.506   9.027
  278    HE3  LYS  33           HE1      LYS  33  37.568  38.749   9.063
  279    HZ1  LYS  33           HZ1      LYS  33  35.415  39.018   8.691
  280    HZ2  LYS  33           HZ2      LYS  33  35.536  40.706   8.838
  281    HZ3  LYS  33           HZ3      LYS  33  35.265  39.748  10.216
  282    H    GLU  34           HN       GLU  34  37.380  37.647  15.926
  283    HA   GLU  34           HA       GLU  34  36.318  39.820  17.638
  284    HB2  GLU  34           HB2      GLU  34  36.673  36.914  18.406
  285    HB3  GLU  34           HB1      GLU  34  35.575  38.100  19.105
  286    HG2  GLU  34           HG2      GLU  34  34.369  38.242  16.939
  287    HG3  GLU  34           HG1      GLU  34  35.430  36.992  16.289
  288    H    GLY  35           HN       GLY  35  39.207  37.888  17.282
  289    HA2  GLY  35           HA3      GLY  35  41.305  38.135  18.320
  290    HA3  GLY  35           HA2      GLY  35  40.706  39.630  19.033
  291    H    ILE  36           HN       ILE  36  38.671  36.996  19.647
  292    HA   ILE  36           HA       ILE  36  39.441  36.994  22.469
  293    HB   ILE  36           HB       ILE  36  37.219  35.550  21.032
  294   HG12  ILE  36          HG12      ILE  36  37.210  38.157  22.586
  295   HG13  ILE  36          HG11      ILE  36  37.166  38.046  20.828
  296   HG21  ILE  36          HG21      ILE  36  37.760  34.558  23.192
  297   HG22  ILE  36          HG22      ILE  36  36.260  35.467  23.337
  298   HG23  ILE  36          HG23      ILE  36  37.764  36.146  23.951
  299   HD11  ILE  36          HD11      ILE  36  35.124  36.867  22.715
  300   HD12  ILE  36          HD12      ILE  36  35.091  36.741  20.956
  301   HD13  ILE  36          HD13      ILE  36  34.902  38.314  21.734
  302    HA   PRO  37           HA       PRO  37  41.722  33.159  21.659
  303    HB2  PRO  37           HB2      PRO  37  42.660  32.657  24.149
  304    HB3  PRO  37           HB1      PRO  37  43.289  33.995  23.163
  305    HG2  PRO  37           HG2      PRO  37  41.279  34.063  25.376
  306    HG3  PRO  37           HG1      PRO  37  42.638  35.157  25.060
  307    HD2  PRO  37           HD2      PRO  37  40.040  35.739  24.351
  308    HD3  PRO  37           HD1      PRO  37  41.454  36.387  23.490
  309    HA   PRO  38           HA       PRO  38  38.391  30.150  22.339
  310    HB2  PRO  38           HB2      PRO  38  40.832  28.419  22.507
  311    HB3  PRO  38           HB1      PRO  38  39.266  28.067  21.743
  312    HG2  PRO  38           HG2      PRO  38  41.265  28.879  20.267
  313    HG3  PRO  38           HG1      PRO  38  39.651  29.534  19.983
  314    HD2  PRO  38           HD2      PRO  38  42.029  30.866  21.211
  315    HD3  PRO  38           HD1      PRO  38  40.668  31.584  20.318
  316    H    ASP  39           HN       ASP  39  41.179  30.455  24.463
  317    HA   ASP  39           HA       ASP  39  40.334  28.720  26.552
  318    HB2  ASP  39           HB2      ASP  39  42.009  31.237  26.588
  319    HB3  ASP  39           HB1      ASP  39  41.753  30.239  28.019
  320    H    GLN  40           HN       GLN  40  39.632  32.137  25.958
  321    HA   GLN  40           HA       GLN  40  37.848  32.238  28.316
  322    HB2  GLN  40           HB2      GLN  40  38.592  34.355  26.275
  323    HB3  GLN  40           HB1      GLN  40  37.665  34.625  27.749
  324    HG2  GLN  40           HG2      GLN  40  39.614  33.721  29.059
  325    HG3  GLN  40           HG1      GLN  40  40.538  33.692  27.560
  326   HE21  GLN  40          HE21      GLN  40  40.356  35.519  30.217
  327   HE22  GLN  40          HE22      GLN  40  40.561  37.072  29.564
  328    H    GLN  41           HN       GLN  41  37.555  31.202  25.171
  329    HA   GLN  41           HA       GLN  41  34.647  31.939  25.075
  330    HB2  GLN  41           HB2      GLN  41  35.634  33.212  23.342
  331    HB3  GLN  41           HB1      GLN  41  36.758  31.928  22.914
  332    HG2  GLN  41           HG2      GLN  41  35.025  30.619  21.920
  333    HG3  GLN  41           HG1      GLN  41  33.761  31.650  22.593
  334   HE21  GLN  41          HE21      GLN  41  34.995  34.206  21.980
  335   HE22  GLN  41          HE22      GLN  41  34.990  34.390  20.292
  336    H    ARG  42           HN       ARG  42  33.265  30.245  24.679
  337    HA   ARG  42           HA       ARG  42  34.411  27.602  23.882
  338    HB2  ARG  42           HB2      ARG  42  32.542  28.237  26.180
  339    HB3  ARG  42           HB1      ARG  42  32.636  26.625  25.477
  340    HG2  ARG  42           HG2      ARG  42  35.075  28.116  26.477
  341    HG3  ARG  42           HG1      ARG  42  34.127  27.058  27.517
  342    HD2  ARG  42           HD2      ARG  42  34.499  25.304  25.559
  343    HD3  ARG  42           HD1      ARG  42  35.867  26.346  25.171
  344    HE   ARG  42           HE       ARG  42  36.932  25.617  27.154
  345   HH11  ARG  42          HH11      ARG  42  37.059  24.266  28.964
  346   HH12  ARG  42          HH12      ARG  42  35.641  23.437  29.511
  347   HH21  ARG  42          HH21      ARG  42  33.598  24.746  27.033
  348   HH22  ARG  42          HH22      ARG  42  33.681  23.710  28.418
  349    H    LEU  43           HN       LEU  43  33.271  26.853  22.094
  350    HA   LEU  43           HA       LEU  43  30.867  28.356  21.302
  351    HB2  LEU  43           HB2      LEU  43  32.138  26.028  19.864
  352    HB3  LEU  43           HB1      LEU  43  31.080  27.282  19.191
  353    HG   LEU  43           HG       LEU  43  33.942  27.565  20.156
  354   HD11  LEU  43          HD11      LEU  43  34.202  28.479  17.860
  355   HD12  LEU  43          HD12      LEU  43  32.495  28.158  17.567
  356   HD13  LEU  43          HD13      LEU  43  33.607  26.820  17.849
  357   HD21  LEU  43          HD21      LEU  43  32.883  29.513  21.036
  358   HD22  LEU  43          HD22      LEU  43  31.830  29.653  19.629
  359   HD23  LEU  43          HD23      LEU  43  33.548  30.027  19.482
  360    H    ILE  44           HN       ILE  44  28.823  27.514  21.128
  361    HA   ILE  44           HA       ILE  44  28.360  24.711  22.096
  362    HB   ILE  44           HB       ILE  44  26.684  27.192  22.630
  363   HG12  ILE  44          HG12      ILE  44  28.681  27.150  24.036
  364   HG13  ILE  44          HG11      ILE  44  27.271  26.758  25.013
  365   HG21  ILE  44          HG21      ILE  44  25.240  25.253  22.364
  366   HG22  ILE  44          HG22      ILE  44  25.373  25.587  24.093
  367   HG23  ILE  44          HG23      ILE  44  26.301  24.270  23.375
  368   HD11  ILE  44          HD11      ILE  44  28.714  25.090  25.716
  369   HD12  ILE  44          HD12      ILE  44  29.538  25.000  24.164
  370   HD13  ILE  44          HD13      ILE  44  27.958  24.252  24.362
  371    H    PHE  45           HN       PHE  45  27.062  23.523  20.706
  372    HA   PHE  45           HA       PHE  45  25.356  24.949  18.748
  373    HB2  PHE  45           HB2      PHE  45  27.423  24.720  17.528
  374    HB3  PHE  45           HB1      PHE  45  27.621  23.054  18.065
  375    HD1  PHE  45           HD1      PHE  45  25.752  25.308  15.829
  376    HD2  PHE  45           HD2      PHE  45  26.323  21.248  17.090
  377    HE1  PHE  45           HE1      PHE  45  24.462  24.521  13.862
  378    HE2  PHE  45           HE2      PHE  45  25.034  20.453  15.124
  379    HZ   PHE  45           HZ       PHE  45  24.103  22.092  13.509
  380    H    ALA  46           HN       ALA  46  23.420  24.015  19.184
  381    HA   ALA  46           HA       ALA  46  21.792  22.367  19.514
  382    HB1  ALA  46           HB1      ALA  46  21.996  20.403  18.197
  383    HB2  ALA  46           HB2      ALA  46  23.757  20.444  18.267
  384    HB3  ALA  46           HB3      ALA  46  22.885  21.643  17.311
  385    H    GLY  47           HN       GLY  47  23.985  22.712  21.604
  386    HA2  GLY  47           HA3      GLY  47  24.096  21.706  23.759
  387    HA3  GLY  47           HA2      GLY  47  23.285  20.280  23.118
  388    H    LYS  48           HN       LYS  48  25.744  21.101  21.011
  389    HA   LYS  48           HA       LYS  48  27.754  19.372  22.409
  390    HB2  LYS  48           HB2      LYS  48  27.089  19.319  19.475
  391    HB3  LYS  48           HB1      LYS  48  28.269  18.304  20.292
  392    HG2  LYS  48           HG2      LYS  48  26.550  17.189  21.553
  393    HG3  LYS  48           HG1      LYS  48  25.330  18.339  21.016
  394    HD2  LYS  48           HD2      LYS  48  25.041  16.348  19.696
  395    HD3  LYS  48           HD1      LYS  48  25.769  17.564  18.647
  396    HE2  LYS  48           HE2      LYS  48  27.922  16.554  18.799
  397    HE3  LYS  48           HE1      LYS  48  27.435  15.544  20.160
  398    HZ1  LYS  48           HZ1      LYS  48  27.504  14.587  17.753
  399    HZ2  LYS  48           HZ2      LYS  48  25.973  15.313  17.629
  400    HZ3  LYS  48           HZ3      LYS  48  26.265  14.138  18.821
  401    H    GLN  49           HN       GLN  49  29.979  19.928  21.910
  402    HA   GLN  49           HA       GLN  49  30.285  22.690  20.926
  403    HB2  GLN  49           HB2      GLN  49  32.367  20.951  22.186
  404    HB3  GLN  49           HB1      GLN  49  32.396  22.700  22.023
  405    HG2  GLN  49           HG2      GLN  49  30.424  22.855  23.516
  406    HG3  GLN  49           HG1      GLN  49  30.441  21.101  23.706
  407   HE21  GLN  49          HE21      GLN  49  31.088  20.932  25.903
  408   HE22  GLN  49          HE22      GLN  49  32.549  21.553  26.500
  409    H    LEU  50           HN       LEU  50  32.267  23.083  19.511
  410    HA   LEU  50           HA       LEU  50  32.413  20.942  17.435
  411    HB2  LEU  50           HB2      LEU  50  33.517  23.749  17.217
  412    HB3  LEU  50           HB1      LEU  50  33.064  22.646  15.916
  413    HG   LEU  50           HG       LEU  50  31.171  23.963  17.884
  414   HD11  LEU  50          HD11      LEU  50  30.291  25.020  15.778
  415   HD12  LEU  50          HD12      LEU  50  31.671  24.338  14.918
  416   HD13  LEU  50          HD13      LEU  50  31.927  25.526  16.196
  417   HD21  LEU  50          HD21      LEU  50  30.768  21.899  15.710
  418   HD22  LEU  50          HD22      LEU  50  29.449  22.925  16.272
  419   HD23  LEU  50          HD23      LEU  50  30.248  21.824  17.394
  420    H    GLU  51           HN       GLU  51  34.122  19.576  17.702
  421    HA   GLU  51           HA       GLU  51  36.567  20.536  19.081
  422    HB2  GLU  51           HB2      GLU  51  35.823  17.773  18.068
  423    HB3  GLU  51           HB1      GLU  51  37.217  18.166  19.075
  424    HG2  GLU  51           HG2      GLU  51  35.683  19.015  20.835
  425    HG3  GLU  51           HG1      GLU  51  34.306  18.542  19.839
  426    H    ASP  52           HN       ASP  52  38.688  20.121  18.094
  427    HA   ASP  52           HA       ASP  52  38.771  20.950  15.319
  428    HB2  ASP  52           HB2      ASP  52  40.938  19.984  17.207
  429    HB3  ASP  52           HB1      ASP  52  41.247  20.624  15.593
  430    H    GLY  53           HN       GLY  53  39.741  19.707  13.561
  431    HA2  GLY  53           HA3      GLY  53  40.309  17.708  12.413
  432    HA3  GLY  53           HA2      GLY  53  40.114  16.816  13.923
  433    H    ARG  54           HN       ARG  54  37.871  18.901  12.082
  434    HA   ARG  54           HA       ARG  54  36.186  16.600  11.396
  435    HB2  ARG  54           HB2      ARG  54  35.621  17.120  13.802
  436    HB3  ARG  54           HB1      ARG  54  35.067  18.705  13.267
  437    HG2  ARG  54           HG2      ARG  54  33.337  17.750  11.919
  438    HG3  ARG  54           HG1      ARG  54  34.008  16.127  12.088
  439    HD2  ARG  54           HD2      ARG  54  33.032  17.749  14.450
  440    HD3  ARG  54           HD1      ARG  54  31.995  16.629  13.562
  441    HE   ARG  54           HE       ARG  54  34.342  15.214  14.276
  442   HH11  ARG  54          HH11      ARG  54  34.315  13.873  16.097
  443   HH12  ARG  54          HH12      ARG  54  33.126  14.133  17.328
  444   HH21  ARG  54          HH21      ARG  54  31.650  16.822  15.711
  445   HH22  ARG  54          HH22      ARG  54  31.618  15.802  17.111
  446    H    THR  55           HN       THR  55  34.695  17.110   9.757
  447    HA   THR  55           HA       THR  55  34.634  19.948   8.800
  448    HB   THR  55           HB       THR  55  34.866  17.372   7.205
  449    HG1  THR  55           HG1      THR  55  36.858  17.984   7.287
  450   HG21  THR  55          HG21      THR  55  34.839  19.106   5.249
  451   HG22  THR  55          HG22      THR  55  33.975  20.132   6.394
  452   HG23  THR  55          HG23      THR  55  33.306  18.568   5.932
  453    H    LEU  56           HN       LEU  56  32.494  20.552   7.917
  454    HA   LEU  56           HA       LEU  56  30.252  19.683   9.235
  455    HB2  LEU  56           HB2      LEU  56  30.637  20.788   6.469
  456    HB3  LEU  56           HB1      LEU  56  29.026  20.292   6.969
  457    HG   LEU  56           HG       LEU  56  29.280  21.764   9.004
  458   HD11  LEU  56          HD11      LEU  56  31.825  22.503   7.544
  459   HD12  LEU  56          HD12      LEU  56  31.643  21.990   9.221
  460   HD13  LEU  56          HD13      LEU  56  31.068  23.579   8.717
  461   HD21  LEU  56          HD21      LEU  56  27.986  22.643   7.210
  462   HD22  LEU  56          HD22      LEU  56  29.413  22.927   6.217
  463   HD23  LEU  56          HD23      LEU  56  29.116  23.928   7.638
  464    H    SER  57           HN       SER  57  31.591  18.176   6.292
  465    HA   SER  57           HA       SER  57  29.514  16.281   5.856
  466    HB2  SER  57           HB2      SER  57  31.404  16.576   4.285
  467    HB3  SER  57           HB1      SER  57  32.509  15.912   5.486
  468    HG   SER  57           HG       SER  57  31.167  13.997   5.427
  469    H    ASP  58           HN       ASP  58  32.536  15.891   7.697
  470    HA   ASP  58           HA       ASP  58  31.874  13.379   8.876
  471    HB2  ASP  58           HB2      ASP  58  33.670  15.627   9.819
  472    HB3  ASP  58           HB1      ASP  58  33.541  14.086  10.668
  473    H    TYR  59           HN       TYR  59  31.052  16.683   9.768
  474    HA   TYR  59           HA       TYR  59  29.958  15.977  12.362
  475    HB2  TYR  59           HB2      TYR  59  30.641  18.346  11.070
  476    HB3  TYR  59           HB1      TYR  59  28.886  18.436  11.095
  477    HD1  TYR  59           HD1      TYR  59  31.791  19.212  12.907
  478    HD2  TYR  59           HD2      TYR  59  27.818  17.666  13.460
  479    HE1  TYR  59           HE1      TYR  59  31.869  19.871  15.291
  480    HE2  TYR  59           HE2      TYR  59  27.897  18.329  15.848
  481    HH   TYR  59           HH       TYR  59  30.784  19.249  17.406
  482    H    ASN  60           HN       ASN  60  29.029  15.073   9.399
  483    HA   ASN  60           HA       ASN  60  27.009  14.350   8.441
  484    HB2  ASN  60           HB2      ASN  60  26.280  14.042  11.366
  485    HB3  ASN  60           HB1      ASN  60  25.526  13.204  10.010
  486   HD21  ASN  60          HD21      ASN  60  27.456  12.170   8.496
  487   HD22  ASN  60          HD22      ASN  60  28.570  11.243   9.382
  488    H    ILE  61           HN       ILE  61  26.802  16.898   8.030
  489    HA   ILE  61           HA       ILE  61  24.888  18.403   9.519
  490    HB   ILE  61           HB       ILE  61  24.553  19.616   7.267
  491   HG12  ILE  61          HG12      ILE  61  26.922  17.926   6.430
  492   HG13  ILE  61          HG11      ILE  61  25.270  17.492   5.990
  493   HG21  ILE  61          HG21      ILE  61  27.385  19.276   8.298
  494   HG22  ILE  61          HG22      ILE  61  26.164  20.315   9.033
  495   HG23  ILE  61          HG23      ILE  61  26.756  20.663   7.410
  496   HD11  ILE  61          HD11      ILE  61  24.967  19.496   4.744
  497   HD12  ILE  61          HD12      ILE  61  26.569  18.910   4.294
  498   HD13  ILE  61          HD13      ILE  61  26.406  20.237   5.444
  499    H    GLN  62           HN       GLN  62  22.638  18.448   9.427
  500    HA   GLN  62           HA       GLN  62  21.341  16.260   7.847
  501    HB2  GLN  62           HB2      GLN  62  20.499  17.752  10.341
  502    HB3  GLN  62           HB1      GLN  62  19.446  16.632   9.477
  503    HG2  GLN  62           HG2      GLN  62  20.976  14.800   9.842
  504    HG3  GLN  62           HG1      GLN  62  22.195  15.887  10.509
  505   HE21  GLN  62          HE21      GLN  62  20.819  13.574  11.862
  506   HE22  GLN  62          HE22      GLN  62  20.080  14.236  13.240
  507    H    LYS  63           HN       LYS  63  20.244  19.451   9.077
  508    HA   LYS  63           HA       LYS  63  18.459  19.721   6.777
  509    HB2  LYS  63           HB2      LYS  63  19.149  21.617   9.038
  510    HB3  LYS  63           HB1      LYS  63  17.911  21.931   7.820
  511    HG2  LYS  63           HG2      LYS  63  16.723  19.876   8.492
  512    HG3  LYS  63           HG1      LYS  63  17.957  19.560   9.710
  513    HD2  LYS  63           HD2      LYS  63  17.411  21.717  10.806
  514    HD3  LYS  63           HD1      LYS  63  16.141  21.986   9.610
  515    HE2  LYS  63           HE2      LYS  63  16.273  19.616  11.498
  516    HE3  LYS  63           HE1      LYS  63  15.240  21.028  11.719
  517    HZ1  LYS  63           HZ1      LYS  63  15.171  19.207   9.374
  518    HZ2  LYS  63           HZ2      LYS  63  14.151  20.540   9.637
  519    HZ3  LYS  63           HZ3      LYS  63  14.065  19.186  10.660
  520    H    GLU  64           HN       GLU  64  21.600  21.018   7.728
  521    HA   GLU  64           HA       GLU  64  23.040  22.512   6.605
  522    HB2  GLU  64           HB2      GLU  64  22.825  20.359   5.128
  523    HB3  GLU  64           HB1      GLU  64  21.887  21.390   4.049
  524    HG2  GLU  64           HG2      GLU  64  23.815  23.019   4.058
  525    HG3  GLU  64           HG1      GLU  64  24.747  21.823   4.956
  526    H    SEP  65           HN       SEP  65  19.980  23.189   6.877
  527    HA   SEP  65           HA       SEP  65  19.465  24.968   4.637
  528    HB2  SEP  65           HB1      SEP  65  18.159  24.507   7.315
  529    HB3  SEP  65           HB2      SEP  65  17.519  24.167   5.710
  530    H    TPO  66           HN       TPO  66  19.957  25.684   8.116
  531    HA   TPO  66           HA       TPO  66  21.606  28.044   7.340
  532    HB   TPO  66           HB       TPO  66  19.573  29.174   7.636
  533   HG21  TPO  66          HG21      TPO  66  18.996  27.181   9.845
  534   HG22  TPO  66          HG22      TPO  66  18.204  27.277   8.272
  535   HG23  TPO  66          HG23      TPO  66  17.962  28.557   9.460
  536    H    LEU  67           HN       LEU  67  23.439  27.031   8.215
  537    HA   LEU  67           HA       LEU  67  23.475  25.731  10.782
  538    HB2  LEU  67           HB2      LEU  67  25.842  27.067   9.450
  539    HB3  LEU  67           HB1      LEU  67  25.852  25.678  10.536
  540    HG   LEU  67           HG       LEU  67  24.616  25.729   7.764
  541   HD11  LEU  67          HD11      LEU  67  27.168  25.766   7.967
  542   HD12  LEU  67          HD12      LEU  67  26.477  24.425   7.052
  543   HD13  LEU  67          HD13      LEU  67  27.028  24.172   8.708
  544   HD21  LEU  67          HD21      LEU  67  23.378  24.162   9.053
  545   HD22  LEU  67          HD22      LEU  67  24.810  23.628   9.932
  546   HD23  LEU  67          HD23      LEU  67  24.598  23.186   8.238
  547    H    HIS  68           HN       HIS  68  23.232  26.721  12.713
  548    HA   HIS  68           HA       HIS  68  24.092  29.587  12.996
  549    HB2  HIS  68           HB2      HIS  68  22.375  29.782  14.732
  550    HB3  HIS  68           HB1      HIS  68  21.642  29.220  13.229
  551    HD1  HIS  68           HD1      HIS  68  22.752  27.967  16.624
  552    HD2  HIS  68           HD2      HIS  68  20.528  26.637  13.354
  553    HE1  HIS  68           HE1      HIS  68  21.645  25.802  17.340
  554    HE2  HIS  68           HE2      HIS  68  20.291  24.985  15.358
  555    H    LEU  69           HN       LEU  69  25.596  30.004  14.546
  556    HA   LEU  69           HA       LEU  69  26.267  27.849  16.533
  557    HB2  LEU  69           HB2      LEU  69  28.033  29.528  14.754
  558    HB3  LEU  69           HB1      LEU  69  28.636  29.054  16.339
  559    HG   LEU  69           HG       LEU  69  28.130  26.664  15.758
  560   HD11  LEU  69          HD11      LEU  69  27.254  27.982  13.200
  561   HD12  LEU  69          HD12      LEU  69  26.556  26.606  14.052
  562   HD13  LEU  69          HD13      LEU  69  28.024  26.397  13.107
  563   HD21  LEU  69          HD21      LEU  69  30.396  27.352  15.540
  564   HD22  LEU  69          HD22      LEU  69  30.053  28.303  14.095
  565   HD23  LEU  69          HD23      LEU  69  30.024  26.543  14.018
  566    H    VAL  70           HN       VAL  70  27.072  28.772  18.630
  567    HA   VAL  70           HA       VAL  70  26.510  31.693  18.965
  568    HB   VAL  70           HB       VAL  70  25.469  29.476  20.758
  569   HG11  VAL  70          HG11      VAL  70  26.059  31.411  22.079
  570   HG12  VAL  70          HG12      VAL  70  24.305  31.418  21.878
  571   HG13  VAL  70          HG13      VAL  70  25.309  32.499  20.910
  572   HG21  VAL  70          HG21      VAL  70  24.102  31.374  18.828
  573   HG22  VAL  70          HG22      VAL  70  23.238  30.422  20.035
  574   HG23  VAL  70          HG23      VAL  70  24.131  29.613  18.746
  575    H    LEU  71           HN       LEU  71  28.286  32.608  19.909
  576    HA   LEU  71           HA       LEU  71  30.329  30.916  21.135
  577    HB2  LEU  71           HB2      LEU  71  30.034  33.872  20.577
  578    HB3  LEU  71           HB1      LEU  71  31.357  33.274  21.574
  579    HG   LEU  71           HG       LEU  71  32.204  31.923  19.778
  580   HD11  LEU  71          HD11      LEU  71  30.184  31.078  18.780
  581   HD12  LEU  71          HD12      LEU  71  31.023  31.990  17.528
  582   HD13  LEU  71          HD13      LEU  71  29.642  32.703  18.363
  583   HD21  LEU  71          HD21      LEU  71  32.870  33.614  18.239
  584   HD22  LEU  71          HD22      LEU  71  32.582  34.457  19.761
  585   HD23  LEU  71          HD23      LEU  71  31.377  34.520  18.478
  586    H    ARG  72           HN       ARG  72  30.935  30.992  23.382
  587    HA   ARG  72           HA       ARG  72  29.012  32.393  25.208
  588    HB2  ARG  72           HB2      ARG  72  28.758  29.822  25.021
  589    HB3  ARG  72           HB1      ARG  72  30.331  29.734  25.807
  590    HG2  ARG  72           HG2      ARG  72  28.929  29.654  27.667
  591    HG3  ARG  72           HG1      ARG  72  29.212  31.389  27.558
  592    HD2  ARG  72           HD2      ARG  72  27.085  31.398  26.037
  593    HD3  ARG  72           HD1      ARG  72  26.770  29.818  26.752
  594    HE   ARG  72           HE       ARG  72  26.553  32.392  28.116
  595   HH11  ARG  72          HH11      ARG  72  25.838  32.286  30.257
  596   HH12  ARG  72          HH12      ARG  72  25.832  30.761  31.081
  597   HH21  ARG  72          HH21      ARG  72  27.080  28.994  28.370
  598   HH22  ARG  72          HH22      ARG  72  26.535  28.898  30.012
  599    H    LEU  73           HN       LEU  73  30.047  33.131  27.213
  600    HA   LEU  73           HA       LEU  73  32.981  33.541  26.872
  601    HB2  LEU  73           HB2      LEU  73  30.828  34.898  28.503
  602    HB3  LEU  73           HB1      LEU  73  32.536  35.150  28.864
  603    HG   LEU  73           HG       LEU  73  32.893  35.852  26.493
  604   HD11  LEU  73          HD11      LEU  73  30.708  36.493  25.278
  605   HD12  LEU  73          HD12      LEU  73  29.905  35.403  26.406
  606   HD13  LEU  73          HD13      LEU  73  31.137  34.785  25.305
  607   HD21  LEU  73          HD21      LEU  73  30.701  37.421  27.881
  608   HD22  LEU  73          HD22      LEU  73  31.904  38.054  26.757
  609   HD23  LEU  73          HD23      LEU  73  32.400  37.477  28.349
  610    H    ARG  74           HN       ARG  74  34.371  32.354  28.083
  611    HA   ARG  74           HA       ARG  74  35.087  30.749  29.651
  612    HB2  ARG  74           HB2      ARG  74  33.372  32.577  31.356
  613    HB3  ARG  74           HB1      ARG  74  34.476  31.364  32.007
  614    HG2  ARG  74           HG2      ARG  74  36.380  32.453  30.992
  615    HG3  ARG  74           HG1      ARG  74  35.334  33.570  30.115
  616    HD2  ARG  74           HD2      ARG  74  34.546  34.523  32.246
  617    HD3  ARG  74           HD1      ARG  74  35.579  33.402  33.134
  618    HE   ARG  74           HE       ARG  74  37.289  34.761  31.379
  619   HH11  ARG  74          HH11      ARG  74  38.416  36.601  32.048
  620   HH12  ARG  74          HH12      ARG  74  37.813  37.534  33.378
  621   HH21  ARG  74          HH21      ARG  74  35.061  35.494  33.907
  622   HH22  ARG  74          HH22      ARG  74  35.914  36.906  34.430
  623    H    GLY  75           HN       GLY  75  33.395  29.366  28.285
  624    HA2  GLY  75           HA3      GLY  75  30.891  28.640  29.413
  625    HA3  GLY  75           HA2      GLY  75  31.850  27.602  28.357
  626    H    GLY  76           HN       GLY  76  34.161  27.373  30.006
  627    HA2  GLY  76           HA3      GLY  76  33.274  25.283  31.801
  628    HA3  GLY  76           HA2      GLY  76  34.931  25.874  31.648
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1  28.655  28.285   1.223
    2    H2   MET   1           HT2      MET   1  28.401  28.207   2.902
    3    H3   MET   1           HT3      MET   1  29.290  29.491   2.233
    4    HA   MET   1           HA       MET   1  27.143  29.971   0.911
    5    HB2  MET   1           HB2      MET   1  26.201  28.293   3.253
    6    HB3  MET   1           HB1      MET   1  25.142  29.361   2.331
    7    HG2  MET   1           HG2      MET   1  25.863  28.121   0.246
    8    HG3  MET   1           HG1      MET   1  26.675  26.961   1.297
    9    HE1  MET   1           HE1      MET   1  24.652  26.642   3.853
   10    HE2  MET   1           HE2      MET   1  25.754  25.600   2.958
   11    HE3  MET   1           HE3      MET   1  24.076  25.115   3.173
   12    H    GLN   2           HN       GLN   2  26.171  29.920   4.234
   13    HA   GLN   2           HA       GLN   2  27.626  32.351   4.971
   14    HB2  GLN   2           HB2      GLN   2  25.816  33.246   3.523
   15    HB3  GLN   2           HB1      GLN   2  24.621  32.465   4.559
   16    HG2  GLN   2           HG2      GLN   2  25.349  33.800   6.472
   17    HG3  GLN   2           HG1      GLN   2  26.633  34.528   5.505
   18   HE21  GLN   2          HE21      GLN   2  24.730  36.234   6.670
   19   HE22  GLN   2          HE22      GLN   2  23.719  36.868   5.464
   20    H    ILE   3           HN       ILE   3  28.198  30.842   6.708
   21    HA   ILE   3           HA       ILE   3  26.160  29.710   8.422
   22    HB   ILE   3           HB       ILE   3  29.142  30.146   8.759
   23   HG12  ILE   3          HG12      ILE   3  29.095  27.617   8.663
   24   HG13  ILE   3          HG11      ILE   3  27.382  27.721   8.270
   25   HG21  ILE   3          HG21      ILE   3  27.121  28.955  10.668
   26   HG22  ILE   3          HG22      ILE   3  28.313  30.212  10.995
   27   HG23  ILE   3          HG23      ILE   3  28.835  28.547  10.740
   28   HD11  ILE   3          HD11      ILE   3  27.791  28.714   6.179
   29   HD12  ILE   3          HD12      ILE   3  29.097  27.542   6.317
   30   HD13  ILE   3          HD13      ILE   3  29.409  29.244   6.637
   31    H    PHE   4           HN       PHE   4  25.034  30.732  10.012
   32    HA   PHE   4           HA       PHE   4  25.588  33.556  10.575
   33    HB2  PHE   4           HB2      PHE   4  23.499  31.619  11.609
   34    HB3  PHE   4           HB1      PHE   4  23.584  33.313  12.094
   35    HD1  PHE   4           HD1      PHE   4  22.845  30.983   9.348
   36    HD2  PHE   4           HD2      PHE   4  23.120  35.113  10.494
   37    HE1  PHE   4           HE1      PHE   4  21.623  31.635   7.292
   38    HE2  PHE   4           HE2      PHE   4  21.898  35.765   8.438
   39    HZ   PHE   4           HZ       PHE   4  21.150  34.027   6.836
   40    H    VAL   5           HN       VAL   5  26.285  34.391  12.543
   41    HA   VAL   5           HA       VAL   5  27.008  32.491  14.724
   42    HB   VAL   5           HB       VAL   5  28.966  34.523  13.619
   43   HG11  VAL   5          HG11      VAL   5  29.132  32.328  15.698
   44   HG12  VAL   5          HG12      VAL   5  29.362  34.059  15.946
   45   HG13  VAL   5          HG13      VAL   5  30.549  33.135  15.029
   46   HG21  VAL   5          HG21      VAL   5  30.194  32.493  12.787
   47   HG22  VAL   5          HG22      VAL   5  28.664  32.772  11.958
   48   HG23  VAL   5          HG23      VAL   5  28.779  31.524  13.198
   49    H    LYS   6           HN       LYS   6  25.626  33.393  16.235
   50    HA   LYS   6           HA       LYS   6  25.693  36.358  16.627
   51    HB2  LYS   6           HB2      LYS   6  23.474  35.266  16.321
   52    HB3  LYS   6           HB1      LYS   6  23.782  34.291  17.758
   53    HG2  LYS   6           HG2      LYS   6  23.952  36.315  19.129
   54    HG3  LYS   6           HG1      LYS   6  23.724  37.323  17.699
   55    HD2  LYS   6           HD2      LYS   6  21.495  36.310  17.347
   56    HD3  LYS   6           HD1      LYS   6  21.719  35.331  18.798
   57    HE2  LYS   6           HE2      LYS   6  21.766  38.362  18.744
   58    HE3  LYS   6           HE1      LYS   6  20.379  37.390  19.234
   59    HZ1  LYS   6           HZ1      LYS   6  23.046  37.490  20.525
   60    HZ2  LYS   6           HZ2      LYS   6  21.854  36.346  20.918
   61    HZ3  LYS   6           HZ3      LYS   6  21.567  38.000  21.181
   62    H    THR   7           HN       THR   7  26.521  37.209  18.501
   63    HA   THR   7           HA       THR   7  27.803  35.310  20.407
   64    HB   THR   7           HB       THR   7  29.092  37.224  21.159
   65    HG1  THR   7           HG1      THR   7  28.400  39.181  20.862
   66   HG21  THR   7          HG21      THR   7  30.128  37.925  18.987
   67   HG22  THR   7          HG22      THR   7  28.799  37.127  18.144
   68   HG23  THR   7          HG23      THR   7  29.915  36.180  19.128
   69    H    LEU   8           HN       LEU   8  27.834  36.549  22.755
   70    HA   LEU   8           HA       LEU   8  25.043  36.447  23.613
   71    HB2  LEU   8           HB2      LEU   8  25.994  36.819  25.881
   72    HB3  LEU   8           HB1      LEU   8  26.760  35.478  25.037
   73    HG   LEU   8           HG       LEU   8  28.402  37.537  24.247
   74   HD11  LEU   8          HD11      LEU   8  27.460  38.201  27.057
   75   HD12  LEU   8          HD12      LEU   8  27.316  39.228  25.631
   76   HD13  LEU   8          HD13      LEU   8  28.904  38.871  26.302
   77   HD21  LEU   8          HD21      LEU   8  29.990  36.725  25.929
   78   HD22  LEU   8          HD22      LEU   8  29.093  35.367  25.248
   79   HD23  LEU   8          HD23      LEU   8  28.675  35.988  26.845
   80    H    THR   9           HN       THR   9  27.437  38.937  22.987
   81    HA   THR   9           HA       THR   9  25.882  41.051  24.270
   82    HB   THR   9           HB       THR   9  28.159  41.282  22.277
   83    HG1  THR   9           HG1      THR   9  28.038  40.793  25.023
   84   HG21  THR   9          HG21      THR   9  28.452  43.472  23.636
   85   HG22  THR   9          HG22      THR   9  26.786  43.206  24.153
   86   HG23  THR   9          HG23      THR   9  27.158  43.409  22.441
   87    H    GLY  10           HN       GLY  10  25.407  39.294  21.500
   88    HA2  GLY  10           HA3      GLY  10  23.578  39.696  19.982
   89    HA3  GLY  10           HA2      GLY  10  23.666  41.418  20.359
   90    H    LYS  11           HN       LYS  11  26.739  41.024  20.058
   91    HA   LYS  11           HA       LYS  11  27.038  42.140  17.489
   92    HB2  LYS  11           HB2      LYS  11  28.933  40.502  19.185
   93    HB3  LYS  11           HB1      LYS  11  29.420  41.182  17.633
   94    HG2  LYS  11           HG2      LYS  11  29.085  43.412  18.382
   95    HG3  LYS  11           HG1      LYS  11  28.166  42.885  19.791
   96    HD2  LYS  11           HD2      LYS  11  30.466  43.561  20.413
   97    HD3  LYS  11           HD1      LYS  11  30.184  41.851  20.742
   98    HE2  LYS  11           HE2      LYS  11  32.389  42.448  19.566
   99    HE3  LYS  11           HE1      LYS  11  31.425  41.168  18.832
  100    HZ1  LYS  11           HZ1      LYS  11  30.813  43.862  17.951
  101    HZ2  LYS  11           HZ2      LYS  11  30.949  42.426  17.052
  102    HZ3  LYS  11           HZ3      LYS  11  32.343  43.286  17.501
  103    H    THR  12           HN       THR  12  26.238  41.192  15.661
  104    HA   THR  12           HA       THR  12  26.317  38.241  15.380
  105    HB   THR  12           HB       THR  12  25.134  40.373  13.576
  106    HG1  THR  12           HG1      THR  12  23.661  38.524  15.063
  107   HG21  THR  12          HG21      THR  12  23.889  38.323  12.678
  108   HG22  THR  12          HG22      THR  12  25.097  37.351  13.519
  109   HG23  THR  12          HG23      THR  12  25.591  38.456  12.237
  110    H    ILE  13           HN       ILE  13  27.427  37.197  13.698
  111    HA   ILE  13           HA       ILE  13  29.184  38.819  11.936
  112    HB   ILE  13           HB       ILE  13  30.236  36.490  13.573
  113   HG12  ILE  13          HG12      ILE  13  30.610  39.476  13.984
  114   HG13  ILE  13          HG11      ILE  13  29.744  38.382  15.064
  115   HG21  ILE  13          HG21      ILE  13  32.381  37.132  12.694
  116   HG22  ILE  13          HG22      ILE  13  31.719  38.609  11.996
  117   HG23  ILE  13          HG23      ILE  13  31.276  37.040  11.324
  118   HD11  ILE  13          HD11      ILE  13  32.702  38.402  14.436
  119   HD12  ILE  13          HD12      ILE  13  31.909  37.046  15.238
  120   HD13  ILE  13          HD13      ILE  13  31.927  38.635  16.003
  121    H    THR  14           HN       THR  14  29.456  37.804   9.922
  122    HA   THR  14           HA       THR  14  28.268  35.058   9.623
  123    HB   THR  14           HB       THR  14  27.403  35.780   7.433
  124    HG1  THR  14           HG1      THR  14  28.944  37.401   7.034
  125   HG21  THR  14          HG21      THR  14  25.952  36.018   9.404
  126   HG22  THR  14          HG22      THR  14  25.653  37.321   8.253
  127   HG23  THR  14          HG23      THR  14  26.610  37.627   9.703
  128    H    LEU  15           HN       LEU  15  29.509  33.641   8.485
  129    HA   LEU  15           HA       LEU  15  31.998  34.693   7.160
  130    HB2  LEU  15           HB2      LEU  15  31.632  31.929   8.347
  131    HB3  LEU  15           HB1      LEU  15  33.135  32.698   7.844
  132    HG   LEU  15           HG       LEU  15  31.381  33.676  10.120
  133   HD11  LEU  15          HD11      LEU  15  32.330  31.617  10.838
  134   HD12  LEU  15          HD12      LEU  15  33.396  32.865  11.486
  135   HD13  LEU  15          HD13      LEU  15  33.869  31.960  10.047
  136   HD21  LEU  15          HD21      LEU  15  33.566  34.941  10.630
  137   HD22  LEU  15          HD22      LEU  15  32.618  35.521   9.261
  138   HD23  LEU  15          HD23      LEU  15  34.052  34.532   8.985
  139    H    GLU  16           HN       GLU  16  31.732  34.531   4.976
  140    HA   GLU  16           HA       GLU  16  29.900  32.483   3.873
  141    HB2  GLU  16           HB2      GLU  16  31.451  34.762   2.606
  142    HB3  GLU  16           HB1      GLU  16  30.436  33.644   1.694
  143    HG2  GLU  16           HG2      GLU  16  28.473  34.308   2.962
  144    HG3  GLU  16           HG1      GLU  16  29.454  35.322   4.020
  145    H    VAL  17           HN       VAL  17  30.766  30.501   3.550
  146    HA   VAL  17           HA       VAL  17  33.141  30.196   1.903
  147    HB   VAL  17           HB       VAL  17  34.273  30.543   4.024
  148   HG11  VAL  17          HG11      VAL  17  32.356  30.038   5.496
  149   HG12  VAL  17          HG12      VAL  17  33.779  29.112   5.973
  150   HG13  VAL  17          HG13      VAL  17  32.481  28.331   5.071
  151   HG21  VAL  17          HG21      VAL  17  34.955  28.634   2.436
  152   HG22  VAL  17          HG22      VAL  17  34.197  27.550   3.602
  153   HG23  VAL  17          HG23      VAL  17  35.568  28.548   4.086
  154    H    GLU  18           HN       GLU  18  33.388  27.963   1.207
  155    HA   GLU  18           HA       GLU  18  31.074  26.553   0.661
  156    HB2  GLU  18           HB2      GLU  18  33.901  25.574   1.100
  157    HB3  GLU  18           HB1      GLU  18  32.617  24.480   0.588
  158    HG2  GLU  18           HG2      GLU  18  33.280  27.053  -0.865
  159    HG3  GLU  18           HG1      GLU  18  33.968  25.491  -1.304
  160    HA   PRO  19           HA       PRO  19  29.647  24.882   4.516
  161    HB2  PRO  19           HB2      PRO  19  28.546  22.481   3.701
  162    HB3  PRO  19           HB1      PRO  19  27.772  24.057   3.444
  163    HG2  PRO  19           HG2      PRO  19  29.398  22.421   1.542
  164    HG3  PRO  19           HG1      PRO  19  27.896  23.319   1.254
  165    HD2  PRO  19           HD2      PRO  19  30.299  24.314   0.511
  166    HD3  PRO  19           HD1      PRO  19  28.997  25.373   1.090
  167    H    SER  20           HN       SER  20  32.072  23.293   2.685
  168    HA   SER  20           HA       SER  20  32.510  21.157   4.675
  169    HB2  SER  20           HB2      SER  20  34.375  21.885   2.415
  170    HB3  SER  20           HB1      SER  20  34.165  20.327   3.211
  171    HG   SER  20           HG       SER  20  32.742  21.487   1.171
  172    H    ASP  21           HN       ASP  21  32.915  24.268   4.985
  173    HA   ASP  21           HA       ASP  21  35.610  24.899   5.452
  174    HB2  ASP  21           HB2      ASP  21  33.514  26.375   5.860
  175    HB3  ASP  21           HB1      ASP  21  33.492  25.654   7.469
  176    H    THR  22           HN       THR  22  36.838  24.854   7.587
  177    HA   THR  22           HA       THR  22  36.247  22.308   9.052
  178    HB   THR  22           HB       THR  22  38.917  23.713   8.999
  179    HG1  THR  22           HG1      THR  22  39.355  22.219   7.238
  180   HG21  THR  22          HG21      THR  22  39.766  21.630   9.669
  181   HG22  THR  22          HG22      THR  22  38.356  20.759   9.071
  182   HG23  THR  22          HG23      THR  22  38.237  21.721  10.542
  183    H    ILE  23           HN       ILE  23  36.083  22.370  11.263
  184    HA   ILE  23           HA       ILE  23  35.269  24.653  12.619
  185    HB   ILE  23           HB       ILE  23  36.916  22.473  13.932
  186   HG12  ILE  23          HG12      ILE  23  35.255  21.337  12.593
  187   HG13  ILE  23          HG11      ILE  23  34.677  21.340  14.257
  188   HG21  ILE  23          HG21      ILE  23  35.600  22.989  15.891
  189   HG22  ILE  23          HG22      ILE  23  34.570  24.084  14.970
  190   HG23  ILE  23          HG23      ILE  23  36.257  24.502  15.267
  191   HD11  ILE  23          HD11      ILE  23  33.727  23.021  11.940
  192   HD12  ILE  23          HD12      ILE  23  33.427  23.521  13.605
  193   HD13  ILE  23          HD13      ILE  23  32.782  21.992  13.015
  194    H    GLU  24           HN       GLU  24  38.592  23.324  12.762
  195    HA   GLU  24           HA       GLU  24  39.773  25.395  14.239
  196    HB2  GLU  24           HB2      GLU  24  41.885  24.780  12.936
  197    HB3  GLU  24           HB1      GLU  24  41.082  23.454  13.776
  198    HG2  GLU  24           HG2      GLU  24  39.952  22.801  11.690
  199    HG3  GLU  24           HG1      GLU  24  40.729  24.140  10.842
  200    H    ASN  25           HN       ASN  25  38.958  25.303  10.795
  201    HA   ASN  25           HA       ASN  25  40.403  27.702  10.101
  202    HB2  ASN  25           HB2      ASN  25  39.499  25.935   8.490
  203    HB3  ASN  25           HB1      ASN  25  37.910  26.661   8.733
  204   HD21  ASN  25          HD21      ASN  25  37.717  27.572   6.597
  205   HD22  ASN  25          HD22      ASN  25  38.729  28.817   6.044
  206    H    VAL  26           HN       VAL  26  37.023  27.050  11.017
  207    HA   VAL  26           HA       VAL  26  36.085  29.735  10.780
  208    HB   VAL  26           HB       VAL  26  35.200  27.623  12.771
  209   HG11  VAL  26          HG11      VAL  26  32.988  28.861  12.420
  210   HG12  VAL  26          HG12      VAL  26  33.943  30.135  11.662
  211   HG13  VAL  26          HG13      VAL  26  34.220  29.711  13.351
  212   HG21  VAL  26          HG21      VAL  26  35.085  26.619  10.611
  213   HG22  VAL  26          HG22      VAL  26  34.495  28.107   9.871
  214   HG23  VAL  26          HG23      VAL  26  33.453  27.187  10.955
  215    H    LYS  27           HN       LYS  27  36.894  27.982  13.778
  216    HA   LYS  27           HA       LYS  27  36.942  30.051  15.594
  217    HB2  LYS  27           HB2      LYS  27  38.893  27.745  15.337
  218    HB3  LYS  27           HB1      LYS  27  38.790  28.784  16.757
  219    HG2  LYS  27           HG2      LYS  27  36.319  28.195  16.869
  220    HG3  LYS  27           HG1      LYS  27  36.643  26.968  15.645
  221    HD2  LYS  27           HD2      LYS  27  38.234  25.854  17.094
  222    HD3  LYS  27           HD1      LYS  27  38.106  27.142  18.292
  223    HE2  LYS  27           HE2      LYS  27  35.715  26.602  18.612
  224    HE3  LYS  27           HE1      LYS  27  35.855  25.298  17.433
  225    HZ1  LYS  27           HZ1      LYS  27  37.677  24.404  18.896
  226    HZ2  LYS  27           HZ2      LYS  27  36.105  24.309  19.532
  227    HZ3  LYS  27           HZ3      LYS  27  37.173  25.514  20.075
  228    H    ALA  28           HN       ALA  28  39.361  29.379  13.119
  229    HA   ALA  28           HA       ALA  28  41.332  31.250  14.089
  230    HB1  ALA  28           HB1      ALA  28  40.920  30.465  11.197
  231    HB2  ALA  28           HB2      ALA  28  41.653  29.370  12.368
  232    HB3  ALA  28           HB3      ALA  28  42.428  30.910  11.998
  233    H    LYS  29           HN       LYS  29  39.043  31.510  11.345
  234    HA   LYS  29           HA       LYS  29  39.473  34.214  10.735
  235    HB2  LYS  29           HB2      LYS  29  37.012  32.482  10.552
  236    HB3  LYS  29           HB1      LYS  29  36.997  34.158  10.002
  237    HG2  LYS  29           HG2      LYS  29  38.556  33.756   8.292
  238    HG3  LYS  29           HG1      LYS  29  39.175  32.294   9.062
  239    HD2  LYS  29           HD2      LYS  29  37.034  31.159   8.614
  240    HD3  LYS  29           HD1      LYS  29  36.434  32.607   7.806
  241    HE2  LYS  29           HE2      LYS  29  38.950  31.144   6.961
  242    HE3  LYS  29           HE1      LYS  29  37.366  30.853   6.239
  243    HZ1  LYS  29           HZ1      LYS  29  37.901  32.514   4.876
  244    HZ2  LYS  29           HZ2      LYS  29  39.175  33.054   5.862
  245    HZ3  LYS  29           HZ3      LYS  29  37.581  33.549   6.183
  246    H    ILE  30           HN       ILE  30  37.701  32.815  13.398
  247    HA   ILE  30           HA       ILE  30  36.443  35.359  14.155
  248    HB   ILE  30           HB       ILE  30  36.625  32.641  15.486
  249   HG12  ILE  30          HG12      ILE  30  34.214  34.105  14.388
  250   HG13  ILE  30          HG11      ILE  30  35.200  33.039  13.388
  251   HG21  ILE  30          HG21      ILE  30  34.820  33.619  17.001
  252   HG22  ILE  30          HG22      ILE  30  35.282  35.204  16.385
  253   HG23  ILE  30          HG23      ILE  30  36.450  34.234  17.282
  254   HD11  ILE  30          HD11      ILE  30  34.820  31.209  15.054
  255   HD12  ILE  30          HD12      ILE  30  33.335  31.762  14.278
  256   HD13  ILE  30          HD13      ILE  30  33.719  32.279  15.920
  257    H    GLN  31           HN       GLN  31  38.681  33.183  15.847
  258    HA   GLN  31           HA       GLN  31  39.565  34.675  17.944
  259    HB2  GLN  31           HB2      GLN  31  40.476  32.482  17.493
  260    HB3  GLN  31           HB1      GLN  31  41.256  33.056  16.023
  261    HG2  GLN  31           HG2      GLN  31  42.776  34.414  17.246
  262    HG3  GLN  31           HG1      GLN  31  41.882  34.202  18.749
  263   HE21  GLN  31          HE21      GLN  31  42.351  31.462  16.582
  264   HE22  GLN  31          HE22      GLN  31  43.469  30.640  17.560
  265    H    ASP  32           HN       ASP  32  40.772  35.056  14.621
  266    HA   ASP  32           HA       ASP  32  42.579  37.222  15.294
  267    HB2  ASP  32           HB2      ASP  32  41.408  36.299  12.659
  268    HB3  ASP  32           HB1      ASP  32  42.586  37.605  12.788
  269    H    LYS  33           HN       LYS  33  39.456  37.235  13.559
  270    HA   LYS  33           HA       LYS  33  39.200  40.034  13.365
  271    HB2  LYS  33           HB2      LYS  33  36.991  38.014  13.668
  272    HB3  LYS  33           HB1      LYS  33  36.804  39.639  13.032
  273    HG2  LYS  33           HG2      LYS  33  38.805  37.764  11.776
  274    HG3  LYS  33           HG1      LYS  33  37.100  37.611  11.365
  275    HD2  LYS  33           HD2      LYS  33  38.429  40.308  11.240
  276    HD3  LYS  33           HD1      LYS  33  38.656  39.168   9.923
  277    HE2  LYS  33           HE2      LYS  33  35.986  40.188  10.947
  278    HE3  LYS  33           HE1      LYS  33  36.758  40.634   9.429
  279    HZ1  LYS  33           HZ1      LYS  33  36.743  37.926   9.355
  280    HZ2  LYS  33           HZ2      LYS  33  35.630  38.941   8.569
  281    HZ3  LYS  33           HZ3      LYS  33  35.258  38.282  10.091
  282    H    GLU  34           HN       GLU  34  37.992  37.898  15.972
  283    HA   GLU  34           HA       GLU  34  37.047  40.244  17.480
  284    HB2  GLU  34           HB2      GLU  34  37.249  37.350  18.377
  285    HB3  GLU  34           HB1      GLU  34  36.339  38.637  19.164
  286    HG2  GLU  34           HG2      GLU  34  34.996  38.900  17.062
  287    HG3  GLU  34           HG1      GLU  34  35.822  37.483  16.412
  288    H    GLY  35           HN       GLY  35  39.833  38.136  17.360
  289    HA2  GLY  35           HA3      GLY  35  41.958  38.513  18.295
  290    HA3  GLY  35           HA2      GLY  35  41.338  39.972  19.064
  291    H    ILE  36           HN       ILE  36  39.248  37.482  19.689
  292    HA   ILE  36           HA       ILE  36  40.156  37.267  22.455
  293    HB   ILE  36           HB       ILE  36  37.798  35.982  21.078
  294   HG12  ILE  36          HG12      ILE  36  37.921  38.547  22.690
  295   HG13  ILE  36          HG11      ILE  36  37.874  38.501  20.929
  296   HG21  ILE  36          HG21      ILE  36  36.923  35.776  23.340
  297   HG22  ILE  36          HG22      ILE  36  38.330  36.607  23.993
  298   HG23  ILE  36          HG23      ILE  36  38.507  35.010  23.273
  299   HD11  ILE  36          HD11      ILE  36  35.799  37.290  22.758
  300   HD12  ILE  36          HD12      ILE  36  35.757  37.289  20.995
  301   HD13  ILE  36          HD13      ILE  36  35.622  38.808  21.882
  302    HA   PRO  37           HA       PRO  37  42.223  33.390  21.423
  303    HB2  PRO  37           HB2      PRO  37  42.886  32.533  23.918
  304    HB3  PRO  37           HB1      PRO  37  43.697  33.909  23.142
  305    HG2  PRO  37           HG2      PRO  37  41.508  33.913  25.177
  306    HG3  PRO  37           HG1      PRO  37  42.966  34.920  25.094
  307    HD2  PRO  37           HD2      PRO  37  40.504  35.798  24.256
  308    HD3  PRO  37           HD1      PRO  37  42.028  36.386  23.555
  309    HA   PRO  38           HA       PRO  38  38.545  30.689  21.516
  310    HB2  PRO  38           HB2      PRO  38  40.802  28.738  21.228
  311    HB3  PRO  38           HB1      PRO  38  39.202  28.716  20.453
  312    HG2  PRO  38           HG2      PRO  38  41.257  29.624  19.122
  313    HG3  PRO  38           HG1      PRO  38  39.722  30.493  19.045
  314    HD2  PRO  38           HD2      PRO  38  42.242  31.246  20.476
  315    HD3  PRO  38           HD1      PRO  38  40.985  32.294  19.775
  316    H    ASP  39           HN       ASP  39  41.300  30.529  23.604
  317    HA   ASP  39           HA       ASP  39  40.514  28.398  25.321
  318    HB2  ASP  39           HB2      ASP  39  42.764  29.455  25.358
  319    HB3  ASP  39           HB1      ASP  39  42.044  30.907  26.055
  320    H    GLN  40           HN       GLN  40  39.816  31.892  25.498
  321    HA   GLN  40           HA       GLN  40  38.100  31.505  27.842
  322    HB2  GLN  40           HB2      GLN  40  38.648  33.957  26.138
  323    HB3  GLN  40           HB1      GLN  40  37.808  33.942  27.688
  324    HG2  GLN  40           HG2      GLN  40  39.841  33.000  28.763
  325    HG3  GLN  40           HG1      GLN  40  40.682  33.108  27.218
  326   HE21  GLN  40          HE21      GLN  40  40.387  34.741  30.077
  327   HE22  GLN  40          HE22      GLN  40  40.671  36.325  29.537
  328    H    GLN  41           HN       GLN  41  37.548  30.599  24.829
  329    HA   GLN  41           HA       GLN  41  34.684  31.503  24.868
  330    HB2  GLN  41           HB2      GLN  41  36.469  31.246  22.430
  331    HB3  GLN  41           HB1      GLN  41  34.743  31.602  22.399
  332    HG2  GLN  41           HG2      GLN  41  35.197  33.632  23.801
  333    HG3  GLN  41           HG1      GLN  41  36.922  33.307  23.633
  334   HE21  GLN  41          HE21      GLN  41  37.716  33.148  21.269
  335   HE22  GLN  41          HE22      GLN  41  36.981  34.169  20.130
  336    H    ARG  42           HN       ARG  42  33.198  29.932  24.361
  337    HA   ARG  42           HA       ARG  42  34.194  27.249  23.489
  338    HB2  ARG  42           HB2      ARG  42  32.333  27.884  25.803
  339    HB3  ARG  42           HB1      ARG  42  32.436  26.284  25.075
  340    HG2  ARG  42           HG2      ARG  42  34.973  27.638  25.974
  341    HG3  ARG  42           HG1      ARG  42  33.930  26.891  27.181
  342    HD2  ARG  42           HD2      ARG  42  34.182  24.739  26.249
  343    HD3  ARG  42           HD1      ARG  42  34.767  25.370  24.711
  344    HE   ARG  42           HE       ARG  42  36.521  26.048  26.933
  345   HH11  ARG  42          HH11      ARG  42  38.538  25.029  26.931
  346   HH12  ARG  42          HH12      ARG  42  38.796  23.648  25.917
  347   HH21  ARG  42          HH21      ARG  42  35.578  23.670  24.621
  348   HH22  ARG  42          HH22      ARG  42  37.119  22.878  24.610
  349    H    LEU  43           HN       LEU  43  32.970  26.567  21.715
  350    HA   LEU  43           HA       LEU  43  30.654  28.223  20.978
  351    HB2  LEU  43           HB2      LEU  43  31.763  25.836  19.507
  352    HB3  LEU  43           HB1      LEU  43  30.772  27.155  18.857
  353    HG   LEU  43           HG       LEU  43  33.651  27.280  19.806
  354   HD11  LEU  43          HD11      LEU  43  33.969  28.138  17.500
  355   HD12  LEU  43          HD12      LEU  43  32.243  27.928  17.208
  356   HD13  LEU  43          HD13      LEU  43  33.263  26.522  17.507
  357   HD21  LEU  43          HD21      LEU  43  32.714  29.293  20.663
  358   HD22  LEU  43          HD22      LEU  43  31.643  29.469  19.274
  359   HD23  LEU  43          HD23      LEU  43  33.374  29.757  19.093
  360    H    ILE  44           HN       ILE  44  28.565  27.432  20.704
  361    HA   ILE  44           HA       ILE  44  27.974  24.701  21.803
  362    HB   ILE  44           HB       ILE  44  26.374  27.260  22.174
  363   HG12  ILE  44          HG12      ILE  44  28.330  27.209  23.636
  364   HG13  ILE  44          HG11      ILE  44  26.879  26.920  24.589
  365   HG21  ILE  44          HG21      ILE  44  24.871  25.356  21.950
  366   HG22  ILE  44          HG22      ILE  44  24.955  25.785  23.661
  367   HG23  ILE  44          HG23      ILE  44  25.858  24.397  23.053
  368   HD11  ILE  44          HD11      ILE  44  29.103  25.043  23.903
  369   HD12  ILE  44          HD12      ILE  44  27.489  24.359  24.069
  370   HD13  ILE  44          HD13      ILE  44  28.220  25.228  25.413
  371    H    PHE  45           HN       PHE  45  26.687  23.484  20.449
  372    HA   PHE  45           HA       PHE  45  25.076  24.844  18.366
  373    HB2  PHE  45           HB2      PHE  45  27.191  24.524  17.239
  374    HB3  PHE  45           HB1      PHE  45  27.310  22.866  17.824
  375    HD1  PHE  45           HD1      PHE  45  25.754  25.104  15.386
  376    HD2  PHE  45           HD2      PHE  45  25.821  21.106  16.939
  377    HE1  PHE  45           HE1      PHE  45  24.493  24.316  13.398
  378    HE2  PHE  45           HE2      PHE  45  24.563  20.311  14.953
  379    HZ   PHE  45           HZ       PHE  45  23.899  21.916  13.182
  380    H    ALA  46           HN       ALA  46  23.118  23.909  18.492
  381    HA   ALA  46           HA       ALA  46  21.445  22.315  18.869
  382    HB1  ALA  46           HB1      ALA  46  23.530  20.376  17.850
  383    HB2  ALA  46           HB2      ALA  46  22.612  21.454  16.800
  384    HB3  ALA  46           HB3      ALA  46  21.777  20.220  17.743
  385    H    GLY  47           HN       GLY  47  23.646  22.672  21.071
  386    HA2  GLY  47           HA3      GLY  47  23.491  21.783  23.289
  387    HA3  GLY  47           HA2      GLY  47  22.716  20.336  22.646
  388    H    LYS  48           HN       LYS  48  25.268  20.949  20.642
  389    HA   LYS  48           HA       LYS  48  27.194  19.332  22.274
  390    HB2  LYS  48           HB2      LYS  48  26.685  19.096  19.316
  391    HB3  LYS  48           HB1      LYS  48  27.827  18.140  20.252
  392    HG2  LYS  48           HG2      LYS  48  26.063  17.083  21.485
  393    HG3  LYS  48           HG1      LYS  48  24.863  18.205  20.851
  394    HD2  LYS  48           HD2      LYS  48  24.630  16.139  19.627
  395    HD3  LYS  48           HD1      LYS  48  25.366  17.318  18.543
  396    HE2  LYS  48           HE2      LYS  48  27.530  16.351  18.795
  397    HE3  LYS  48           HE1      LYS  48  27.023  15.395  20.187
  398    HZ1  LYS  48           HZ1      LYS  48  26.961  13.874  18.479
  399    HZ2  LYS  48           HZ2      LYS  48  26.406  15.001  17.337
  400    HZ3  LYS  48           HZ3      LYS  48  25.347  14.399  18.521
  401    H    GLN  49           HN       GLN  49  29.438  19.834  21.866
  402    HA   GLN  49           HA       GLN  49  29.843  22.551  20.833
  403    HB2  GLN  49           HB2      GLN  49  31.879  20.738  22.065
  404    HB3  GLN  49           HB1      GLN  49  31.959  22.487  21.917
  405    HG2  GLN  49           HG2      GLN  49  29.998  22.686  23.420
  406    HG3  GLN  49           HG1      GLN  49  29.971  20.931  23.597
  407   HE21  GLN  49          HE21      GLN  49  31.147  20.142  25.350
  408   HE22  GLN  49          HE22      GLN  49  32.407  20.970  26.128
  409    H    LEU  50           HN       LEU  50  31.851  22.888  19.430
  410    HA   LEU  50           HA       LEU  50  31.896  20.791  17.309
  411    HB2  LEU  50           HB2      LEU  50  33.115  23.563  17.209
  412    HB3  LEU  50           HB1      LEU  50  32.736  22.501  15.853
  413    HG   LEU  50           HG       LEU  50  30.699  23.735  17.733
  414   HD11  LEU  50          HD11      LEU  50  30.153  25.231  15.968
  415   HD12  LEU  50          HD12      LEU  50  31.108  24.325  14.796
  416   HD13  LEU  50          HD13      LEU  50  31.913  25.258  16.057
  417   HD21  LEU  50          HD21      LEU  50  29.148  22.888  15.835
  418   HD22  LEU  50          HD22      LEU  50  29.772  21.691  16.966
  419   HD23  LEU  50          HD23      LEU  50  30.502  21.858  15.369
  420    H    GLU  51           HN       GLU  51  33.682  19.516  17.081
  421    HA   GLU  51           HA       GLU  51  36.008  20.038  18.852
  422    HB2  GLU  51           HB2      GLU  51  35.355  17.662  17.080
  423    HB3  GLU  51           HB1      GLU  51  36.695  17.754  18.226
  424    HG2  GLU  51           HG2      GLU  51  35.025  18.150  20.056
  425    HG3  GLU  51           HG1      GLU  51  33.738  17.874  18.883
  426    H    ASP  52           HN       ASP  52  38.110  20.334  18.049
  427    HA   ASP  52           HA       ASP  52  38.405  21.729  15.594
  428    HB2  ASP  52           HB2      ASP  52  40.412  20.294  17.348
  429    HB3  ASP  52           HB1      ASP  52  40.884  21.227  15.928
  430    H    GLY  53           HN       GLY  53  39.281  21.055  13.573
  431    HA2  GLY  53           HA3      GLY  53  40.017  19.464  11.950
  432    HA3  GLY  53           HA2      GLY  53  39.762  18.172  13.122
  433    H    ARG  54           HN       ARG  54  38.795  17.494  10.804
  434    HA   ARG  54           HA       ARG  54  36.880  16.924   9.581
  435    HB2  ARG  54           HB2      ARG  54  35.787  17.294  12.376
  436    HB3  ARG  54           HB1      ARG  54  34.774  16.751  11.038
  437    HG2  ARG  54           HG2      ARG  54  36.187  14.822  10.666
  438    HG3  ARG  54           HG1      ARG  54  37.369  15.406  11.838
  439    HD2  ARG  54           HD2      ARG  54  34.499  14.826  12.589
  440    HD3  ARG  54           HD1      ARG  54  35.763  13.601  12.673
  441    HE   ARG  54           HE       ARG  54  36.613  15.963  14.066
  442   HH11  ARG  54          HH11      ARG  54  36.574  15.913  16.324
  443   HH12  ARG  54          HH12      ARG  54  35.613  14.722  17.134
  444   HH21  ARG  54          HH21      ARG  54  34.451  13.281  14.202
  445   HH22  ARG  54          HH22      ARG  54  34.411  13.231  15.934
  446    H    THR  55           HN       THR  55  34.752  17.763   8.759
  447    HA   THR  55           HA       THR  55  34.572  20.743   8.989
  448    HB   THR  55           HB       THR  55  33.826  20.734   6.639
  449    HG1  THR  55           HG1      THR  55  33.141  18.407   6.942
  450   HG21  THR  55          HG21      THR  55  36.190  21.062   6.996
  451   HG22  THR  55          HG22      THR  55  36.005  19.978   5.618
  452   HG23  THR  55          HG23      THR  55  36.450  19.329   7.196
  453    H    LEU  56           HN       LEU  56  32.325  21.522   8.349
  454    HA   LEU  56           HA       LEU  56  30.366  20.355  10.044
  455    HB2  LEU  56           HB2      LEU  56  30.088  22.214   7.666
  456    HB3  LEU  56           HB1      LEU  56  28.767  21.836   8.771
  457    HG   LEU  56           HG       LEU  56  31.384  22.814   9.912
  458   HD11  LEU  56          HD11      LEU  56  30.300  25.164   9.771
  459   HD12  LEU  56          HD12      LEU  56  29.330  24.482   8.464
  460   HD13  LEU  56          HD13      LEU  56  31.087  24.528   8.327
  461   HD21  LEU  56          HD21      LEU  56  29.822  23.803  11.592
  462   HD22  LEU  56          HD22      LEU  56  29.636  22.056  11.455
  463   HD23  LEU  56          HD23      LEU  56  28.463  23.130  10.693
  464    H    SER  57           HN       SER  57  30.901  20.031   6.536
  465    HA   SER  57           HA       SER  57  28.595  18.348   6.088
  466    HB2  SER  57           HB2      SER  57  31.199  18.587   4.546
  467    HB3  SER  57           HB1      SER  57  29.781  17.708   3.981
  468    HG   SER  57           HG       SER  57  28.877  19.540   3.482
  469    H    ASP  58           HN       ASP  58  32.023  17.705   6.694
  470    HA   ASP  58           HA       ASP  58  31.989  14.891   6.553
  471    HB2  ASP  58           HB2      ASP  58  34.015  16.391   6.901
  472    HB3  ASP  58           HB1      ASP  58  33.566  16.452   8.605
  473    H    TYR  59           HN       TYR  59  30.936  17.021   9.201
  474    HA   TYR  59           HA       TYR  59  30.603  14.828  11.077
  475    HB2  TYR  59           HB2      TYR  59  29.660  17.697  10.995
  476    HB3  TYR  59           HB1      TYR  59  29.079  16.598  12.243
  477    HD1  TYR  59           HD1      TYR  59  31.567  18.959  11.507
  478    HD2  TYR  59           HD2      TYR  59  31.034  15.117  13.359
  479    HE1  TYR  59           HE1      TYR  59  33.649  19.297  12.809
  480    HE2  TYR  59           HE2      TYR  59  33.117  15.457  14.660
  481    HH   TYR  59           HH       TYR  59  34.550  17.197  15.410
  482    H    ASN  60           HN       ASN  60  28.704  16.123   8.456
  483    HA   ASN  60           HA       ASN  60  26.661  15.421   7.580
  484    HB2  ASN  60           HB2      ASN  60  27.761  13.125   8.142
  485    HB3  ASN  60           HB1      ASN  60  26.662  13.104   9.520
  486   HD21  ASN  60          HD21      ASN  60  25.241  11.448   8.737
  487   HD22  ASN  60          HD22      ASN  60  24.280  11.645   7.352
  488    H    ILE  61           HN       ILE  61  26.610  17.353   9.578
  489    HA   ILE  61           HA       ILE  61  24.719  16.691  11.675
  490    HB   ILE  61           HB       ILE  61  24.597  19.175  11.983
  491   HG12  ILE  61          HG12      ILE  61  26.607  19.268   9.711
  492   HG13  ILE  61          HG11      ILE  61  24.907  19.695   9.523
  493   HG21  ILE  61          HG21      ILE  61  26.395  17.751  13.004
  494   HG22  ILE  61          HG22      ILE  61  26.895  19.420  12.723
  495   HG23  ILE  61          HG23      ILE  61  27.424  18.143  11.628
  496   HD11  ILE  61          HD11      ILE  61  25.148  21.433  11.255
  497   HD12  ILE  61          HD12      ILE  61  26.284  21.701   9.933
  498   HD13  ILE  61          HD13      ILE  61  26.847  21.002  11.453
  499    H    GLN  62           HN       GLN  62  22.481  17.305  11.767
  500    HA   GLN  62           HA       GLN  62  21.224  18.344   9.294
  501    HB2  GLN  62           HB2      GLN  62  19.550  16.386   9.423
  502    HB3  GLN  62           HB1      GLN  62  21.142  16.035   8.749
  503    HG2  GLN  62           HG2      GLN  62  21.895  15.141  10.896
  504    HG3  GLN  62           HG1      GLN  62  20.353  15.567  11.639
  505   HE21  GLN  62          HE21      GLN  62  21.847  12.872  10.776
  506   HE22  GLN  62          HE22      GLN  62  20.575  11.973  10.099
  507    H    LYS  63           HN       LYS  63  21.042  20.025  11.126
  508    HA   LYS  63           HA       LYS  63  18.703  19.439  12.913
  509    HB2  LYS  63           HB2      LYS  63  20.736  20.177  14.092
  510    HB3  LYS  63           HB1      LYS  63  20.803  21.624  13.085
  511    HG2  LYS  63           HG2      LYS  63  18.695  22.421  13.980
  512    HG3  LYS  63           HG1      LYS  63  18.446  20.909  14.854
  513    HD2  LYS  63           HD2      LYS  63  20.327  21.352  16.294
  514    HD3  LYS  63           HD1      LYS  63  20.804  22.750  15.332
  515    HE2  LYS  63           HE2      LYS  63  18.672  23.866  15.916
  516    HE3  LYS  63           HE1      LYS  63  18.223  22.475  16.902
  517    HZ1  LYS  63           HZ1      LYS  63  19.694  23.017  18.506
  518    HZ2  LYS  63           HZ2      LYS  63  19.467  24.582  17.886
  519    HZ3  LYS  63           HZ3      LYS  63  20.826  23.671  17.426
  520    H    GLU  64           HN       GLU  64  19.928  21.543  10.373
  521    HA   GLU  64           HA       GLU  64  17.274  22.364   9.615
  522    HB2  GLU  64           HB2      GLU  64  17.532  23.769  11.654
  523    HB3  GLU  64           HB1      GLU  64  18.992  24.475  10.961
  524    HG2  GLU  64           HG2      GLU  64  17.717  25.372   9.084
  525    HG3  GLU  64           HG1      GLU  64  16.251  24.584   9.669
  526    H    SEP  65           HN       SEP  65  17.339  23.652   7.654
  527    HA   SEP  65           HA       SEP  65  19.380  23.064   5.839
  528    HB2  SEP  65           HB1      SEP  65  17.410  25.345   5.979
  529    HB3  SEP  65           HB2      SEP  65  17.397  23.948   4.907
  530    H    TPO  66           HN       TPO  66  18.985  26.211   7.518
  531    HA   TPO  66           HA       TPO  66  21.722  26.983   6.808
  532    HB   TPO  66           HB       TPO  66  21.217  29.045   8.038
  533   HG21  TPO  66          HG21      TPO  66  20.314  28.694   5.719
  534   HG22  TPO  66          HG22      TPO  66  19.366  29.823   6.687
  535   HG23  TPO  66          HG23      TPO  66  18.795  28.172   6.445
  536    H    LEU  67           HN       LEU  67  23.486  27.037   8.216
  537    HA   LEU  67           HA       LEU  67  23.221  25.388  10.667
  538    HB2  LEU  67           HB2      LEU  67  25.749  26.619   9.547
  539    HB3  LEU  67           HB1      LEU  67  25.604  25.231  10.624
  540    HG   LEU  67           HG       LEU  67  24.635  25.346   7.753
  541   HD11  LEU  67          HD11      LEU  67  26.430  23.629   7.420
  542   HD12  LEU  67          HD12      LEU  67  26.970  23.934   9.071
  543   HD13  LEU  67          HD13      LEU  67  27.059  25.216   7.865
  544   HD21  LEU  67          HD21      LEU  67  23.174  23.864   8.896
  545   HD22  LEU  67          HD22      LEU  67  24.469  23.245   9.924
  546   HD23  LEU  67          HD23      LEU  67  24.410  22.807   8.216
  547    H    HIS  68           HN       HIS  68  22.861  26.387  12.577
  548    HA   HIS  68           HA       HIS  68  23.629  29.265  12.885
  549    HB2  HIS  68           HB2      HIS  68  22.068  29.107  14.894
  550    HB3  HIS  68           HB1      HIS  68  21.298  28.938  13.315
  551    HD1  HIS  68           HD1      HIS  68  20.807  26.411  12.526
  552    HD2  HIS  68           HD2      HIS  68  21.762  26.887  16.559
  553    HE1  HIS  68           HE1      HIS  68  20.102  24.272  13.687
  554    HE2  HIS  68           HE2      HIS  68  20.677  24.553  16.142
  555    H    LEU  69           HN       LEU  69  25.304  29.733  14.184
  556    HA   LEU  69           HA       LEU  69  26.178  27.738  16.260
  557    HB2  LEU  69           HB2      LEU  69  27.788  29.331  14.257
  558    HB3  LEU  69           HB1      LEU  69  28.507  28.897  15.801
  559    HG   LEU  69           HG       LEU  69  27.866  26.482  15.300
  560   HD11  LEU  69          HD11      LEU  69  26.292  26.485  13.581
  561   HD12  LEU  69          HD12      LEU  69  27.758  26.169  12.668
  562   HD13  LEU  69          HD13      LEU  69  27.078  27.794  12.706
  563   HD21  LEU  69          HD21      LEU  69  29.819  26.154  13.847
  564   HD22  LEU  69          HD22      LEU  69  30.158  27.393  15.057
  565   HD23  LEU  69          HD23      LEU  69  29.785  27.859  13.397
  566    H    VAL  70           HN       VAL  70  26.871  28.741  18.289
  567    HA   VAL  70           HA       VAL  70  26.566  31.716  18.420
  568    HB   VAL  70           HB       VAL  70  25.378  31.227  20.693
  569   HG11  VAL  70          HG11      VAL  70  24.115  30.837  17.971
  570   HG12  VAL  70          HG12      VAL  70  24.155  32.304  18.949
  571   HG13  VAL  70          HG13      VAL  70  23.161  30.939  19.453
  572   HG21  VAL  70          HG21      VAL  70  25.913  28.721  20.422
  573   HG22  VAL  70          HG22      VAL  70  24.615  28.690  19.231
  574   HG23  VAL  70          HG23      VAL  70  24.268  29.132  20.902
  575    H    LEU  71           HN       LEU  71  28.286  32.576  19.434
  576    HA   LEU  71           HA       LEU  71  30.245  30.842  20.745
  577    HB2  LEU  71           HB2      LEU  71  30.076  33.801  20.155
  578    HB3  LEU  71           HB1      LEU  71  31.372  33.147  21.153
  579    HG   LEU  71           HG       LEU  71  32.144  31.735  19.363
  580   HD11  LEU  71          HD11      LEU  71  30.956  31.903  17.103
  581   HD12  LEU  71          HD12      LEU  71  29.609  32.631  17.977
  582   HD13  LEU  71          HD13      LEU  71  30.114  30.984  18.350
  583   HD21  LEU  71          HD21      LEU  71  32.995  33.972  19.186
  584   HD22  LEU  71          HD22      LEU  71  31.492  34.554  18.468
  585   HD23  LEU  71          HD23      LEU  71  32.546  33.477  17.555
  586    H    ARG  72           HN       ARG  72  30.741  30.809  22.971
  587    HA   ARG  72           HA       ARG  72  28.855  32.284  24.784
  588    HB2  ARG  72           HB2      ARG  72  28.673  29.715  24.642
  589    HB3  ARG  72           HB1      ARG  72  30.253  29.676  25.422
  590    HG2  ARG  72           HG2      ARG  72  29.390  30.935  27.326
  591    HG3  ARG  72           HG1      ARG  72  27.821  31.105  26.537
  592    HD2  ARG  72           HD2      ARG  72  27.603  28.619  26.520
  593    HD3  ARG  72           HD1      ARG  72  29.117  28.509  27.417
  594    HE   ARG  72           HE       ARG  72  27.423  30.243  28.870
  595   HH11  ARG  72          HH11      ARG  72  26.240  29.439  30.623
  596   HH12  ARG  72          HH12      ARG  72  25.918  27.740  30.727
  597   HH21  ARG  72          HH21      ARG  72  27.585  26.974  27.785
  598   HH22  ARG  72          HH22      ARG  72  26.680  26.345  29.120
  599    H    LEU  73           HN       LEU  73  29.895  32.767  26.954
  600    HA   LEU  73           HA       LEU  73  32.713  33.609  26.525
  601    HB2  LEU  73           HB2      LEU  73  30.766  35.105  27.441
  602    HB3  LEU  73           HB1      LEU  73  31.045  34.251  28.957
  603    HG   LEU  73           HG       LEU  73  33.585  34.890  28.490
  604   HD11  LEU  73          HD11      LEU  73  32.194  37.213  27.142
  605   HD12  LEU  73          HD12      LEU  73  32.900  35.891  26.219
  606   HD13  LEU  73          HD13      LEU  73  33.924  36.891  27.245
  607   HD21  LEU  73          HD21      LEU  73  32.380  35.673  30.445
  608   HD22  LEU  73          HD22      LEU  73  31.465  36.826  29.473
  609   HD23  LEU  73          HD23      LEU  73  33.198  37.055  29.715
  610    H    ARG  74           HN       ARG  74  34.274  33.247  28.302
  611    HA   ARG  74           HA       ARG  74  33.645  31.101  30.227
  612    HB2  ARG  74           HB2      ARG  74  34.351  29.970  28.062
  613    HB3  ARG  74           HB1      ARG  74  35.929  30.731  28.272
  614    HG2  ARG  74           HG2      ARG  74  36.010  29.682  30.582
  615    HG3  ARG  74           HG1      ARG  74  34.579  28.757  30.128
  616    HD2  ARG  74           HD2      ARG  74  35.827  27.857  28.165
  617    HD3  ARG  74           HD1      ARG  74  37.265  28.712  28.722
  618    HE   ARG  74           HE       ARG  74  36.231  27.060  30.834
  619   HH11  ARG  74          HH11      ARG  74  37.342  25.148  31.298
  620   HH12  ARG  74          HH12      ARG  74  38.429  24.487  30.123
  621   HH21  ARG  74          HH21      ARG  74  37.868  27.000  27.801
  622   HH22  ARG  74          HH22      ARG  74  38.726  25.535  28.144
  623    H    GLY  75           HN       GLY  75  34.576  31.748  32.100
  624    HA2  GLY  75           HA3      GLY  75  37.129  32.203  32.811
  625    HA3  GLY  75           HA2      GLY  75  36.764  33.741  32.026
  626    H    GLY  76           HN       GLY  76  36.385  31.881  34.895
  627    HA2  GLY  76           HA3      GLY  76  35.289  32.333  36.926
  628    HA3  GLY  76           HA2      GLY  76  35.691  34.013  36.560
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1  26.802  27.615   3.903
    2    H2   MET   1           HT2      MET   1  28.413  27.109   4.095
    3    H3   MET   1           HT3      MET   1  27.532  26.648   2.717
    4    HA   MET   1           HA       MET   1  29.211  28.530   2.462
    5    HB2  MET   1           HB2      MET   1  27.462  27.931   0.795
    6    HB3  MET   1           HB1      MET   1  26.322  28.974   1.648
    7    HG2  MET   1           HG2      MET   1  27.731  30.923   1.227
    8    HG3  MET   1           HG1      MET   1  28.954  29.905   0.466
    9    HE1  MET   1           HE1      MET   1  27.841  32.422  -0.763
   10    HE2  MET   1           HE2      MET   1  27.398  32.023  -2.420
   11    HE3  MET   1           HE3      MET   1  28.912  31.419  -1.750
   12    H    GLN   2           HN       GLN   2  26.037  29.979   3.128
   13    HA   GLN   2           HA       GLN   2  27.356  32.223   4.488
   14    HB2  GLN   2           HB2      GLN   2  24.385  31.716   4.193
   15    HB3  GLN   2           HB1      GLN   2  25.187  33.259   4.490
   16    HG2  GLN   2           HG2      GLN   2  26.306  33.087   2.284
   17    HG3  GLN   2           HG1      GLN   2  25.454  31.572   1.984
   18   HE21  GLN   2          HE21      GLN   2  24.946  35.076   2.459
   19   HE22  GLN   2          HE22      GLN   2  23.409  35.115   1.741
   20    H    ILE   3           HN       ILE   3  28.194  30.929   6.320
   21    HA   ILE   3           HA       ILE   3  26.206  29.807   8.189
   22    HB   ILE   3           HB       ILE   3  28.331  29.458   9.612
   23   HG12  ILE   3          HG12      ILE   3  29.667  30.110   6.968
   24   HG13  ILE   3          HG11      ILE   3  29.627  31.225   8.333
   25   HG21  ILE   3          HG21      ILE   3  28.116  28.218   6.850
   26   HG22  ILE   3          HG22      ILE   3  27.299  27.658   8.309
   27   HG23  ILE   3          HG23      ILE   3  29.056  27.553   8.187
   28   HD11  ILE   3          HD11      ILE   3  30.671  29.405   9.740
   29   HD12  ILE   3          HD12      ILE   3  31.710  30.018   8.454
   30   HD13  ILE   3          HD13      ILE   3  30.885  28.472   8.258
   31    H    PHE   4           HN       PHE   4  25.399  30.888   9.930
   32    HA   PHE   4           HA       PHE   4  26.270  33.697  10.344
   33    HB2  PHE   4           HB2      PHE   4  23.924  32.107  11.426
   34    HB3  PHE   4           HB1      PHE   4  24.242  33.797  11.816
   35    HD1  PHE   4           HD1      PHE   4  23.161  31.444   9.212
   36    HD2  PHE   4           HD2      PHE   4  24.052  35.551  10.104
   37    HE1  PHE   4           HE1      PHE   4  22.034  32.144   7.116
   38    HE2  PHE   4           HE2      PHE   4  22.926  36.252   8.009
   39    HZ   PHE   4           HZ       PHE   4  21.916  34.548   6.514
   40    H    VAL   5           HN       VAL   5  26.686  34.466  12.550
   41    HA   VAL   5           HA       VAL   5  27.419  32.367  14.538
   42    HB   VAL   5           HB       VAL   5  29.285  34.605  13.684
   43   HG11  VAL   5          HG11      VAL   5  30.878  33.218  15.135
   44   HG12  VAL   5          HG12      VAL   5  29.442  32.391  15.737
   45   HG13  VAL   5          HG13      VAL   5  29.634  34.125  15.993
   46   HG21  VAL   5          HG21      VAL   5  29.334  32.981  11.937
   47   HG22  VAL   5          HG22      VAL   5  29.221  31.640  13.077
   48   HG23  VAL   5          HG23      VAL   5  30.707  32.582  12.969
   49    H    LYS   6           HN       LYS   6  26.050  32.984  16.166
   50    HA   LYS   6           HA       LYS   6  25.748  35.896  16.771
   51    HB2  LYS   6           HB2      LYS   6  23.688  34.547  16.421
   52    HB3  LYS   6           HB1      LYS   6  24.153  33.521  17.779
   53    HG2  LYS   6           HG2      LYS   6  24.077  35.438  19.297
   54    HG3  LYS   6           HG1      LYS   6  23.705  36.516  17.951
   55    HD2  LYS   6           HD2      LYS   6  21.613  35.272  17.532
   56    HD3  LYS   6           HD1      LYS   6  21.981  34.204  18.887
   57    HE2  LYS   6           HE2      LYS   6  21.946  36.127  20.426
   58    HE3  LYS   6           HE1      LYS   6  21.596  37.206  19.075
   59    HZ1  LYS   6           HZ1      LYS   6  19.500  36.790  19.805
   60    HZ2  LYS   6           HZ2      LYS   6  19.872  35.236  20.383
   61    HZ3  LYS   6           HZ3      LYS   6  19.656  35.498  18.719
   62    H    THR   7           HN       THR   7  26.774  36.721  18.521
   63    HA   THR   7           HA       THR   7  28.140  34.872  20.398
   64    HB   THR   7           HB       THR   7  29.310  36.858  21.184
   65    HG1  THR   7           HG1      THR   7  27.310  38.164  20.848
   66   HG21  THR   7          HG21      THR   7  30.326  37.614  19.043
   67   HG22  THR   7          HG22      THR   7  29.019  36.819  18.167
   68   HG23  THR   7          HG23      THR   7  30.153  35.860  19.117
   69    H    LEU   8           HN       LEU   8  28.103  35.989  22.793
   70    HA   LEU   8           HA       LEU   8  25.312  35.752  23.636
   71    HB2  LEU   8           HB2      LEU   8  27.679  36.569  25.339
   72    HB3  LEU   8           HB1      LEU   8  26.163  35.850  25.879
   73    HG   LEU   8           HG       LEU   8  28.276  34.513  24.164
   74   HD11  LEU   8          HD11      LEU   8  28.636  34.806  26.696
   75   HD12  LEU   8          HD12      LEU   8  28.738  33.162  26.067
   76   HD13  LEU   8          HD13      LEU   8  27.279  33.699  26.899
   77   HD21  LEU   8          HD21      LEU   8  26.720  32.481  24.640
   78   HD22  LEU   8          HD22      LEU   8  26.226  33.621  23.390
   79   HD23  LEU   8          HD23      LEU   8  25.486  33.692  24.990
   80    H    THR   9           HN       THR   9  27.582  38.344  23.034
   81    HA   THR   9           HA       THR   9  25.999  40.358  24.447
   82    HB   THR   9           HB       THR   9  27.575  41.961  23.421
   83    HG1  THR   9           HG1      THR   9  29.299  40.345  22.298
   84   HG21  THR   9          HG21      THR   9  29.636  41.070  24.430
   85   HG22  THR   9          HG22      THR   9  28.927  39.455  24.461
   86   HG23  THR   9          HG23      THR   9  28.243  40.737  25.460
   87    H    GLY  10           HN       GLY  10  25.355  38.645  21.741
   88    HA2  GLY  10           HA3      GLY  10  23.542  39.033  20.237
   89    HA3  GLY  10           HA2      GLY  10  23.537  40.732  20.711
   90    H    LYS  11           HN       LYS  11  26.655  40.381  20.280
   91    HA   LYS  11           HA       LYS  11  26.751  41.691  17.745
   92    HB2  LYS  11           HB2      LYS  11  28.894  40.175  19.266
   93    HB3  LYS  11           HB1      LYS  11  29.206  41.156  17.834
   94    HG2  LYS  11           HG2      LYS  11  28.290  43.136  18.982
   95    HG3  LYS  11           HG1      LYS  11  27.969  42.159  20.415
   96    HD2  LYS  11           HD2      LYS  11  30.387  41.648  20.595
   97    HD3  LYS  11           HD1      LYS  11  30.696  42.665  19.187
   98    HE2  LYS  11           HE2      LYS  11  29.422  43.617  21.770
   99    HE3  LYS  11           HE1      LYS  11  31.103  43.886  21.311
  100    HZ1  LYS  11           HZ1      LYS  11  30.099  44.894  19.198
  101    HZ2  LYS  11           HZ2      LYS  11  30.040  45.806  20.630
  102    HZ3  LYS  11           HZ3      LYS  11  28.656  44.984  20.085
  103    H    THR  12           HN       THR  12  25.645  40.496  16.165
  104    HA   THR  12           HA       THR  12  26.605  37.725  15.590
  105    HB   THR  12           HB       THR  12  24.204  39.238  14.523
  106    HG1  THR  12           HG1      THR  12  23.904  36.989  16.076
  107   HG21  THR  12          HG21      THR  12  23.539  36.896  13.798
  108   HG22  THR  12          HG22      THR  12  25.194  36.404  14.158
  109   HG23  THR  12          HG23      THR  12  24.883  37.607  12.906
  110    H    ILE  13           HN       ILE  13  28.022  37.450  13.927
  111    HA   ILE  13           HA       ILE  13  28.241  39.606  11.854
  112    HB   ILE  13           HB       ILE  13  30.312  37.624  12.851
  113   HG12  ILE  13          HG12      ILE  13  30.275  40.647  13.071
  114   HG13  ILE  13          HG11      ILE  13  29.713  39.580  14.359
  115   HG21  ILE  13          HG21      ILE  13  30.687  38.041  10.509
  116   HG22  ILE  13          HG22      ILE  13  31.838  39.036  11.401
  117   HG23  ILE  13          HG23      ILE  13  30.389  39.768  10.712
  118   HD11  ILE  13          HD11      ILE  13  32.495  39.599  13.152
  119   HD12  ILE  13          HD12      ILE  13  31.937  38.476  14.392
  120   HD13  ILE  13          HD13      ILE  13  32.053  40.199  14.750
  121    H    THR  14           HN       THR  14  28.621  38.845   9.654
  122    HA   THR  14           HA       THR  14  27.488  36.111   9.163
  123    HB   THR  14           HB       THR  14  27.645  38.528   7.333
  124    HG1  THR  14           HG1      THR  14  25.475  38.690   7.734
  125   HG21  THR  14          HG21      THR  14  26.473  35.759   6.994
  126   HG22  THR  14          HG22      THR  14  27.733  36.517   6.019
  127   HG23  THR  14          HG23      THR  14  26.077  37.115   5.939
  128    H    LEU  15           HN       LEU  15  28.891  34.614   8.408
  129    HA   LEU  15           HA       LEU  15  31.408  35.535   7.039
  130    HB2  LEU  15           HB2      LEU  15  31.085  33.027   8.708
  131    HB3  LEU  15           HB1      LEU  15  32.581  33.692   8.058
  132    HG   LEU  15           HG       LEU  15  30.817  35.087  10.094
  133   HD11  LEU  15          HD11      LEU  15  33.464  33.645  10.441
  134   HD12  LEU  15          HD12      LEU  15  31.902  33.062  11.011
  135   HD13  LEU  15          HD13      LEU  15  32.603  34.527  11.700
  136   HD21  LEU  15          HD21      LEU  15  33.025  36.436  10.333
  137   HD22  LEU  15          HD22      LEU  15  32.020  36.763   8.924
  138   HD23  LEU  15          HD23      LEU  15  33.454  35.748   8.766
  139    H    GLU  16           HN       GLU  16  31.337  34.953   4.932
  140    HA   GLU  16           HA       GLU  16  29.627  32.663   4.105
  141    HB2  GLU  16           HB2      GLU  16  31.099  34.777   2.502
  142    HB3  GLU  16           HB1      GLU  16  30.105  33.500   1.800
  143    HG2  GLU  16           HG2      GLU  16  28.148  34.324   3.050
  144    HG3  GLU  16           HG1      GLU  16  29.137  35.597   3.766
  145    H    VAL  17           HN       VAL  17  30.650  30.719   4.155
  146    HA   VAL  17           HA       VAL  17  33.156  30.379   2.679
  147    HB   VAL  17           HB       VAL  17  34.152  31.015   4.753
  148   HG11  VAL  17          HG11      VAL  17  32.226  30.934   6.203
  149   HG12  VAL  17          HG12      VAL  17  33.461  29.886   6.900
  150   HG13  VAL  17          HG13      VAL  17  32.101  29.184   6.022
  151   HG21  VAL  17          HG21      VAL  17  35.389  29.078   5.337
  152   HG22  VAL  17          HG22      VAL  17  34.892  28.790   3.670
  153   HG23  VAL  17          HG23      VAL  17  34.030  28.008   4.994
  154    H    GLU  18           HN       GLU  18  33.481  28.191   2.099
  155    HA   GLU  18           HA       GLU  18  31.229  26.580   1.763
  156    HB2  GLU  18           HB2      GLU  18  34.149  25.810   1.938
  157    HB3  GLU  18           HB1      GLU  18  32.885  24.681   1.451
  158    HG2  GLU  18           HG2      GLU  18  32.245  26.172  -0.399
  159    HG3  GLU  18           HG1      GLU  18  33.487  27.326   0.093
  160    HA   PRO  19           HA       PRO  19  30.618  24.820   5.820
  161    HB2  PRO  19           HB2      PRO  19  29.117  22.645   5.247
  162    HB3  PRO  19           HB1      PRO  19  28.503  24.291   4.986
  163    HG2  PRO  19           HG2      PRO  19  29.690  22.390   3.001
  164    HG3  PRO  19           HG1      PRO  19  28.224  23.382   2.865
  165    HD2  PRO  19           HD2      PRO  19  30.622  24.138   1.770
  166    HD3  PRO  19           HD1      PRO  19  29.414  25.308   2.349
  167    H    SER  20           HN       SER  20  32.241  22.941   3.352
  168    HA   SER  20           HA       SER  20  32.869  20.695   5.085
  169    HB2  SER  20           HB2      SER  20  34.469  21.446   2.642
  170    HB3  SER  20           HB1      SER  20  34.122  19.844   3.291
  171    HG   SER  20           HG       SER  20  31.941  20.169   2.710
  172    H    ASP  21           HN       ASP  21  33.938  23.859   5.057
  173    HA   ASP  21           HA       ASP  21  36.726  23.658   5.482
  174    HB2  ASP  21           HB2      ASP  21  34.574  25.554   6.413
  175    HB3  ASP  21           HB1      ASP  21  36.220  25.737   7.002
  176    H    THR  22           HN       THR  22  37.915  23.546   7.536
  177    HA   THR  22           HA       THR  22  36.674  21.655   9.398
  178    HB   THR  22           HB       THR  22  38.887  21.638  10.479
  179    HG1  THR  22           HG1      THR  22  40.396  23.080   9.940
  180   HG21  THR  22          HG21      THR  22  38.831  21.498   7.460
  181   HG22  THR  22          HG22      THR  22  38.686  20.168   8.608
  182   HG23  THR  22          HG23      THR  22  40.229  20.999   8.410
  183    H    ILE  23           HN       ILE  23  36.109  22.084  11.531
  184    HA   ILE  23           HA       ILE  23  35.045  24.550  12.252
  185    HB   ILE  23           HB       ILE  23  36.376  22.771  14.306
  186   HG12  ILE  23          HG12      ILE  23  33.803  21.844  14.221
  187   HG13  ILE  23          HG11      ILE  23  34.020  22.235  12.520
  188   HG21  ILE  23          HG21      ILE  23  35.377  24.992  14.956
  189   HG22  ILE  23          HG22      ILE  23  34.640  23.604  15.758
  190   HG23  ILE  23          HG23      ILE  23  33.813  24.385  14.410
  191   HD11  ILE  23          HD11      ILE  23  34.814  20.067  12.536
  192   HD12  ILE  23          HD12      ILE  23  35.397  20.178  14.195
  193   HD13  ILE  23          HD13      ILE  23  36.318  20.917  12.888
  194    H    GLU  24           HN       GLU  24  38.312  23.392  13.166
  195    HA   GLU  24           HA       GLU  24  39.241  25.623  14.541
  196    HB2  GLU  24           HB2      GLU  24  41.509  25.057  13.489
  197    HB3  GLU  24           HB1      GLU  24  40.704  23.748  14.354
  198    HG2  GLU  24           HG2      GLU  24  39.825  22.869  12.233
  199    HG3  GLU  24           HG1      GLU  24  40.592  24.193  11.356
  200    H    ASN  25           HN       ASN  25  38.718  25.268  11.080
  201    HA   ASN  25           HA       ASN  25  40.112  27.660  10.280
  202    HB2  ASN  25           HB2      ASN  25  39.274  25.760   8.761
  203    HB3  ASN  25           HB1      ASN  25  37.680  26.503   8.895
  204   HD21  ASN  25          HD21      ASN  25  37.555  27.288   6.712
  205   HD22  ASN  25          HD22      ASN  25  38.598  28.483   6.108
  206    H    VAL  26           HN       VAL  26  36.774  26.951  11.241
  207    HA   VAL  26           HA       VAL  26  35.709  29.566  10.807
  208    HB   VAL  26           HB       VAL  26  34.927  27.614  12.996
  209   HG11  VAL  26          HG11      VAL  26  32.671  28.666  12.577
  210   HG12  VAL  26          HG12      VAL  26  33.483  29.846  11.548
  211   HG13  VAL  26          HG13      VAL  26  33.868  29.761  13.267
  212   HG21  VAL  26          HG21      VAL  26  33.295  26.757  11.303
  213   HG22  VAL  26          HG22      VAL  26  34.972  26.437  10.862
  214   HG23  VAL  26          HG23      VAL  26  34.089  27.752  10.083
  215    H    LYS  27           HN       LYS  27  36.669  28.065  13.904
  216    HA   LYS  27           HA       LYS  27  36.672  30.179  15.633
  217    HB2  LYS  27           HB2      LYS  27  38.828  28.075  15.294
  218    HB3  LYS  27           HB1      LYS  27  38.713  29.142  16.694
  219    HG2  LYS  27           HG2      LYS  27  36.340  28.307  17.006
  220    HG3  LYS  27           HG1      LYS  27  36.687  27.092  15.773
  221    HD2  LYS  27           HD2      LYS  27  38.683  26.389  17.167
  222    HD3  LYS  27           HD1      LYS  27  38.073  27.443  18.443
  223    HE2  LYS  27           HE2      LYS  27  37.218  25.265  18.933
  224    HE3  LYS  27           HE1      LYS  27  35.867  26.173  18.255
  225    HZ1  LYS  27           HZ1      LYS  27  37.421  23.990  17.079
  226    HZ2  LYS  27           HZ2      LYS  27  36.818  25.188  16.035
  227    HZ3  LYS  27           HZ3      LYS  27  35.754  24.290  17.008
  228    H    ALA  28           HN       ALA  28  38.871  29.734  12.943
  229    HA   ALA  28           HA       ALA  28  40.813  31.712  13.711
  230    HB1  ALA  28           HB1      ALA  28  40.092  31.119  10.839
  231    HB2  ALA  28           HB2      ALA  28  40.914  29.908  11.823
  232    HB3  ALA  28           HB3      ALA  28  41.676  31.472  11.531
  233    H    LYS  29           HN       LYS  29  38.140  31.911  11.339
  234    HA   LYS  29           HA       LYS  29  38.247  34.664  10.813
  235    HB2  LYS  29           HB2      LYS  29  35.919  32.743  10.974
  236    HB3  LYS  29           HB1      LYS  29  35.665  34.441  10.573
  237    HG2  LYS  29           HG2      LYS  29  35.905  33.169   8.510
  238    HG3  LYS  29           HG1      LYS  29  37.314  34.209   8.711
  239    HD2  LYS  29           HD2      LYS  29  38.689  32.396   9.401
  240    HD3  LYS  29           HD1      LYS  29  37.299  31.347   9.682
  241    HE2  LYS  29           HE2      LYS  29  36.814  31.329   7.268
  242    HE3  LYS  29           HE1      LYS  29  38.185  32.400   6.979
  243    HZ1  LYS  29           HZ1      LYS  29  39.687  30.748   7.699
  244    HZ2  LYS  29           HZ2      LYS  29  38.615  29.971   6.633
  245    HZ3  LYS  29           HZ3      LYS  29  38.447  29.766   8.312
  246    H    ILE  30           HN       ILE  30  37.037  33.006  13.640
  247    HA   ILE  30           HA       ILE  30  35.785  35.384  14.786
  248    HB   ILE  30           HB       ILE  30  36.503  32.632  15.822
  249   HG12  ILE  30          HG12      ILE  30  34.115  32.365  15.992
  250   HG13  ILE  30          HG11      ILE  30  33.841  34.086  15.723
  251   HG21  ILE  30          HG21      ILE  30  36.916  33.995  17.748
  252   HG22  ILE  30          HG22      ILE  30  35.272  33.388  17.949
  253   HG23  ILE  30          HG23      ILE  30  35.541  35.040  17.391
  254   HD11  ILE  30          HD11      ILE  30  35.187  32.311  13.677
  255   HD12  ILE  30          HD12      ILE  30  34.529  33.929  13.437
  256   HD13  ILE  30          HD13      ILE  30  33.445  32.567  13.711
  257    H    GLN  31           HN       GLN  31  38.545  33.458  15.882
  258    HA   GLN  31           HA       GLN  31  39.729  35.211  17.653
  259    HB2  GLN  31           HB2      GLN  31  40.607  32.985  17.291
  260    HB3  GLN  31           HB1      GLN  31  41.081  33.393  15.645
  261    HG2  GLN  31           HG2      GLN  31  42.750  34.908  16.401
  262    HG3  GLN  31           HG1      GLN  31  42.149  34.868  18.057
  263   HE21  GLN  31          HE21      GLN  31  43.956  33.017  15.622
  264   HE22  GLN  31          HE22      GLN  31  44.572  31.864  16.704
  265    H    ASP  32           HN       ASP  32  40.430  35.144  14.124
  266    HA   ASP  32           HA       ASP  32  42.217  37.374  14.196
  267    HB2  ASP  32           HB2      ASP  32  41.998  35.636  12.368
  268    HB3  ASP  32           HB1      ASP  32  40.564  36.504  11.822
  269    H    LYS  33           HN       LYS  33  38.730  37.331  14.192
  270    HA   LYS  33           HA       LYS  33  38.628  40.179  13.353
  271    HB2  LYS  33           HB2      LYS  33  36.377  38.254  13.881
  272    HB3  LYS  33           HB1      LYS  33  36.222  39.859  13.189
  273    HG2  LYS  33           HG2      LYS  33  38.007  37.802  11.881
  274    HG3  LYS  33           HG1      LYS  33  36.271  37.791  11.574
  275    HD2  LYS  33           HD2      LYS  33  37.839  40.333  11.290
  276    HD3  LYS  33           HD1      LYS  33  37.860  39.150   9.993
  277    HE2  LYS  33           HE2      LYS  33  35.205  39.993  11.131
  278    HE3  LYS  33           HE1      LYS  33  36.031  41.057   9.996
  279    HZ1  LYS  33           HZ1      LYS  33  36.050  39.387   8.360
  280    HZ2  LYS  33           HZ2      LYS  33  34.474  39.387   8.997
  281    HZ3  LYS  33           HZ3      LYS  33  35.579  38.182   9.457
  282    H    GLU  34           HN       GLU  34  37.604  38.094  16.056
  283    HA   GLU  34           HA       GLU  34  36.849  40.460  17.637
  284    HB2  GLU  34           HB2      GLU  34  37.092  37.626  18.665
  285    HB3  GLU  34           HB1      GLU  34  36.071  38.926  19.274
  286    HG2  GLU  34           HG2      GLU  34  34.865  38.899  17.051
  287    HG3  GLU  34           HG1      GLU  34  35.763  37.431  16.662
  288    H    GLY  35           HN       GLY  35  39.607  38.400  17.177
  289    HA2  GLY  35           HA3      GLY  35  41.781  38.618  18.011
  290    HA3  GLY  35           HA2      GLY  35  41.289  40.136  18.764
  291    H    ILE  36           HN       ILE  36  39.280  37.503  19.519
  292    HA   ILE  36           HA       ILE  36  40.268  37.483  22.285
  293    HB   ILE  36           HB       ILE  36  37.872  36.140  21.029
  294   HG12  ILE  36          HG12      ILE  36  38.161  38.785  22.488
  295   HG13  ILE  36          HG11      ILE  36  37.843  38.595  20.765
  296   HG21  ILE  36          HG21      ILE  36  38.464  36.842  23.913
  297   HG22  ILE  36          HG22      ILE  36  38.674  35.231  23.230
  298   HG23  ILE  36          HG23      ILE  36  37.071  35.954  23.308
  299   HD11  ILE  36          HD11      ILE  36  35.776  37.306  21.369
  300   HD12  ILE  36          HD12      ILE  36  35.736  39.000  21.854
  301   HD13  ILE  36          HD13      ILE  36  36.064  37.748  23.051
  302    HA   PRO  37           HA       PRO  37  42.393  33.615  21.362
  303    HB2  PRO  37           HB2      PRO  37  43.074  32.835  23.881
  304    HB3  PRO  37           HB1      PRO  37  43.864  34.196  23.059
  305    HG2  PRO  37           HG2      PRO  37  41.678  34.236  25.099
  306    HG3  PRO  37           HG1      PRO  37  43.125  35.256  24.981
  307    HD2  PRO  37           HD2      PRO  37  40.660  36.089  24.129
  308    HD3  PRO  37           HD1      PRO  37  42.171  36.656  23.388
  309    HA   PRO  38           HA       PRO  38  38.793  30.815  21.509
  310    HB2  PRO  38           HB2      PRO  38  41.105  28.923  21.279
  311    HB3  PRO  38           HB1      PRO  38  39.509  28.838  20.499
  312    HG2  PRO  38           HG2      PRO  38  41.539  29.771  19.153
  313    HG3  PRO  38           HG1      PRO  38  39.982  30.597  19.054
  314    HD2  PRO  38           HD2      PRO  38  42.478  31.446  20.475
  315    HD3  PRO  38           HD1      PRO  38  41.199  32.445  19.742
  316    H    ASP  39           HN       ASP  39  41.697  30.316  23.484
  317    HA   ASP  39           HA       ASP  39  40.739  28.363  25.268
  318    HB2  ASP  39           HB2      ASP  39  43.077  29.315  25.198
  319    HB3  ASP  39           HB1      ASP  39  42.457  30.728  26.053
  320    H    GLN  40           HN       GLN  40  39.820  31.684  24.948
  321    HA   GLN  40           HA       GLN  40  38.360  31.629  27.551
  322    HB2  GLN  40           HB2      GLN  40  39.165  33.829  25.641
  323    HB3  GLN  40           HB1      GLN  40  37.979  34.094  26.916
  324    HG2  GLN  40           HG2      GLN  40  40.703  32.915  27.476
  325    HG3  GLN  40           HG1      GLN  40  40.407  34.654  27.507
  326   HE21  GLN  40          HE21      GLN  40  40.540  32.014  29.528
  327   HE22  GLN  40          HE22      GLN  40  39.489  32.545  30.751
  328    H    GLN  41           HN       GLN  41  37.832  30.763  24.420
  329    HA   GLN  41           HA       GLN  41  34.891  31.249  24.676
  330    HB2  GLN  41           HB2      GLN  41  36.562  31.815  22.210
  331    HB3  GLN  41           HB1      GLN  41  34.799  31.812  22.249
  332    HG2  GLN  41           HG2      GLN  41  34.982  33.531  24.134
  333    HG3  GLN  41           HG1      GLN  41  36.684  33.676  23.697
  334   HE21  GLN  41          HE21      GLN  41  36.965  33.967  21.137
  335   HE22  GLN  41          HE22      GLN  41  35.902  35.084  20.426
  336    H    ARG  42           HN       ARG  42  33.625  29.606  23.860
  337    HA   ARG  42           HA       ARG  42  34.963  27.334  22.456
  338    HB2  ARG  42           HB2      ARG  42  33.007  27.103  24.768
  339    HB3  ARG  42           HB1      ARG  42  33.639  25.758  23.817
  340    HG2  ARG  42           HG2      ARG  42  35.994  26.887  24.544
  341    HG3  ARG  42           HG1      ARG  42  35.007  27.420  25.903
  342    HD2  ARG  42           HD2      ARG  42  34.237  24.871  25.905
  343    HD3  ARG  42           HD1      ARG  42  35.789  24.639  25.105
  344    HE   ARG  42           HE       ARG  42  36.426  26.204  27.289
  345   HH11  ARG  42          HH11      ARG  42  36.968  25.335  29.306
  346   HH12  ARG  42          HH12      ARG  42  36.387  23.763  29.741
  347   HH21  ARG  42          HH21      ARG  42  34.693  23.273  26.756
  348   HH22  ARG  42          HH22      ARG  42  35.099  22.596  28.297
  349    H    LEU  43           HN       LEU  43  33.672  26.542  20.766
  350    HA   LEU  43           HA       LEU  43  31.268  28.142  20.190
  351    HB2  LEU  43           HB2      LEU  43  32.866  26.078  18.661
  352    HB3  LEU  43           HB1      LEU  43  31.303  26.667  18.065
  353    HG   LEU  43           HG       LEU  43  32.119  28.953  18.033
  354   HD11  LEU  43          HD11      LEU  43  34.532  27.731  19.380
  355   HD12  LEU  43          HD12      LEU  43  33.562  29.105  19.909
  356   HD13  LEU  43          HD13      LEU  43  34.640  29.269  18.524
  357   HD21  LEU  43          HD21      LEU  43  33.713  28.748  16.254
  358   HD22  LEU  43          HD22      LEU  43  32.666  27.333  16.153
  359   HD23  LEU  43          HD23      LEU  43  34.277  27.191  16.859
  360    H    ILE  44           HN       ILE  44  29.210  27.370  20.143
  361    HA   ILE  44           HA       ILE  44  28.712  24.526  20.974
  362    HB   ILE  44           HB       ILE  44  27.259  27.032  21.885
  363   HG12  ILE  44          HG12      ILE  44  29.401  26.728  23.031
  364   HG13  ILE  44          HG11      ILE  44  28.077  26.385  24.137
  365   HG21  ILE  44          HG21      ILE  44  26.741  24.084  22.404
  366   HG22  ILE  44          HG22      ILE  44  25.644  25.240  21.648
  367   HG23  ILE  44          HG23      ILE  44  26.021  25.373  23.368
  368   HD11  ILE  44          HD11      ILE  44  29.386  24.543  24.579
  369   HD12  ILE  44          HD12      ILE  44  30.105  24.532  22.973
  370   HD13  ILE  44          HD13      ILE  44  28.490  23.880  23.216
  371    H    PHE  45           HN       PHE  45  27.125  23.495  19.766
  372    HA   PHE  45           HA       PHE  45  25.522  25.164  17.856
  373    HB2  PHE  45           HB2      PHE  45  27.284  24.045  16.600
  374    HB3  PHE  45           HB1      PHE  45  26.906  22.507  17.374
  375    HD1  PHE  45           HD1      PHE  45  25.707  25.056  14.979
  376    HD2  PHE  45           HD2      PHE  45  24.998  21.199  16.714
  377    HE1  PHE  45           HE1      PHE  45  24.007  24.590  13.234
  378    HE2  PHE  45           HE2      PHE  45  23.297  20.724  14.970
  379    HZ   PHE  45           HZ       PHE  45  22.803  22.422  13.230
  380    H    ALA  46           HN       ALA  46  23.494  25.022  18.756
  381    HA   ALA  46           HA       ALA  46  21.564  24.049  19.684
  382    HB1  ALA  46           HB1      ALA  46  21.017  21.782  18.665
  383    HB2  ALA  46           HB2      ALA  46  22.570  21.875  17.833
  384    HB3  ALA  46           HB3      ALA  46  21.318  23.075  17.505
  385    H    GLY  47           HN       GLY  47  23.590  23.961  21.513
  386    HA2  GLY  47           HA3      GLY  47  24.197  22.863  23.490
  387    HA3  GLY  47           HA2      GLY  47  22.829  21.791  23.205
  388    H    LYS  48           HN       LYS  48  24.664  21.578  20.466
  389    HA   LYS  48           HA       LYS  48  25.783  19.000  21.357
  390    HB2  LYS  48           HB2      LYS  48  25.964  20.251  18.632
  391    HB3  LYS  48           HB1      LYS  48  26.230  18.564  19.041
  392    HG2  LYS  48           HG2      LYS  48  23.813  18.581  19.937
  393    HG3  LYS  48           HG1      LYS  48  23.630  20.103  19.063
  394    HD2  LYS  48           HD2      LYS  48  24.343  18.965  16.972
  395    HD3  LYS  48           HD1      LYS  48  24.447  17.443  17.856
  396    HE2  LYS  48           HE2      LYS  48  22.296  17.511  16.753
  397    HE3  LYS  48           HE1      LYS  48  22.024  17.726  18.483
  398    HZ1  LYS  48           HZ1      LYS  48  22.143  19.876  16.437
  399    HZ2  LYS  48           HZ2      LYS  48  21.978  20.133  18.110
  400    HZ3  LYS  48           HZ3      LYS  48  20.754  19.332  17.245
  401    H    GLN  49           HN       GLN  49  27.938  18.472  21.361
  402    HA   GLN  49           HA       GLN  49  29.851  20.747  21.426
  403    HB2  GLN  49           HB2      GLN  49  29.551  19.217  23.450
  404    HB3  GLN  49           HB1      GLN  49  30.326  17.959  22.484
  405    HG2  GLN  49           HG2      GLN  49  32.251  19.548  22.114
  406    HG3  GLN  49           HG1      GLN  49  31.502  20.633  23.286
  407   HE21  GLN  49          HE21      GLN  49  33.609  17.954  22.976
  408   HE22  GLN  49          HE22      GLN  49  33.654  17.504  24.612
  409    H    LEU  50           HN       LEU  50  31.451  20.861  19.902
  410    HA   LEU  50           HA       LEU  50  31.774  18.534  18.032
  411    HB2  LEU  50           HB2      LEU  50  32.604  21.401  17.518
  412    HB3  LEU  50           HB1      LEU  50  32.388  20.103  16.343
  413    HG   LEU  50           HG       LEU  50  30.184  21.368  17.999
  414   HD11  LEU  50          HD11      LEU  50  29.473  22.427  15.976
  415   HD12  LEU  50          HD12      LEU  50  30.600  21.480  15.004
  416   HD13  LEU  50          HD13      LEU  50  31.207  22.726  16.094
  417   HD21  LEU  50          HD21      LEU  50  30.241  19.113  15.983
  418   HD22  LEU  50          HD22      LEU  50  28.764  20.019  16.316
  419   HD23  LEU  50          HD23      LEU  50  29.549  19.108  17.605
  420    H    GLU  51           HN       GLU  51  33.867  17.733  17.696
  421    HA   GLU  51           HA       GLU  51  35.907  18.618  19.662
  422    HB2  GLU  51           HB2      GLU  51  35.902  16.272  17.736
  423    HB3  GLU  51           HB1      GLU  51  37.087  16.561  19.009
  424    HG2  GLU  51           HG2      GLU  51  35.262  16.457  20.697
  425    HG3  GLU  51           HG1      GLU  51  34.121  16.078  19.407
  426    H    ASP  52           HN       ASP  52  38.091  19.106  18.960
  427    HA   ASP  52           HA       ASP  52  38.268  20.878  16.754
  428    HB2  ASP  52           HB2      ASP  52  40.780  20.530  17.017
  429    HB3  ASP  52           HB1      ASP  52  39.928  21.028  18.479
  430    H    GLY  53           HN       GLY  53  39.402  20.590  14.703
  431    HA2  GLY  53           HA3      GLY  53  40.100  19.358  12.808
  432    HA3  GLY  53           HA2      GLY  53  40.068  17.896  13.796
  433    H    ARG  54           HN       ARG  54  39.055  17.289  11.520
  434    HA   ARG  54           HA       ARG  54  37.150  16.490  10.430
  435    HB2  ARG  54           HB2      ARG  54  36.634  15.861  12.903
  436    HB3  ARG  54           HB1      ARG  54  35.525  17.230  12.869
  437    HG2  ARG  54           HG2      ARG  54  34.234  16.259  11.104
  438    HG3  ARG  54           HG1      ARG  54  35.442  15.008  10.812
  439    HD2  ARG  54           HD2      ARG  54  33.985  15.306  13.445
  440    HD3  ARG  54           HD1      ARG  54  33.423  14.254  12.148
  441    HE   ARG  54           HE       ARG  54  36.147  13.628  12.659
  442   HH11  ARG  54          HH11      ARG  54  36.634  11.825  13.931
  443   HH12  ARG  54          HH12      ARG  54  35.432  11.186  15.003
  444   HH21  ARG  54          HH21      ARG  54  33.034  13.538  14.139
  445   HH22  ARG  54          HH22      ARG  54  33.395  12.156  15.120
  446    H    THR  55           HN       THR  55  35.045  17.245   9.503
  447    HA   THR  55           HA       THR  55  34.838  20.241   9.497
  448    HB   THR  55           HB       THR  55  34.170  20.073   7.147
  449    HG1  THR  55           HG1      THR  55  33.585  17.650   7.767
  450   HG21  THR  55          HG21      THR  55  36.333  19.086   6.234
  451   HG22  THR  55          HG22      THR  55  36.727  18.645   7.896
  452   HG23  THR  55          HG23      THR  55  36.525  20.341   7.459
  453    H    LEU  56           HN       LEU  56  32.547  20.837   8.516
  454    HA   LEU  56           HA       LEU  56  30.588  19.776  10.352
  455    HB2  LEU  56           HB2      LEU  56  30.351  21.582   7.932
  456    HB3  LEU  56           HB1      LEU  56  28.970  21.132   8.924
  457    HG   LEU  56           HG       LEU  56  30.292  22.002  10.935
  458   HD11  LEU  56          HD11      LEU  56  31.973  23.826  10.207
  459   HD12  LEU  56          HD12      LEU  56  32.038  22.979   8.665
  460   HD13  LEU  56          HD13      LEU  56  32.524  22.155  10.145
  461   HD21  LEU  56          HD21      LEU  56  29.337  23.791   8.694
  462   HD22  LEU  56          HD22      LEU  56  29.819  24.432  10.266
  463   HD23  LEU  56          HD23      LEU  56  28.465  23.307  10.150
  464    H    SER  57           HN       SER  57  31.131  19.348   6.838
  465    HA   SER  57           HA       SER  57  28.885  17.628   6.400
  466    HB2  SER  57           HB2      SER  57  30.121  16.853   4.408
  467    HB3  SER  57           HB1      SER  57  30.224  18.604   4.552
  468    HG   SER  57           HG       SER  57  32.250  17.466   4.135
  469    H    ASP  58           HN       ASP  58  32.285  16.904   7.089
  470    HA   ASP  58           HA       ASP  58  32.141  14.110   7.297
  471    HB2  ASP  58           HB2      ASP  58  33.784  16.133   8.826
  472    HB3  ASP  58           HB1      ASP  58  33.976  14.400   9.087
  473    H    TYR  59           HN       TYR  59  31.042  16.563   9.594
  474    HA   TYR  59           HA       TYR  59  30.528  14.658  11.736
  475    HB2  TYR  59           HB2      TYR  59  29.972  17.554  11.227
  476    HB3  TYR  59           HB1      TYR  59  28.888  16.751  12.358
  477    HD1  TYR  59           HD1      TYR  59  31.795  18.640  12.217
  478    HD2  TYR  59           HD2      TYR  59  30.270  15.049  14.021
  479    HE1  TYR  59           HE1      TYR  59  33.493  18.817  14.013
  480    HE2  TYR  59           HE2      TYR  59  31.973  15.229  15.813
  481    HH   TYR  59           HH       TYR  59  33.926  16.259  16.394
  482    H    ASN  60           HN       ASN  60  28.976  15.503   8.818
  483    HA   ASN  60           HA       ASN  60  27.066  14.598   7.807
  484    HB2  ASN  60           HB2      ASN  60  26.340  13.090  10.311
  485    HB3  ASN  60           HB1      ASN  60  26.146  12.618   8.625
  486   HD21  ASN  60          HD21      ASN  60  28.476  12.553   7.437
  487   HD22  ASN  60          HD22      ASN  60  29.675  11.721   8.306
  488    H    ILE  61           HN       ILE  61  26.630  17.049   8.443
  489    HA   ILE  61           HA       ILE  61  24.742  17.583  10.531
  490    HB   ILE  61           HB       ILE  61  26.144  19.337   9.522
  491   HG12  ILE  61          HG12      ILE  61  24.387  21.024   9.110
  492   HG13  ILE  61          HG11      ILE  61  23.203  19.736   8.943
  493   HG21  ILE  61          HG21      ILE  61  25.781  20.071   7.231
  494   HG22  ILE  61          HG22      ILE  61  24.474  18.904   7.028
  495   HG23  ILE  61          HG23      ILE  61  26.135  18.344   7.226
  496   HD11  ILE  61          HD11      ILE  61  23.486  20.966  11.257
  497   HD12  ILE  61          HD12      ILE  61  24.855  19.873  11.448
  498   HD13  ILE  61          HD13      ILE  61  23.232  19.222  11.217
  499    H    GLN  62           HN       GLN  62  22.442  17.877  10.312
  500    HA   GLN  62           HA       GLN  62  21.238  16.117   8.275
  501    HB2  GLN  62           HB2      GLN  62  20.059  17.616  10.630
  502    HB3  GLN  62           HB1      GLN  62  19.137  16.552   9.567
  503    HG2  GLN  62           HG2      GLN  62  20.631  14.673  10.145
  504    HG3  GLN  62           HG1      GLN  62  21.553  15.735  11.210
  505   HE21  GLN  62          HE21      GLN  62  20.999  14.922  13.273
  506   HE22  GLN  62          HE22      GLN  62  19.405  14.796  13.845
  507    H    LYS  63           HN       LYS  63  20.767  19.522   9.339
  508    HA   LYS  63           HA       LYS  63  18.920  20.144   7.242
  509    HB2  LYS  63           HB2      LYS  63  19.277  21.491   9.341
  510    HB3  LYS  63           HB1      LYS  63  20.787  22.075   8.641
  511    HG2  LYS  63           HG2      LYS  63  19.572  23.019   6.736
  512    HG3  LYS  63           HG1      LYS  63  18.054  22.383   7.366
  513    HD2  LYS  63           HD2      LYS  63  18.303  23.769   9.389
  514    HD3  LYS  63           HD1      LYS  63  19.826  24.405   8.768
  515    HE2  LYS  63           HE2      LYS  63  18.016  25.985   8.296
  516    HE3  LYS  63           HE1      LYS  63  18.618  25.298   6.787
  517    HZ1  LYS  63           HZ1      LYS  63  16.721  24.162   6.436
  518    HZ2  LYS  63           HZ2      LYS  63  16.049  25.370   7.423
  519    HZ3  LYS  63           HZ3      LYS  63  16.450  23.857   8.082
  520    H    GLU  64           HN       GLU  64  22.444  20.199   7.376
  521    HA   GLU  64           HA       GLU  64  24.032  20.826   5.743
  522    HB2  GLU  64           HB2      GLU  64  23.020  18.610   4.990
  523    HB3  GLU  64           HB1      GLU  64  22.029  19.547   3.872
  524    HG2  GLU  64           HG2      GLU  64  24.035  20.475   2.820
  525    HG3  GLU  64           HG1      GLU  64  25.058  19.623   3.977
  526    H    SEP  65           HN       SEP  65  22.948  23.152   6.189
  527    HA   SEP  65           HA       SEP  65  22.804  24.432   3.587
  528    HB2  SEP  65           HB1      SEP  65  20.559  25.213   3.613
  529    HB3  SEP  65           HB2      SEP  65  20.314  24.694   5.277
  530    H    TPO  66           HN       TPO  66  20.938  26.386   5.397
  531    HA   TPO  66           HA       TPO  66  23.181  28.078   6.159
  532    HB   TPO  66           HB       TPO  66  21.469  29.630   6.953
  533   HG21  TPO  66          HG21      TPO  66  20.364  28.299   4.478
  534   HG22  TPO  66          HG22      TPO  66  21.865  29.225   4.453
  535   HG23  TPO  66          HG23      TPO  66  20.348  30.013   4.891
  536    H    LEU  67           HN       LEU  67  24.337  26.842   7.719
  537    HA   LEU  67           HA       LEU  67  22.950  25.886  10.127
  538    HB2  LEU  67           HB2      LEU  67  25.943  26.034   9.742
  539    HB3  LEU  67           HB1      LEU  67  25.016  24.897  10.723
  540    HG   LEU  67           HG       LEU  67  25.058  25.050   7.697
  541   HD11  LEU  67          HD11      LEU  67  27.013  23.928   8.424
  542   HD12  LEU  67          HD12      LEU  67  25.873  22.636   8.056
  543   HD13  LEU  67          HD13      LEU  67  26.159  23.108   9.731
  544   HD21  LEU  67          HD21      LEU  67  23.642  22.920   7.964
  545   HD22  LEU  67          HD22      LEU  67  22.829  24.451   8.288
  546   HD23  LEU  67          HD23      LEU  67  23.375  23.441   9.628
  547    H    HIS  68           HN       HIS  68  23.243  26.736  12.213
  548    HA   HIS  68           HA       HIS  68  24.295  29.549  12.320
  549    HB2  HIS  68           HB2      HIS  68  21.875  29.371  12.746
  550    HB3  HIS  68           HB1      HIS  68  22.181  28.198  14.026
  551    HD1  HIS  68           HD1      HIS  68  21.154  29.859  15.794
  552    HD2  HIS  68           HD2      HIS  68  24.567  31.289  13.868
  553    HE1  HIS  68           HE1      HIS  68  21.945  31.863  17.127
  554    HE2  HIS  68           HE2      HIS  68  24.020  32.741  15.965
  555    H    LEU  69           HN       LEU  69  25.854  30.012  13.824
  556    HA   LEU  69           HA       LEU  69  26.698  27.818  15.701
  557    HB2  LEU  69           HB2      LEU  69  28.480  29.998  14.584
  558    HB3  LEU  69           HB1      LEU  69  28.968  28.527  15.426
  559    HG   LEU  69           HG       LEU  69  27.602  28.624  12.718
  560   HD11  LEU  69          HD11      LEU  69  30.468  28.048  13.527
  561   HD12  LEU  69          HD12      LEU  69  29.902  29.427  12.582
  562   HD13  LEU  69          HD13      LEU  69  29.816  27.800  11.906
  563   HD21  LEU  69          HD21      LEU  69  28.568  26.379  14.501
  564   HD22  LEU  69          HD22      LEU  69  28.391  26.160  12.760
  565   HD23  LEU  69          HD23      LEU  69  26.987  26.573  13.742
  566    H    VAL  70           HN       VAL  70  27.380  28.541  17.827
  567    HA   VAL  70           HA       VAL  70  26.811  31.400  18.483
  568    HB   VAL  70           HB       VAL  70  25.738  28.998  19.996
  569   HG11  VAL  70          HG11      VAL  70  25.577  31.983  20.493
  570   HG12  VAL  70          HG12      VAL  70  26.318  30.770  21.537
  571   HG13  VAL  70          HG13      VAL  70  24.568  30.798  21.322
  572   HG21  VAL  70          HG21      VAL  70  24.353  31.147  18.360
  573   HG22  VAL  70          HG22      VAL  70  23.527  29.930  19.334
  574   HG23  VAL  70          HG23      VAL  70  24.481  29.440  17.935
  575    H    LEU  71           HN       LEU  71  28.585  32.179  19.499
  576    HA   LEU  71           HA       LEU  71  30.597  30.353  20.586
  577    HB2  LEU  71           HB2      LEU  71  30.373  33.349  20.287
  578    HB3  LEU  71           HB1      LEU  71  31.678  32.634  21.234
  579    HG   LEU  71           HG       LEU  71  32.432  31.348  19.308
  580   HD11  LEU  71          HD11      LEU  71  31.296  31.873  17.068
  581   HD12  LEU  71          HD12      LEU  71  29.957  32.514  18.022
  582   HD13  LEU  71          HD13      LEU  71  30.411  30.817  18.168
  583   HD21  LEU  71          HD21      LEU  71  31.934  34.297  18.830
  584   HD22  LEU  71          HD22      LEU  71  32.902  33.320  17.730
  585   HD23  LEU  71          HD23      LEU  71  33.410  33.522  19.404
  586    H    ARG  72           HN       ARG  72  31.220  30.222  22.792
  587    HA   ARG  72           HA       ARG  72  29.223  31.285  24.760
  588    HB2  ARG  72           HB2      ARG  72  29.938  28.642  24.277
  589    HB3  ARG  72           HB1      ARG  72  31.004  29.057  25.613
  590    HG2  ARG  72           HG2      ARG  72  27.987  29.417  25.591
  591    HG3  ARG  72           HG1      ARG  72  28.855  28.124  26.415
  592    HD2  ARG  72           HD2      ARG  72  30.157  30.119  27.556
  593    HD3  ARG  72           HD1      ARG  72  28.729  31.048  27.090
  594    HE   ARG  72           HE       ARG  72  27.770  28.723  28.346
  595   HH11  ARG  72          HH11      ARG  72  27.235  28.752  30.543
  596   HH12  ARG  72          HH12      ARG  72  27.939  29.950  31.576
  597   HH21  ARG  72          HH21      ARG  72  29.784  31.434  29.042
  598   HH22  ARG  72          HH22      ARG  72  29.382  31.468  30.726
  599    H    LEU  73           HN       LEU  73  30.280  31.893  26.905
  600    HA   LEU  73           HA       LEU  73  32.991  33.057  26.415
  601    HB2  LEU  73           HB2      LEU  73  30.919  34.474  27.115
  602    HB3  LEU  73           HB1      LEU  73  31.151  33.755  28.706
  603    HG   LEU  73           HG       LEU  73  33.658  34.527  28.385
  604   HD11  LEU  73          HD11      LEU  73  33.516  35.276  26.078
  605   HD12  LEU  73          HD12      LEU  73  33.754  36.687  27.102
  606   HD13  LEU  73          HD13      LEU  73  32.154  36.328  26.459
  607   HD21  LEU  73          HD21      LEU  73  33.028  36.795  29.313
  608   HD22  LEU  73          HD22      LEU  73  32.276  35.432  30.143
  609   HD23  LEU  73          HD23      LEU  73  31.343  36.386  28.990
  610    H    ARG  74           HN       ARG  74  34.539  32.935  28.212
  611    HA   ARG  74           HA       ARG  74  35.728  31.734  29.829
  612    HB2  ARG  74           HB2      ARG  74  33.597  32.400  31.125
  613    HB3  ARG  74           HB1      ARG  74  33.061  30.742  30.852
  614    HG2  ARG  74           HG2      ARG  74  35.149  29.911  31.909
  615    HG3  ARG  74           HG1      ARG  74  35.628  31.578  32.233
  616    HD2  ARG  74           HD2      ARG  74  33.134  30.211  33.285
  617    HD3  ARG  74           HD1      ARG  74  34.576  30.598  34.224
  618    HE   ARG  74           HE       ARG  74  32.507  32.498  33.381
  619   HH11  ARG  74          HH11      ARG  74  32.767  34.596  34.177
  620   HH12  ARG  74          HH12      ARG  74  34.275  35.057  34.894
  621   HH21  ARG  74          HH21      ARG  74  35.754  31.958  34.412
  622   HH22  ARG  74          HH22      ARG  74  35.966  33.563  35.026
  623    H    GLY  75           HN       GLY  75  36.504  29.593  30.221
  624    HA2  GLY  75           HA3      GLY  75  35.373  27.140  29.750
  625    HA3  GLY  75           HA2      GLY  75  35.782  27.685  28.122
  626    H    GLY  76           HN       GLY  76  37.441  27.890  31.293
  627    HA2  GLY  76           HA3      GLY  76  39.480  26.028  30.797
  628    HA3  GLY  76           HA2      GLY  76  40.046  27.550  30.108
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1  27.701  27.228   4.668
    2    H2   MET   1           HT2      MET   1  28.695  28.582   4.931
    3    H3   MET   1           HT3      MET   1  29.000  27.542   3.622
    4    HA   MET   1           HA       MET   1  27.933  29.204   2.520
    5    HB2  MET   1           HB2      MET   1  26.643  27.083   2.279
    6    HB3  MET   1           HB1      MET   1  25.621  27.580   3.628
    7    HG2  MET   1           HG2      MET   1  24.902  29.566   2.391
    8    HG3  MET   1           HG1      MET   1  25.980  29.152   1.058
    9    HE1  MET   1           HE1      MET   1  23.895  29.144  -0.763
   10    HE2  MET   1           HE2      MET   1  23.187  29.873   0.677
   11    HE3  MET   1           HE3      MET   1  22.307  28.616  -0.189
   12    H    GLN   2           HN       GLN   2  28.408  31.057   3.921
   13    HA   GLN   2           HA       GLN   2  27.794  32.891   5.253
   14    HB2  GLN   2           HB2      GLN   2  26.086  32.910   3.322
   15    HB3  GLN   2           HB1      GLN   2  24.951  32.210   4.477
   16    HG2  GLN   2           HG2      GLN   2  25.235  34.116   5.974
   17    HG3  GLN   2           HG1      GLN   2  26.471  34.798   4.917
   18   HE21  GLN   2          HE21      GLN   2  23.958  33.253   3.157
   19   HE22  GLN   2          HE22      GLN   2  23.087  34.647   2.736
   20    H    ILE   3           HN       ILE   3  28.347  31.069   6.988
   21    HA   ILE   3           HA       ILE   3  26.120  30.036   8.529
   22    HB   ILE   3           HB       ILE   3  29.024  30.408   9.328
   23   HG12  ILE   3          HG12      ILE   3  27.611  27.939   8.276
   24   HG13  ILE   3          HG11      ILE   3  28.604  28.999   7.274
   25   HG21  ILE   3          HG21      ILE   3  26.769  28.739  10.484
   26   HG22  ILE   3          HG22      ILE   3  27.603  30.080  11.273
   27   HG23  ILE   3          HG23      ILE   3  28.462  28.574  10.950
   28   HD11  ILE   3          HD11      ILE   3  29.869  27.026   8.147
   29   HD12  ILE   3          HD12      ILE   3  29.577  27.609   9.786
   30   HD13  ILE   3          HD13      ILE   3  30.552  28.566   8.670
   31    H    PHE   4           HN       PHE   4  25.068  30.988  10.237
   32    HA   PHE   4           HA       PHE   4  25.638  33.832  10.774
   33    HB2  PHE   4           HB2      PHE   4  23.463  31.939  11.705
   34    HB3  PHE   4           HB1      PHE   4  23.591  33.607  12.261
   35    HD1  PHE   4           HD1      PHE   4  22.853  31.417   9.402
   36    HD2  PHE   4           HD2      PHE   4  23.229  35.487  10.726
   37    HE1  PHE   4           HE1      PHE   4  21.709  32.193   7.343
   38    HE2  PHE   4           HE2      PHE   4  22.086  36.262   8.667
   39    HZ   PHE   4           HZ       PHE   4  21.326  34.616   6.975
   40    H    VAL   5           HN       VAL   5  26.192  34.643  12.851
   41    HA   VAL   5           HA       VAL   5  26.891  32.671  14.966
   42    HB   VAL   5           HB       VAL   5  28.832  34.777  13.963
   43   HG11  VAL   5          HG11      VAL   5  30.397  33.407  15.443
   44   HG12  VAL   5          HG12      VAL   5  28.951  32.630  16.091
   45   HG13  VAL   5          HG13      VAL   5  29.185  34.367  16.294
   46   HG21  VAL   5          HG21      VAL   5  28.656  33.005  12.308
   47   HG22  VAL   5          HG22      VAL   5  28.756  31.771  13.564
   48   HG23  VAL   5          HG23      VAL   5  30.158  32.780  13.204
   49    H    LYS   6           HN       LYS   6  25.575  33.461  16.569
   50    HA   LYS   6           HA       LYS   6  25.465  36.429  16.995
   51    HB2  LYS   6           HB2      LYS   6  23.629  34.253  18.046
   52    HB3  LYS   6           HB1      LYS   6  23.401  35.989  18.241
   53    HG2  LYS   6           HG2      LYS   6  23.655  34.768  15.489
   54    HG3  LYS   6           HG1      LYS   6  22.108  34.778  16.329
   55    HD2  LYS   6           HD2      LYS   6  22.346  37.269  16.608
   56    HD3  LYS   6           HD1      LYS   6  23.784  37.194  15.590
   57    HE2  LYS   6           HE2      LYS   6  21.837  37.781  14.229
   58    HE3  LYS   6           HE1      LYS   6  22.423  36.180  13.777
   59    HZ1  LYS   6           HZ1      LYS   6  20.733  35.194  15.180
   60    HZ2  LYS   6           HZ2      LYS   6  20.017  36.220  14.031
   61    HZ3  LYS   6           HZ3      LYS   6  20.179  36.728  15.643
   62    H    THR   7           HN       THR   7  26.338  37.265  18.826
   63    HA   THR   7           HA       THR   7  27.476  35.367  20.837
   64    HB   THR   7           HB       THR   7  28.957  37.159  21.467
   65    HG1  THR   7           HG1      THR   7  27.356  38.752  19.750
   66   HG21  THR   7          HG21      THR   7  29.515  35.963  19.366
   67   HG22  THR   7          HG22      THR   7  30.089  37.631  19.344
   68   HG23  THR   7          HG23      THR   7  28.633  37.186  18.453
   69    H    LEU   8           HN       LEU   8  27.441  36.382  23.156
   70    HA   LEU   8           HA       LEU   8  24.655  36.818  23.855
   71    HB2  LEU   8           HB2      LEU   8  27.067  37.228  25.641
   72    HB3  LEU   8           HB1      LEU   8  25.416  36.856  26.135
   73    HG   LEU   8           HG       LEU   8  27.262  35.035  24.560
   74   HD11  LEU   8          HD11      LEU   8  26.081  34.611  27.311
   75   HD12  LEU   8          HD12      LEU   8  27.653  35.372  27.069
   76   HD13  LEU   8          HD13      LEU   8  27.385  33.711  26.540
   77   HD21  LEU   8          HD21      LEU   8  25.320  33.384  25.095
   78   HD22  LEU   8          HD22      LEU   8  25.086  34.532  23.778
   79   HD23  LEU   8          HD23      LEU   8  24.351  34.835  25.351
   80    H    THR   9           HN       THR   9  27.243  38.868  22.936
   81    HA   THR   9           HA       THR   9  26.150  41.248  24.306
   82    HB   THR   9           HB       THR   9  28.022  42.431  23.213
   83    HG1  THR   9           HG1      THR   9  27.881  40.300  21.603
   84   HG21  THR   9          HG21      THR   9  28.325  41.078  25.338
   85   HG22  THR   9          HG22      THR   9  29.800  41.354  24.411
   86   HG23  THR   9          HG23      THR   9  28.986  39.791  24.331
   87    H    GLY  10           HN       GLY  10  25.294  39.522  21.619
   88    HA2  GLY  10           HA3      GLY  10  23.595  40.152  20.059
   89    HA3  GLY  10           HA2      GLY  10  23.860  41.844  20.480
   90    H    LYS  11           HN       LYS  11  26.885  40.890  20.133
   91    HA   LYS  11           HA       LYS  11  27.294  42.135  17.599
   92    HB2  LYS  11           HB2      LYS  11  29.037  40.213  19.166
   93    HB3  LYS  11           HB1      LYS  11  29.575  41.052  17.712
   94    HG2  LYS  11           HG2      LYS  11  29.119  43.223  18.784
   95    HG3  LYS  11           HG1      LYS  11  28.572  42.392  20.240
   96    HD2  LYS  11           HD2      LYS  11  30.790  41.390  20.534
   97    HD3  LYS  11           HD1      LYS  11  31.350  42.157  19.046
   98    HE2  LYS  11           HE2      LYS  11  32.065  43.476  20.987
   99    HE3  LYS  11           HE1      LYS  11  30.884  44.384  20.041
  100    HZ1  LYS  11           HZ1      LYS  11  30.253  44.567  22.295
  101    HZ2  LYS  11           HZ2      LYS  11  30.427  42.898  22.566
  102    HZ3  LYS  11           HZ3      LYS  11  29.163  43.476  21.587
  103    H    THR  12           HN       THR  12  26.403  41.320  15.753
  104    HA   THR  12           HA       THR  12  26.241  38.375  15.378
  105    HB   THR  12           HB       THR  12  25.158  40.652  13.691
  106    HG1  THR  12           HG1      THR  12  24.171  40.416  15.738
  107   HG21  THR  12          HG21      THR  12  23.750  38.723  12.761
  108   HG22  THR  12          HG22      THR  12  24.921  37.645  13.518
  109   HG23  THR  12          HG23      THR  12  25.441  38.770  12.263
  110    H    ILE  13           HN       ILE  13  27.405  37.299  13.806
  111    HA   ILE  13           HA       ILE  13  29.090  38.863  11.917
  112    HB   ILE  13           HB       ILE  13  30.226  36.628  13.627
  113   HG12  ILE  13          HG12      ILE  13  30.522  39.636  13.920
  114   HG13  ILE  13          HG11      ILE  13  29.716  38.557  15.058
  115   HG21  ILE  13          HG21      ILE  13  32.337  37.286  12.680
  116   HG22  ILE  13          HG22      ILE  13  31.626  38.721  11.944
  117   HG23  ILE  13          HG23      ILE  13  31.207  37.119  11.338
  118   HD11  ILE  13          HD11      ILE  13  31.925  38.941  15.919
  119   HD12  ILE  13          HD12      ILE  13  32.658  38.611  14.348
  120   HD13  ILE  13          HD13      ILE  13  31.909  37.303  15.265
  121    H    THR  14           HN       THR  14  29.272  37.808   9.938
  122    HA   THR  14           HA       THR  14  28.128  35.031   9.763
  123    HB   THR  14           HB       THR  14  27.308  35.659   7.525
  124    HG1  THR  14           HG1      THR  14  28.183  37.326   6.639
  125   HG21  THR  14          HG21      THR  14  25.562  37.256   8.243
  126   HG22  THR  14          HG22      THR  14  26.493  37.606   9.699
  127   HG23  THR  14          HG23      THR  14  25.821  35.995   9.448
  128    H    LEU  15           HN       LEU  15  29.365  33.547   8.680
  129    HA   LEU  15           HA       LEU  15  31.878  34.527   7.342
  130    HB2  LEU  15           HB2      LEU  15  31.534  31.842   8.699
  131    HB3  LEU  15           HB1      LEU  15  33.033  32.611   8.181
  132    HG   LEU  15           HG       LEU  15  31.214  33.688  10.359
  133   HD11  LEU  15          HD11      LEU  15  33.890  32.285  10.598
  134   HD12  LEU  15          HD12      LEU  15  32.335  31.530  10.942
  135   HD13  LEU  15          HD13      LEU  15  32.894  32.884  11.924
  136   HD21  LEU  15          HD21      LEU  15  33.905  34.511   9.247
  137   HD22  LEU  15          HD22      LEU  15  33.354  35.024  10.842
  138   HD23  LEU  15          HD23      LEU  15  32.450  35.494   9.402
  139    H    GLU  16           HN       GLU  16  31.623  34.226   5.167
  140    HA   GLU  16           HA       GLU  16  29.960  31.949   4.200
  141    HB2  GLU  16           HB2      GLU  16  29.541  34.234   3.289
  142    HB3  GLU  16           HB1      GLU  16  31.189  34.257   2.660
  143    HG2  GLU  16           HG2      GLU  16  30.720  32.301   1.268
  144    HG3  GLU  16           HG1      GLU  16  29.090  32.192   1.934
  145    H    VAL  17           HN       VAL  17  31.067  30.096   3.773
  146    HA   VAL  17           HA       VAL  17  33.443  30.167   2.106
  147    HB   VAL  17           HB       VAL  17  34.433  30.673   4.318
  148   HG11  VAL  17          HG11      VAL  17  32.634  29.388   5.583
  149   HG12  VAL  17          HG12      VAL  17  34.285  29.120   6.140
  150   HG13  VAL  17          HG13      VAL  17  33.489  27.915   5.128
  151   HG21  VAL  17          HG21      VAL  17  35.651  29.330   2.594
  152   HG22  VAL  17          HG22      VAL  17  35.055  27.863   3.372
  153   HG23  VAL  17          HG23      VAL  17  36.143  28.944   4.243
  154    H    GLU  18           HN       GLU  18  34.021  28.042   1.358
  155    HA   GLU  18           HA       GLU  18  31.995  26.263   0.788
  156    HB2  GLU  18           HB2      GLU  18  34.891  25.564   1.332
  157    HB3  GLU  18           HB1      GLU  18  33.746  24.544   0.459
  158    HG2  GLU  18           HG2      GLU  18  33.442  26.301  -1.233
  159    HG3  GLU  18           HG1      GLU  18  34.554  27.352  -0.355
  160    HA   PRO  19           HA       PRO  19  30.869  24.950   5.040
  161    HB2  PRO  19           HB2      PRO  19  29.608  22.795   3.359
  162    HB3  PRO  19           HB1      PRO  19  28.939  23.668   4.757
  163    HG2  PRO  19           HG2      PRO  19  28.213  24.317   2.292
  164    HG3  PRO  19           HG1      PRO  19  28.487  25.571   3.518
  165    HD2  PRO  19           HD2      PRO  19  30.194  24.825   1.177
  166    HD3  PRO  19           HD1      PRO  19  30.002  26.401   1.978
  167    H    SER  20           HN       SER  20  32.572  23.092   2.618
  168    HA   SER  20           HA       SER  20  33.101  20.809   4.344
  169    HB2  SER  20           HB2      SER  20  34.874  20.310   2.587
  170    HB3  SER  20           HB1      SER  20  33.221  20.421   1.988
  171    HG   SER  20           HG       SER  20  35.245  22.413   1.905
  172    H    ASP  21           HN       ASP  21  34.143  23.956   4.444
  173    HA   ASP  21           HA       ASP  21  36.918  23.801   4.925
  174    HB2  ASP  21           HB2      ASP  21  34.716  25.662   5.567
  175    HB3  ASP  21           HB1      ASP  21  36.024  25.724   6.736
  176    H    THR  22           HN       THR  22  38.094  23.619   6.952
  177    HA   THR  22           HA       THR  22  36.895  21.604   8.735
  178    HB   THR  22           HB       THR  22  39.161  21.530   9.742
  179    HG1  THR  22           HG1      THR  22  40.354  23.051   7.860
  180   HG21  THR  22          HG21      THR  22  39.221  21.521   6.713
  181   HG22  THR  22          HG22      THR  22  38.599  20.203   7.705
  182   HG23  THR  22          HG23      THR  22  40.307  20.637   7.785
  183    H    ILE  23           HN       ILE  23  36.506  21.901  10.934
  184    HA   ILE  23           HA       ILE  23  35.448  24.262  11.903
  185    HB   ILE  23           HB       ILE  23  36.948  22.123  13.426
  186   HG12  ILE  23          HG12      ILE  23  33.970  22.590  13.116
  187   HG13  ILE  23          HG11      ILE  23  34.889  21.525  12.056
  188   HG21  ILE  23          HG21      ILE  23  36.861  24.047  14.865
  189   HG22  ILE  23          HG22      ILE  23  35.542  22.990  15.361
  190   HG23  ILE  23          HG23      ILE  23  35.207  24.413  14.377
  191   HD11  ILE  23          HD11      ILE  23  35.122  21.176  15.026
  192   HD12  ILE  23          HD12      ILE  23  35.292  19.982  13.736
  193   HD13  ILE  23          HD13      ILE  23  33.696  20.570  14.193
  194    H    GLU  24           HN       GLU  24  38.821  23.368  11.695
  195    HA   GLU  24           HA       GLU  24  39.920  25.358  13.417
  196    HB2  GLU  24           HB2      GLU  24  41.237  24.334  10.900
  197    HB3  GLU  24           HB1      GLU  24  42.012  24.855  12.396
  198    HG2  GLU  24           HG2      GLU  24  40.260  22.401  12.044
  199    HG3  GLU  24           HG1      GLU  24  42.007  22.412  12.295
  200    H    ASN  25           HN       ASN  25  38.890  25.429  10.041
  201    HA   ASN  25           HA       ASN  25  40.025  28.001   9.417
  202    HB2  ASN  25           HB2      ASN  25  39.258  26.429   7.665
  203    HB3  ASN  25           HB1      ASN  25  37.595  26.623   8.225
  204   HD21  ASN  25          HD21      ASN  25  40.294  28.328   6.642
  205   HD22  ASN  25          HD22      ASN  25  39.350  29.599   6.030
  206    H    VAL  26           HN       VAL  26  36.892  26.939  10.698
  207    HA   VAL  26           HA       VAL  26  35.685  29.554  10.721
  208    HB   VAL  26           HB       VAL  26  35.103  27.276  12.633
  209   HG11  VAL  26          HG11      VAL  26  32.800  28.226  12.475
  210   HG12  VAL  26          HG12      VAL  26  33.440  29.527  11.472
  211   HG13  VAL  26          HG13      VAL  26  33.965  29.367  13.147
  212   HG21  VAL  26          HG21      VAL  26  33.387  26.647  10.840
  213   HG22  VAL  26          HG22      VAL  26  35.069  26.273  10.463
  214   HG23  VAL  26          HG23      VAL  26  34.297  27.686   9.744
  215    H    LYS  27           HN       LYS  27  36.863  27.629  13.498
  216    HA   LYS  27           HA       LYS  27  36.904  29.583  15.452
  217    HB2  LYS  27           HB2      LYS  27  38.917  27.384  14.897
  218    HB3  LYS  27           HB1      LYS  27  38.935  28.359  16.368
  219    HG2  LYS  27           HG2      LYS  27  36.496  27.670  16.696
  220    HG3  LYS  27           HG1      LYS  27  36.753  26.497  15.408
  221    HD2  LYS  27           HD2      LYS  27  38.447  25.354  16.662
  222    HD3  LYS  27           HD1      LYS  27  38.520  26.642  17.865
  223    HE2  LYS  27           HE2      LYS  27  37.227  24.741  18.729
  224    HE3  LYS  27           HE1      LYS  27  36.185  26.148  18.522
  225    HZ1  LYS  27           HZ1      LYS  27  35.115  24.207  17.634
  226    HZ2  LYS  27           HZ2      LYS  27  36.456  23.860  16.650
  227    HZ3  LYS  27           HZ3      LYS  27  35.517  25.247  16.357
  228    H    ALA  28           HN       ALA  28  39.228  29.160  12.823
  229    HA   ALA  28           HA       ALA  28  41.116  31.115  13.803
  230    HB1  ALA  28           HB1      ALA  28  40.608  29.905  11.080
  231    HB2  ALA  28           HB2      ALA  28  41.932  29.561  12.193
  232    HB3  ALA  28           HB3      ALA  28  41.868  31.109  11.350
  233    H    LYS  29           HN       LYS  29  38.756  31.329  11.104
  234    HA   LYS  29           HA       LYS  29  39.055  34.075  10.588
  235    HB2  LYS  29           HB2      LYS  29  36.693  32.216  10.341
  236    HB3  LYS  29           HB1      LYS  29  36.567  33.915   9.878
  237    HG2  LYS  29           HG2      LYS  29  38.131  33.699   8.139
  238    HG3  LYS  29           HG1      LYS  29  38.845  32.239   8.824
  239    HD2  LYS  29           HD2      LYS  29  36.780  30.997   8.332
  240    HD3  LYS  29           HD1      LYS  29  36.071  32.447   7.620
  241    HE2  LYS  29           HE2      LYS  29  38.637  31.151   6.654
  242    HE3  LYS  29           HE1      LYS  29  37.057  30.902   5.910
  243    HZ1  LYS  29           HZ1      LYS  29  38.479  33.493   6.196
  244    HZ2  LYS  29           HZ2      LYS  29  36.914  33.307   5.559
  245    HZ3  LYS  29           HZ3      LYS  29  38.247  32.626   4.756
  246    H    ILE  30           HN       ILE  30  37.424  32.491  13.224
  247    HA   ILE  30           HA       ILE  30  36.035  34.941  14.079
  248    HB   ILE  30           HB       ILE  30  36.321  32.177  15.284
  249   HG12  ILE  30          HG12      ILE  30  33.892  33.657  14.234
  250   HG13  ILE  30          HG11      ILE  30  34.870  32.577  13.240
  251   HG21  ILE  30          HG21      ILE  30  34.492  33.041  16.856
  252   HG22  ILE  30          HG22      ILE  30  34.940  34.663  16.330
  253   HG23  ILE  30          HG23      ILE  30  36.118  33.652  17.166
  254   HD11  ILE  30          HD11      ILE  30  33.323  31.858  15.742
  255   HD12  ILE  30          HD12      ILE  30  34.469  30.771  14.956
  256   HD13  ILE  30          HD13      ILE  30  33.020  31.293  14.098
  257    H    GLN  31           HN       GLN  31  38.355  32.802  15.753
  258    HA   GLN  31           HA       GLN  31  39.146  34.341  17.856
  259    HB2  GLN  31           HB2      GLN  31  40.072  32.123  17.348
  260    HB3  GLN  31           HB1      GLN  31  40.999  32.807  16.015
  261    HG2  GLN  31           HG2      GLN  31  42.258  34.200  17.535
  262    HG3  GLN  31           HG1      GLN  31  41.272  33.687  18.899
  263   HE21  GLN  31          HE21      GLN  31  41.159  30.847  18.015
  264   HE22  GLN  31          HE22      GLN  31  42.703  30.204  18.297
  265    H    ASP  32           HN       ASP  32  40.417  34.707  14.556
  266    HA   ASP  32           HA       ASP  32  42.188  36.897  15.244
  267    HB2  ASP  32           HB2      ASP  32  41.040  35.977  12.599
  268    HB3  ASP  32           HB1      ASP  32  42.202  37.294  12.740
  269    H    LYS  33           HN       LYS  33  39.091  36.857  13.508
  270    HA   LYS  33           HA       LYS  33  38.761  39.661  13.309
  271    HB2  LYS  33           HB2      LYS  33  36.883  37.348  13.305
  272    HB3  LYS  33           HB1      LYS  33  36.223  38.975  13.301
  273    HG2  LYS  33           HG2      LYS  33  36.600  37.863  11.025
  274    HG3  LYS  33           HG1      LYS  33  37.218  39.495  11.215
  275    HD2  LYS  33           HD2      LYS  33  39.468  38.735  11.359
  276    HD3  LYS  33           HD1      LYS  33  38.975  37.080  11.701
  277    HE2  LYS  33           HE2      LYS  33  39.769  37.325   9.374
  278    HE3  LYS  33           HE1      LYS  33  38.070  36.862   9.429
  279    HZ1  LYS  33           HZ1      LYS  33  38.934  38.866   7.965
  280    HZ2  LYS  33           HZ2      LYS  33  38.677  39.715   9.414
  281    HZ3  LYS  33           HZ3      LYS  33  37.396  38.873   8.681
  282    H    GLU  34           HN       GLU  34  37.823  37.492  15.980
  283    HA   GLU  34           HA       GLU  34  36.777  39.831  17.492
  284    HB2  GLU  34           HB2      GLU  34  36.903  36.985  18.500
  285    HB3  GLU  34           HB1      GLU  34  35.796  38.274  18.969
  286    HG2  GLU  34           HG2      GLU  34  35.869  36.857  16.292
  287    HG3  GLU  34           HG1      GLU  34  34.614  36.712  17.522
  288    H    GLY  35           HN       GLY  35  39.566  37.790  17.284
  289    HA2  GLY  35           HA3      GLY  35  41.638  37.915  18.430
  290    HA3  GLY  35           HA2      GLY  35  41.104  39.480  19.038
  291    H    ILE  36           HN       ILE  36  39.131  36.663  19.592
  292    HA   ILE  36           HA       ILE  36  39.685  36.868  22.503
  293    HB   ILE  36           HB       ILE  36  37.398  35.540  21.053
  294   HG12  ILE  36          HG12      ILE  36  37.667  38.304  22.275
  295   HG13  ILE  36          HG11      ILE  36  37.478  37.942  20.562
  296   HG21  ILE  36          HG21      ILE  36  37.909  34.806  23.402
  297   HG22  ILE  36          HG22      ILE  36  36.337  35.579  23.234
  298   HG23  ILE  36          HG23      ILE  36  37.693  36.476  23.917
  299   HD11  ILE  36          HD11      ILE  36  35.309  36.804  21.123
  300   HD12  ILE  36          HD12      ILE  36  35.313  38.544  21.405
  301   HD13  ILE  36          HD13      ILE  36  35.480  37.432  22.762
  302    HA   PRO  37           HA       PRO  37  42.069  33.005  21.619
  303    HB2  PRO  37           HB2      PRO  37  42.096  33.121  24.624
  304    HB3  PRO  37           HB1      PRO  37  43.420  32.743  23.500
  305    HG2  PRO  37           HG2      PRO  37  43.278  35.123  24.649
  306    HG3  PRO  37           HG1      PRO  37  43.763  34.968  22.950
  307    HD2  PRO  37           HD2      PRO  37  41.156  35.920  24.083
  308    HD3  PRO  37           HD1      PRO  37  41.995  36.429  22.601
  309    HA   PRO  38           HA       PRO  38  38.353  30.375  21.927
  310    HB2  PRO  38           HB2      PRO  38  40.589  28.382  21.999
  311    HB3  PRO  38           HB1      PRO  38  39.019  28.269  21.171
  312    HG2  PRO  38           HG2      PRO  38  41.136  28.972  19.813
  313    HG3  PRO  38           HG1      PRO  38  39.617  29.835  19.559
  314    HD2  PRO  38           HD2      PRO  38  42.092  30.757  20.970
  315    HD3  PRO  38           HD1      PRO  38  40.873  31.709  20.092
  316    H    ASP  39           HN       ASP  39  41.018  30.421  24.165
  317    HA   ASP  39           HA       ASP  39  40.046  28.541  26.082
  318    HB2  ASP  39           HB2      ASP  39  41.790  30.994  26.391
  319    HB3  ASP  39           HB1      ASP  39  41.474  29.857  27.701
  320    H    GLN  40           HN       GLN  40  39.569  32.049  25.816
  321    HA   GLN  40           HA       GLN  40  37.694  32.036  28.088
  322    HB2  GLN  40           HB2      GLN  40  38.537  34.259  26.203
  323    HB3  GLN  40           HB1      GLN  40  37.588  34.462  27.673
  324    HG2  GLN  40           HG2      GLN  40  39.481  33.441  28.967
  325    HG3  GLN  40           HG1      GLN  40  40.434  33.448  27.484
  326   HE21  GLN  40          HE21      GLN  40  41.640  34.953  29.311
  327   HE22  GLN  40          HE22      GLN  40  41.335  36.612  29.116
  328    H    GLN  41           HN       GLN  41  37.467  31.276  24.848
  329    HA   GLN  41           HA       GLN  41  34.591  32.123  24.708
  330    HB2  GLN  41           HB2      GLN  41  35.726  33.324  23.007
  331    HB3  GLN  41           HB1      GLN  41  36.755  31.952  22.606
  332    HG2  GLN  41           HG2      GLN  41  34.959  30.785  21.566
  333    HG3  GLN  41           HG1      GLN  41  33.755  31.891  22.228
  334   HE21  GLN  41          HE21      GLN  41  34.331  31.286  19.338
  335   HE22  GLN  41          HE22      GLN  41  34.715  32.780  18.631
  336    H    ARG  42           HN       ARG  42  33.120  30.498  24.299
  337    HA   ARG  42           HA       ARG  42  34.142  27.801  23.511
  338    HB2  ARG  42           HB2      ARG  42  32.213  28.455  25.765
  339    HB3  ARG  42           HB1      ARG  42  32.448  26.833  25.120
  340    HG2  ARG  42           HG2      ARG  42  34.836  28.427  26.049
  341    HG3  ARG  42           HG1      ARG  42  33.823  27.606  27.234
  342    HD2  ARG  42           HD2      ARG  42  34.145  25.470  25.973
  343    HD3  ARG  42           HD1      ARG  42  35.254  26.312  24.891
  344    HE   ARG  42           HE       ARG  42  36.098  26.711  27.596
  345   HH11  ARG  42          HH11      ARG  42  37.859  25.505  28.342
  346   HH12  ARG  42          HH12      ARG  42  38.322  24.062  27.502
  347   HH21  ARG  42          HH21      ARG  42  35.819  24.331  25.118
  348   HH22  ARG  42          HH22      ARG  42  37.166  23.398  25.677
  349    H    LEU  43           HN       LEU  43  33.101  27.364  21.584
  350    HA   LEU  43           HA       LEU  43  30.564  28.736  21.009
  351    HB2  LEU  43           HB2      LEU  43  30.873  27.357  18.797
  352    HB3  LEU  43           HB1      LEU  43  31.843  28.810  19.100
  353    HG   LEU  43           HG       LEU  43  32.878  26.152  20.079
  354   HD11  LEU  43          HD11      LEU  43  32.198  25.719  17.793
  355   HD12  LEU  43          HD12      LEU  43  33.958  25.832  17.865
  356   HD13  LEU  43          HD13      LEU  43  33.006  27.182  17.243
  357   HD21  LEU  43          HD21      LEU  43  34.905  27.262  20.153
  358   HD22  LEU  43          HD22      LEU  43  33.855  28.668  20.304
  359   HD23  LEU  43          HD23      LEU  43  34.548  28.256  18.740
  360    H    ILE  44           HN       ILE  44  28.633  27.781  20.805
  361    HA   ILE  44           HA       ILE  44  28.398  24.854  21.470
  362    HB   ILE  44           HB       ILE  44  26.518  27.115  22.236
  363   HG12  ILE  44          HG12      ILE  44  28.553  27.204  23.577
  364   HG13  ILE  44          HG11      ILE  44  27.237  26.581  24.567
  365   HG21  ILE  44          HG21      ILE  44  25.300  25.025  21.866
  366   HG22  ILE  44          HG22      ILE  44  25.416  25.307  23.605
  367   HG23  ILE  44          HG23      ILE  44  26.478  24.133  22.829
  368   HD11  ILE  44          HD11      ILE  44  28.902  25.056  25.089
  369   HD12  ILE  44          HD12      ILE  44  29.646  25.157  23.497
  370   HD13  ILE  44          HD13      ILE  44  28.169  24.226  23.719
  371    H    PHE  45           HN       PHE  45  26.957  23.674  20.151
  372    HA   PHE  45           HA       PHE  45  25.180  25.143  18.316
  373    HB2  PHE  45           HB2      PHE  45  27.111  25.116  16.934
  374    HB3  PHE  45           HB1      PHE  45  27.567  23.496  17.457
  375    HD1  PHE  45           HD1      PHE  45  24.932  25.390  15.600
  376    HD2  PHE  45           HD2      PHE  45  26.828  21.598  16.271
  377    HE1  PHE  45           HE1      PHE  45  23.661  24.420  13.702
  378    HE2  PHE  45           HE2      PHE  45  25.558  20.625  14.372
  379    HZ   PHE  45           HZ       PHE  45  23.976  22.038  13.089
  380    H    ALA  46           HN       ALA  46  23.317  24.098  18.838
  381    HA   ALA  46           HA       ALA  46  21.767  22.366  19.061
  382    HB1  ALA  46           HB1      ALA  46  22.980  21.733  16.849
  383    HB2  ALA  46           HB2      ALA  46  22.007  20.504  17.655
  384    HB3  ALA  46           HB3      ALA  46  23.763  20.482  17.817
  385    H    GLY  47           HN       GLY  47  24.065  22.754  21.092
  386    HA2  GLY  47           HA3      GLY  47  24.259  21.761  23.245
  387    HA3  GLY  47           HA2      GLY  47  23.390  20.347  22.652
  388    H    LYS  48           HN       LYS  48  25.816  21.172  20.474
  389    HA   LYS  48           HA       LYS  48  27.802  19.331  21.767
  390    HB2  LYS  48           HB2      LYS  48  27.077  19.427  18.848
  391    HB3  LYS  48           HB1      LYS  48  28.255  18.353  19.589
  392    HG2  LYS  48           HG2      LYS  48  26.526  17.252  20.884
  393    HG3  LYS  48           HG1      LYS  48  25.322  18.418  20.347
  394    HD2  LYS  48           HD2      LYS  48  24.924  16.573  18.943
  395    HD3  LYS  48           HD1      LYS  48  25.932  17.615  17.942
  396    HE2  LYS  48           HE2      LYS  48  26.686  15.249  17.877
  397    HE3  LYS  48           HE1      LYS  48  27.921  16.307  18.550
  398    HZ1  LYS  48           HZ1      LYS  48  27.451  15.594  20.710
  399    HZ2  LYS  48           HZ2      LYS  48  27.436  14.169  19.785
  400    HZ3  LYS  48           HZ3      LYS  48  25.973  14.890  20.265
  401    H    GLN  49           HN       GLN  49  30.031  19.854  21.305
  402    HA   GLN  49           HA       GLN  49  30.428  22.630  20.391
  403    HB2  GLN  49           HB2      GLN  49  31.350  21.673  22.604
  404    HB3  GLN  49           HB1      GLN  49  32.495  20.786  21.598
  405    HG2  GLN  49           HG2      GLN  49  33.226  22.945  20.588
  406    HG3  GLN  49           HG1      GLN  49  32.140  23.794  21.684
  407   HE21  GLN  49          HE21      GLN  49  34.799  24.452  21.940
  408   HE22  GLN  49          HE22      GLN  49  35.464  23.754  23.336
  409    H    LEU  50           HN       LEU  50  32.375  22.982  18.947
  410    HA   LEU  50           HA       LEU  50  32.520  20.828  16.883
  411    HB2  LEU  50           HB2      LEU  50  33.569  23.666  16.695
  412    HB3  LEU  50           HB1      LEU  50  33.254  22.544  15.373
  413    HG   LEU  50           HG       LEU  50  31.147  23.709  17.215
  414   HD11  LEU  50          HD11      LEU  50  30.505  25.099  15.386
  415   HD12  LEU  50          HD12      LEU  50  31.539  24.220  14.261
  416   HD13  LEU  50          HD13      LEU  50  32.260  25.252  15.496
  417   HD21  LEU  50          HD21      LEU  50  29.653  22.704  15.348
  418   HD22  LEU  50          HD22      LEU  50  30.347  21.587  16.521
  419   HD23  LEU  50          HD23      LEU  50  31.068  21.743  14.919
  420    H    GLU  51           HN       GLU  51  34.186  19.439  17.325
  421    HA   GLU  51           HA       GLU  51  36.632  20.456  18.662
  422    HB2  GLU  51           HB2      GLU  51  35.851  17.641  17.845
  423    HB3  GLU  51           HB1      GLU  51  37.244  18.081  18.836
  424    HG2  GLU  51           HG2      GLU  51  34.386  18.760  19.576
  425    HG3  GLU  51           HG1      GLU  51  35.228  17.322  20.157
  426    H    ASP  52           HN       ASP  52  38.708  20.266  17.734
  427    HA   ASP  52           HA       ASP  52  38.870  20.719  14.904
  428    HB2  ASP  52           HB2      ASP  52  41.084  19.925  16.822
  429    HB3  ASP  52           HB1      ASP  52  41.292  20.690  15.246
  430    H    GLY  53           HN       GLY  53  39.946  19.347  13.317
  431    HA2  GLY  53           HA3      GLY  53  40.721  17.255  12.462
  432    HA3  GLY  53           HA2      GLY  53  40.320  16.495  14.003
  433    H    ARG  54           HN       ARG  54  38.237  18.485  11.900
  434    HA   ARG  54           HA       ARG  54  36.794  16.238  10.824
  435    HB2  ARG  54           HB2      ARG  54  36.143  16.337  13.352
  436    HB3  ARG  54           HB1      ARG  54  35.193  17.747  12.893
  437    HG2  ARG  54           HG2      ARG  54  33.632  16.025  12.626
  438    HG3  ARG  54           HG1      ARG  54  34.267  16.179  10.991
  439    HD2  ARG  54           HD2      ARG  54  34.495  13.894  11.229
  440    HD3  ARG  54           HD1      ARG  54  36.026  14.357  11.962
  441    HE   ARG  54           HE       ARG  54  33.590  13.468  13.416
  442   HH11  ARG  54          HH11      ARG  54  33.961  12.811  15.531
  443   HH12  ARG  54          HH12      ARG  54  35.510  13.083  16.257
  444   HH21  ARG  54          HH21      ARG  54  36.867  14.606  13.463
  445   HH22  ARG  54          HH22      ARG  54  37.146  14.091  15.090
  446    H    THR  55           HN       THR  55  35.040  16.919   9.440
  447    HA   THR  55           HA       THR  55  35.089  19.851   8.787
  448    HB   THR  55           HB       THR  55  34.642  17.415   7.030
  449    HG1  THR  55           HG1      THR  55  36.792  17.824   7.428
  450   HG21  THR  55          HG21      THR  55  34.281  20.365   6.515
  451   HG22  THR  55          HG22      THR  55  33.187  19.036   6.128
  452   HG23  THR  55          HG23      THR  55  34.674  19.248   5.207
  453    H    LEU  56           HN       LEU  56  32.936  20.539   7.702
  454    HA   LEU  56           HA       LEU  56  30.762  19.889   9.494
  455    HB2  LEU  56           HB2      LEU  56  30.503  21.257   6.806
  456    HB3  LEU  56           HB1      LEU  56  29.474  21.453   8.226
  457    HG   LEU  56           HG       LEU  56  32.359  22.340   7.934
  458   HD11  LEU  56          HD11      LEU  56  29.963  24.033   8.646
  459   HD12  LEU  56          HD12      LEU  56  30.385  23.714   6.964
  460   HD13  LEU  56          HD13      LEU  56  31.528  24.547   8.017
  461   HD21  LEU  56          HD21      LEU  56  32.207  21.593  10.179
  462   HD22  LEU  56          HD22      LEU  56  30.542  22.151  10.343
  463   HD23  LEU  56          HD23      LEU  56  31.863  23.319  10.283
  464    H    SER  57           HN       SER  57  31.396  19.144   6.053
  465    HA   SER  57           HA       SER  57  29.046  17.538   5.676
  466    HB2  SER  57           HB2      SER  57  31.763  17.385   4.330
  467    HB3  SER  57           HB1      SER  57  30.330  16.521   3.781
  468    HG   SER  57           HG       SER  57  31.045  18.990   3.220
  469    H    ASP  58           HN       ASP  58  32.399  16.663   6.463
  470    HA   ASP  58           HA       ASP  58  32.108  13.897   6.797
  471    HB2  ASP  58           HB2      ASP  58  34.272  15.101   7.001
  472    HB3  ASP  58           HB1      ASP  58  33.750  15.744   8.558
  473    H    TYR  59           HN       TYR  59  31.116  16.505   8.969
  474    HA   TYR  59           HA       TYR  59  30.452  14.726  11.172
  475    HB2  TYR  59           HB2      TYR  59  30.410  17.593  10.624
  476    HB3  TYR  59           HB1      TYR  59  28.902  17.119  11.394
  477    HD1  TYR  59           HD1      TYR  59  31.938  18.459  12.169
  478    HD2  TYR  59           HD2      TYR  59  29.491  15.111  13.294
  479    HE1  TYR  59           HE1      TYR  59  33.068  18.371  14.373
  480    HE2  TYR  59           HE2      TYR  59  30.622  15.023  15.498
  481    HH   TYR  59           HH       TYR  59  32.137  17.297  16.875
  482    H    ASN  60           HN       ASN  60  28.976  15.561   8.200
  483    HA   ASN  60           HA       ASN  60  26.902  14.985   7.262
  484    HB2  ASN  60           HB2      ASN  60  27.737  12.729   8.176
  485    HB3  ASN  60           HB1      ASN  60  26.641  13.001   9.531
  486   HD21  ASN  60          HD21      ASN  60  25.092  11.364   8.976
  487   HD22  ASN  60          HD22      ASN  60  24.148  11.436   7.566
  488    H    ILE  61           HN       ILE  61  26.508  17.240   8.462
  489    HA   ILE  61           HA       ILE  61  24.926  17.347  10.802
  490    HB   ILE  61           HB       ILE  61  26.062  19.280   9.629
  491   HG12  ILE  61          HG12      ILE  61  23.104  19.706  10.127
  492   HG13  ILE  61          HG11      ILE  61  24.291  19.488  11.411
  493   HG21  ILE  61          HG21      ILE  61  25.030  20.310   7.742
  494   HG22  ILE  61          HG22      ILE  61  23.579  19.321   7.901
  495   HG23  ILE  61          HG23      ILE  61  25.090  18.590   7.358
  496   HD11  ILE  61          HD11      ILE  61  24.634  21.600   9.282
  497   HD12  ILE  61          HD12      ILE  61  25.441  21.487  10.847
  498   HD13  ILE  61          HD13      ILE  61  23.732  21.910  10.763
  499    H    GLN  62           HN       GLN  62  22.644  17.513  11.061
  500    HA   GLN  62           HA       GLN  62  20.957  16.727   8.718
  501    HB2  GLN  62           HB2      GLN  62  20.889  15.477  11.485
  502    HB3  GLN  62           HB1      GLN  62  19.711  15.169  10.208
  503    HG2  GLN  62           HG2      GLN  62  21.524  14.329   8.747
  504    HG3  GLN  62           HG1      GLN  62  22.687  14.608  10.043
  505   HE21  GLN  62          HE21      GLN  62  23.183  12.632  11.001
  506   HE22  GLN  62          HE22      GLN  62  22.058  11.412  11.360
  507    H    LYS  63           HN       LYS  63  21.301  19.323   9.826
  508    HA   LYS  63           HA       LYS  63  18.972  19.810  11.580
  509    HB2  LYS  63           HB2      LYS  63  21.189  21.039  11.811
  510    HB3  LYS  63           HB1      LYS  63  20.815  21.840  10.288
  511    HG2  LYS  63           HG2      LYS  63  19.980  23.382  11.836
  512    HG3  LYS  63           HG1      LYS  63  18.538  22.443  11.468
  513    HD2  LYS  63           HD2      LYS  63  18.830  21.111  13.487
  514    HD3  LYS  63           HD1      LYS  63  20.373  21.893  13.821
  515    HE2  LYS  63           HE2      LYS  63  19.226  24.065  14.047
  516    HE3  LYS  63           HE1      LYS  63  17.680  23.281  13.723
  517    HZ1  LYS  63           HZ1      LYS  63  18.291  23.628  16.133
  518    HZ2  LYS  63           HZ2      LYS  63  19.459  22.413  15.923
  519    HZ3  LYS  63           HZ3      LYS  63  17.812  22.061  15.700
  520    H    GLU  64           HN       GLU  64  19.864  20.027   8.210
  521    HA   GLU  64           HA       GLU  64  18.642  20.712   6.326
  522    HB2  GLU  64           HB2      GLU  64  16.314  20.004   8.141
  523    HB3  GLU  64           HB1      GLU  64  16.241  20.166   6.386
  524    HG2  GLU  64           HG2      GLU  64  18.028  18.198   7.842
  525    HG3  GLU  64           HG1      GLU  64  16.460  17.788   7.144
  526    H    SEP  65           HN       SEP  65  19.499  22.850   7.860
  527    HA   SEP  65           HA       SEP  65  17.574  24.888   7.118
  528    HB2  SEP  65           HB1      SEP  65  18.077  24.435  10.076
  529    HB3  SEP  65           HB2      SEP  65  16.561  24.097   9.244
  530    H    TPO  66           HN       TPO  66  18.431  27.108   7.870
  531    HA   TPO  66           HA       TPO  66  21.075  27.498   7.039
  532    HB   TPO  66           HB       TPO  66  20.949  29.697   8.111
  533   HG21  TPO  66          HG21      TPO  66  19.621  29.315   6.063
  534   HG22  TPO  66          HG22      TPO  66  18.826  30.468   7.135
  535   HG23  TPO  66          HG23      TPO  66  18.253  28.803   7.053
  536    H    LEU  67           HN       LEU  67  23.078  27.510   8.083
  537    HA   LEU  67           HA       LEU  67  23.215  26.028  10.620
  538    HB2  LEU  67           HB2      LEU  67  25.532  27.277   9.128
  539    HB3  LEU  67           HB1      LEU  67  25.558  25.888  10.215
  540    HG   LEU  67           HG       LEU  67  24.199  25.995   7.505
  541   HD11  LEU  67          HD11      LEU  67  25.940  24.182   7.035
  542   HD12  LEU  67          HD12      LEU  67  26.736  24.698   8.522
  543   HD13  LEU  67          HD13      LEU  67  26.559  25.827   7.177
  544   HD21  LEU  67          HD21      LEU  67  24.333  23.894   9.676
  545   HD22  LEU  67          HD22      LEU  67  24.020  23.465   7.993
  546   HD23  LEU  67          HD23      LEU  67  22.906  24.526   8.855
  547    H    HIS  68           HN       HIS  68  23.043  27.100  12.517
  548    HA   HIS  68           HA       HIS  68  24.091  29.913  12.695
  549    HB2  HIS  68           HB2      HIS  68  21.638  29.808  12.904
  550    HB3  HIS  68           HB1      HIS  68  21.796  28.632  14.209
  551    HD1  HIS  68           HD1      HIS  68  20.651  30.353  15.854
  552    HD2  HIS  68           HD2      HIS  68  24.296  31.629  14.277
  553    HE1  HIS  68           HE1      HIS  68  21.383  32.334  17.254
  554    HE2  HIS  68           HE2      HIS  68  23.601  33.117  16.303
  555    H    LEU  69           HN       LEU  69  25.574  30.304  14.260
  556    HA   LEU  69           HA       LEU  69  26.121  28.159  16.296
  557    HB2  LEU  69           HB2      LEU  69  28.163  30.100  15.178
  558    HB3  LEU  69           HB1      LEU  69  28.459  28.647  16.130
  559    HG   LEU  69           HG       LEU  69  27.260  28.670  13.342
  560   HD11  LEU  69          HD11      LEU  69  29.510  27.572  12.801
  561   HD12  LEU  69          HD12      LEU  69  30.061  28.167  14.367
  562   HD13  LEU  69          HD13      LEU  69  29.548  29.306  13.122
  563   HD21  LEU  69          HD21      LEU  69  27.894  26.185  13.558
  564   HD22  LEU  69          HD22      LEU  69  26.497  26.724  14.484
  565   HD23  LEU  69          HD23      LEU  69  28.049  26.490  15.287
  566    H    VAL  70           HN       VAL  70  26.936  29.033  18.386
  567    HA   VAL  70           HA       VAL  70  26.432  31.951  18.793
  568    HB   VAL  70           HB       VAL  70  25.056  31.546  20.738
  569   HG11  VAL  70          HG11      VAL  70  24.138  29.793  18.438
  570   HG12  VAL  70          HG12      VAL  70  23.925  31.540  18.535
  571   HG13  VAL  70          HG13      VAL  70  23.101  30.486  19.685
  572   HG21  VAL  70          HG21      VAL  70  24.353  29.068  21.143
  573   HG22  VAL  70          HG22      VAL  70  25.930  29.589  21.733
  574   HG23  VAL  70          HG23      VAL  70  25.811  28.663  20.237
  575    H    LEU  71           HN       LEU  71  28.160  32.802  19.839
  576    HA   LEU  71           HA       LEU  71  30.133  31.017  21.074
  577    HB2  LEU  71           HB2      LEU  71  29.991  33.983  20.528
  578    HB3  LEU  71           HB1      LEU  71  31.277  33.297  21.519
  579    HG   LEU  71           HG       LEU  71  32.005  31.875  19.700
  580   HD11  LEU  71          HD11      LEU  71  29.982  31.224  18.639
  581   HD12  LEU  71          HD12      LEU  71  30.826  32.192  17.433
  582   HD13  LEU  71          HD13      LEU  71  29.499  32.897  18.355
  583   HD21  LEU  71          HD21      LEU  71  31.469  34.739  18.869
  584   HD22  LEU  71          HD22      LEU  71  32.513  33.649  17.959
  585   HD23  LEU  71          HD23      LEU  71  32.934  34.098  19.611
  586    H    ARG  72           HN       ARG  72  30.719  31.076  23.313
  587    HA   ARG  72           HA       ARG  72  28.725  32.401  25.123
  588    HB2  ARG  72           HB2      ARG  72  28.714  29.836  25.002
  589    HB3  ARG  72           HB1      ARG  72  30.317  29.898  25.735
  590    HG2  ARG  72           HG2      ARG  72  29.446  31.038  27.687
  591    HG3  ARG  72           HG1      ARG  72  27.857  31.200  26.937
  592    HD2  ARG  72           HD2      ARG  72  27.636  28.740  26.881
  593    HD3  ARG  72           HD1      ARG  72  29.214  28.583  27.652
  594    HE   ARG  72           HE       ARG  72  26.720  29.377  28.974
  595   HH11  ARG  72          HH11      ARG  72  26.877  29.634  31.214
  596   HH12  ARG  72          HH12      ARG  72  28.439  29.718  31.955
  597   HH21  ARG  72          HH21      ARG  72  30.167  29.373  28.969
  598   HH22  ARG  72          HH22      ARG  72  30.303  29.570  30.686
  599    H    LEU  73           HN       LEU  73  29.737  32.924  27.307
  600    HA   LEU  73           HA       LEU  73  32.610  33.737  26.958
  601    HB2  LEU  73           HB2      LEU  73  30.548  34.979  28.797
  602    HB3  LEU  73           HB1      LEU  73  32.148  35.607  28.404
  603    HG   LEU  73           HG       LEU  73  29.898  35.232  26.404
  604   HD11  LEU  73          HD11      LEU  73  29.697  37.665  26.455
  605   HD12  LEU  73          HD12      LEU  73  31.003  37.775  27.634
  606   HD13  LEU  73          HD13      LEU  73  29.472  37.026  28.084
  607   HD21  LEU  73          HD21      LEU  73  32.727  36.287  26.233
  608   HD22  LEU  73          HD22      LEU  73  31.496  36.802  25.081
  609   HD23  LEU  73          HD23      LEU  73  31.933  35.100  25.199
  610    H    ARG  74           HN       ARG  74  34.043  33.251  28.630
  611    HA   ARG  74           HA       ARG  74  32.990  31.978  31.098
  612    HB2  ARG  74           HB2      ARG  74  33.409  30.177  29.345
  613    HB3  ARG  74           HB1      ARG  74  35.115  30.615  29.424
  614    HG2  ARG  74           HG2      ARG  74  34.930  30.268  31.960
  615    HG3  ARG  74           HG1      ARG  74  33.382  29.492  31.630
  616    HD2  ARG  74           HD2      ARG  74  36.062  28.664  30.479
  617    HD3  ARG  74           HD1      ARG  74  35.169  27.810  31.737
  618    HE   ARG  74           HE       ARG  74  34.562  27.777  28.873
  619   HH11  ARG  74          HH11      ARG  74  32.862  26.412  28.276
  620   HH12  ARG  74          HH12      ARG  74  31.808  25.779  29.497
  621   HH21  ARG  74          HH21      ARG  74  33.447  27.366  32.108
  622   HH22  ARG  74          HH22      ARG  74  32.140  26.319  31.667
  623    H    GLY  75           HN       GLY  75  34.176  32.659  32.822
  624    HA2  GLY  75           HA3      GLY  75  36.029  33.448  34.053
  625    HA3  GLY  75           HA2      GLY  75  37.036  33.167  32.631
  626    H    GLY  76           HN       GLY  76  34.250  34.995  31.940
  627    HA2  GLY  76           HA3      GLY  76  33.941  37.273  31.458
  628    HA3  GLY  76           HA2      GLY  76  35.166  37.614  32.680
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1  28.908  29.195   4.708
    2    H2   MET   1           HT2      MET   1  30.173  30.253   4.301
    3    H3   MET   1           HT3      MET   1  29.939  28.821   3.415
    4    HA   MET   1           HA       MET   1  29.133  31.012   2.397
    5    HB2  MET   1           HB2      MET   1  28.604  28.739   1.537
    6    HB3  MET   1           HB1      MET   1  27.249  28.650   2.661
    7    HG2  MET   1           HG2      MET   1  26.188  30.575   1.600
    8    HG3  MET   1           HG1      MET   1  27.575  30.780   0.530
    9    HE1  MET   1           HE1      MET   1  25.976  30.761  -1.553
   10    HE2  MET   1           HE2      MET   1  24.641  30.625  -0.412
   11    HE3  MET   1           HE3      MET   1  24.713  29.547  -1.805
   12    H    GLN   2           HN       GLN   2  28.580  32.759   3.745
   13    HA   GLN   2           HA       GLN   2  27.200  34.097   5.098
   14    HB2  GLN   2           HB2      GLN   2  25.158  32.417   3.618
   15    HB3  GLN   2           HB1      GLN   2  24.736  33.807   4.618
   16    HG2  GLN   2           HG2      GLN   2  26.034  35.291   3.222
   17    HG3  GLN   2           HG1      GLN   2  26.692  33.934   2.307
   18   HE21  GLN   2          HE21      GLN   2  25.021  36.218   1.292
   19   HE22  GLN   2          HE22      GLN   2  23.656  35.498   0.582
   20    H    ILE   3           HN       ILE   3  28.308  32.180   6.630
   21    HA   ILE   3           HA       ILE   3  26.276  30.565   7.984
   22    HB   ILE   3           HB       ILE   3  29.181  31.137   8.639
   23   HG12  ILE   3          HG12      ILE   3  27.860  28.616   7.594
   24   HG13  ILE   3          HG11      ILE   3  28.627  29.814   6.550
   25   HG21  ILE   3          HG21      ILE   3  27.130  29.326   9.935
   26   HG22  ILE   3          HG22      ILE   3  28.099  30.583  10.704
   27   HG23  ILE   3          HG23      ILE   3  28.866  29.098  10.142
   28   HD11  ILE   3          HD11      ILE   3  30.035  28.442   8.853
   29   HD12  ILE   3          HD12      ILE   3  30.764  29.483   7.630
   30   HD13  ILE   3          HD13      ILE   3  30.136  27.899   7.178
   31    H    PHE   4           HN       PHE   4  25.122  31.169   9.756
   32    HA   PHE   4           HA       PHE   4  25.405  33.928  10.733
   33    HB2  PHE   4           HB2      PHE   4  23.460  31.679  11.277
   34    HB3  PHE   4           HB1      PHE   4  23.436  33.165  12.226
   35    HD1  PHE   4           HD1      PHE   4  23.201  31.823   8.756
   36    HD2  PHE   4           HD2      PHE   4  22.487  35.167  11.356
   37    HE1  PHE   4           HE1      PHE   4  21.931  32.956   6.951
   38    HE2  PHE   4           HE2      PHE   4  21.217  36.298   9.553
   39    HZ   PHE   4           HZ       PHE   4  20.938  35.194   7.351
   40    H    VAL   5           HN       VAL   5  26.075  34.528  12.779
   41    HA   VAL   5           HA       VAL   5  26.885  32.414  14.715
   42    HB   VAL   5           HB       VAL   5  28.714  34.645  13.772
   43   HG11  VAL   5          HG11      VAL   5  29.061  34.231  16.122
   44   HG12  VAL   5          HG12      VAL   5  30.363  33.421  15.251
   45   HG13  VAL   5          HG13      VAL   5  29.004  32.486  15.877
   46   HG21  VAL   5          HG21      VAL   5  30.128  32.735  12.987
   47   HG22  VAL   5          HG22      VAL   5  28.590  32.844  12.131
   48   HG23  VAL   5          HG23      VAL   5  28.811  31.636  13.397
   49    H    LYS   6           HN       LYS   6  25.486  33.031  16.335
   50    HA   LYS   6           HA       LYS   6  25.213  35.929  16.985
   51    HB2  LYS   6           HB2      LYS   6  23.690  33.494  17.959
   52    HB3  LYS   6           HB1      LYS   6  23.346  35.158  18.434
   53    HG2  LYS   6           HG2      LYS   6  22.928  35.747  16.073
   54    HG3  LYS   6           HG1      LYS   6  23.262  34.079  15.601
   55    HD2  LYS   6           HD2      LYS   6  21.384  33.298  16.989
   56    HD3  LYS   6           HD1      LYS   6  21.057  34.957  17.490
   57    HE2  LYS   6           HE2      LYS   6  19.542  34.342  15.672
   58    HE3  LYS   6           HE1      LYS   6  20.674  35.569  15.105
   59    HZ1  LYS   6           HZ1      LYS   6  20.247  33.429  13.714
   60    HZ2  LYS   6           HZ2      LYS   6  21.364  32.734  14.787
   61    HZ3  LYS   6           HZ3      LYS   6  21.814  34.069  13.835
   62    H    THR   7           HN       THR   7  26.216  36.777  18.750
   63    HA   THR   7           HA       THR   7  27.743  34.944  20.525
   64    HB   THR   7           HB       THR   7  28.937  36.915  21.239
   65    HG1  THR   7           HG1      THR   7  26.642  38.099  20.529
   66   HG21  THR   7          HG21      THR   7  29.606  36.048  19.052
   67   HG22  THR   7          HG22      THR   7  29.733  37.808  19.059
   68   HG23  THR   7          HG23      THR   7  28.367  37.026  18.264
   69    H    LEU   8           HN       LEU   8  27.772  35.792  22.929
   70    HA   LEU   8           HA       LEU   8  25.088  35.533  23.952
   71    HB2  LEU   8           HB2      LEU   8  27.577  36.489  25.399
   72    HB3  LEU   8           HB1      LEU   8  26.105  35.877  26.151
   73    HG   LEU   8           HG       LEU   8  27.888  34.284  24.283
   74   HD11  LEU   8          HD11      LEU   8  27.589  34.272  27.302
   75   HD12  LEU   8          HD12      LEU   8  29.036  34.685  26.384
   76   HD13  LEU   8          HD13      LEU   8  28.442  33.026  26.390
   77   HD21  LEU   8          HD21      LEU   8  26.457  32.393  25.417
   78   HD22  LEU   8          HD22      LEU   8  25.749  33.319  24.097
   79   HD23  LEU   8          HD23      LEU   8  25.322  33.698  25.766
   80    H    THR   9           HN       THR   9  27.204  38.275  23.311
   81    HA   THR   9           HA       THR   9  25.466  40.181  24.683
   82    HB   THR   9           HB       THR   9  26.948  41.885  23.684
   83    HG1  THR   9           HG1      THR   9  27.633  41.277  21.785
   84   HG21  THR   9          HG21      THR   9  29.101  41.031  24.650
   85   HG22  THR   9          HG22      THR   9  28.345  39.447  24.816
   86   HG23  THR   9          HG23      THR   9  27.716  40.824  25.722
   87    H    GLY  10           HN       GLY  10  25.085  38.458  21.889
   88    HA2  GLY  10           HA3      GLY  10  23.241  38.709  20.379
   89    HA3  GLY  10           HA2      GLY  10  23.092  40.399  20.866
   90    H    LYS  11           HN       LYS  11  26.203  40.424  20.497
   91    HA   LYS  11           HA       LYS  11  26.350  41.813  18.084
   92    HB2  LYS  11           HB2      LYS  11  28.222  41.600  19.728
   93    HB3  LYS  11           HB1      LYS  11  28.502  39.958  19.150
   94    HG2  LYS  11           HG2      LYS  11  28.934  40.812  16.883
   95    HG3  LYS  11           HG1      LYS  11  28.629  42.459  17.439
   96    HD2  LYS  11           HD2      LYS  11  30.511  42.276  19.026
   97    HD3  LYS  11           HD1      LYS  11  30.821  40.631  18.468
   98    HE2  LYS  11           HE2      LYS  11  31.246  41.477  16.191
   99    HE3  LYS  11           HE1      LYS  11  30.931  43.122  16.740
  100    HZ1  LYS  11           HZ1      LYS  11  33.119  41.325  17.626
  101    HZ2  LYS  11           HZ2      LYS  11  32.756  42.810  18.368
  102    HZ3  LYS  11           HZ3      LYS  11  33.271  42.770  16.749
  103    H    THR  12           HN       THR  12  25.853  41.187  16.044
  104    HA   THR  12           HA       THR  12  25.769  38.294  15.390
  105    HB   THR  12           HB       THR  12  24.897  40.727  13.799
  106    HG1  THR  12           HG1      THR  12  22.817  39.895  14.381
  107   HG21  THR  12          HG21      THR  12  23.643  38.935  12.493
  108   HG22  THR  12          HG22      THR  12  24.662  37.752  13.311
  109   HG23  THR  12          HG23      THR  12  25.390  38.965  12.260
  110    H    ILE  13           HN       ILE  13  27.106  37.341  13.871
  111    HA   ILE  13           HA       ILE  13  29.014  39.039  12.348
  112    HB   ILE  13           HB       ILE  13  29.910  36.644  13.985
  113   HG12  ILE  13          HG12      ILE  13  30.274  39.609  14.525
  114   HG13  ILE  13          HG11      ILE  13  29.287  38.501  15.479
  115   HG21  ILE  13          HG21      ILE  13  32.137  37.321  13.335
  116   HG22  ILE  13          HG22      ILE  13  31.523  38.799  12.594
  117   HG23  ILE  13          HG23      ILE  13  31.162  37.232  11.868
  118   HD11  ILE  13          HD11      ILE  13  32.295  38.426  15.125
  119   HD12  ILE  13          HD12      ILE  13  31.368  37.129  15.882
  120   HD13  ILE  13          HD13      ILE  13  31.401  38.734  16.614
  121    H    THR  14           HN       THR  14  29.443  38.146  10.323
  122    HA   THR  14           HA       THR  14  28.292  35.424   9.764
  123    HB   THR  14           HB       THR  14  27.712  36.269   7.523
  124    HG1  THR  14           HG1      THR  14  28.994  37.905   7.057
  125   HG21  THR  14          HG21      THR  14  26.000  36.415   9.239
  126   HG22  THR  14          HG22      THR  14  25.920  37.863   8.237
  127   HG23  THR  14          HG23      THR  14  26.674  37.933   9.830
  128    H    LEU  15           HN       LEU  15  29.583  34.047   8.610
  129    HA   LEU  15           HA       LEU  15  32.201  35.089   7.567
  130    HB2  LEU  15           HB2      LEU  15  31.751  32.380   8.854
  131    HB3  LEU  15           HB1      LEU  15  33.290  33.082   8.362
  132    HG   LEU  15           HG       LEU  15  31.483  34.284  10.482
  133   HD11  LEU  15          HD11      LEU  15  33.114  33.379  12.101
  134   HD12  LEU  15          HD12      LEU  15  33.977  32.582  10.785
  135   HD13  LEU  15          HD13      LEU  15  32.336  32.084  11.193
  136   HD21  LEU  15          HD21      LEU  15  34.269  34.884   9.462
  137   HD22  LEU  15          HD22      LEU  15  33.729  35.421  11.053
  138   HD23  LEU  15          HD23      LEU  15  32.899  35.985   9.606
  139    H    GLU  16           HN       GLU  16  32.136  34.841   5.376
  140    HA   GLU  16           HA       GLU  16  30.406  32.746   4.194
  141    HB2  GLU  16           HB2      GLU  16  32.113  34.880   2.873
  142    HB3  GLU  16           HB1      GLU  16  30.945  33.838   2.057
  143    HG2  GLU  16           HG2      GLU  16  29.135  34.770   3.451
  144    HG3  GLU  16           HG1      GLU  16  30.299  35.817   4.263
  145    H    VAL  17           HN       VAL  17  31.316  30.755   4.059
  146    HA   VAL  17           HA       VAL  17  33.827  30.418   2.612
  147    HB   VAL  17           HB       VAL  17  34.758  30.828   4.810
  148   HG11  VAL  17          HG11      VAL  17  32.889  28.643   5.776
  149   HG12  VAL  17          HG12      VAL  17  32.693  30.365   6.101
  150   HG13  VAL  17          HG13      VAL  17  34.079  29.495   6.761
  151   HG21  VAL  17          HG21      VAL  17  36.013  28.813   5.094
  152   HG22  VAL  17          HG22      VAL  17  35.603  28.883   3.380
  153   HG23  VAL  17          HG23      VAL  17  34.697  27.824   4.461
  154    H    GLU  18           HN       GLU  18  34.105  28.221   1.929
  155    HA   GLU  18           HA       GLU  18  31.847  26.769   1.288
  156    HB2  GLU  18           HB2      GLU  18  33.546  24.765   1.314
  157    HB3  GLU  18           HB1      GLU  18  33.790  26.091   0.187
  158    HG2  GLU  18           HG2      GLU  18  35.455  27.090   1.582
  159    HG3  GLU  18           HG1      GLU  18  35.053  26.032   2.936
  160    HA   PRO  19           HA       PRO  19  30.300  25.479   5.377
  161    HB2  PRO  19           HB2      PRO  19  29.354  23.183   3.672
  162    HB3  PRO  19           HB1      PRO  19  28.479  24.082   4.931
  163    HG2  PRO  19           HG2      PRO  19  28.050  24.572   2.352
  164    HG3  PRO  19           HG1      PRO  19  28.067  25.885   3.546
  165    HD2  PRO  19           HD2      PRO  19  30.095  25.222   1.462
  166    HD3  PRO  19           HD1      PRO  19  29.737  26.784   2.233
  167    H    SER  20           HN       SER  20  32.452  23.725   3.312
  168    HA   SER  20           HA       SER  20  32.855  21.471   5.107
  169    HB2  SER  20           HB2      SER  20  34.955  21.164   3.670
  170    HB3  SER  20           HB1      SER  20  33.412  21.083   2.824
  171    HG   SER  20           HG       SER  20  33.760  23.052   1.982
  172    H    ASP  21           HN       ASP  21  33.312  24.522   5.781
  173    HA   ASP  21           HA       ASP  21  35.990  24.996   6.441
  174    HB2  ASP  21           HB2      ASP  21  34.809  26.163   8.565
  175    HB3  ASP  21           HB1      ASP  21  34.690  26.842   6.949
  176    H    THR  22           HN       THR  22  36.869  24.953   8.765
  177    HA   THR  22           HA       THR  22  36.225  22.311  10.060
  178    HB   THR  22           HB       THR  22  38.537  21.962  10.491
  179    HG1  THR  22           HG1      THR  22  38.635  24.521  10.658
  180   HG21  THR  22          HG21      THR  22  37.865  21.553   8.142
  181   HG22  THR  22          HG22      THR  22  39.555  22.042   8.262
  182   HG23  THR  22          HG23      THR  22  38.336  23.203   7.732
  183    H    ILE  23           HN       ILE  23  36.273  22.271  12.329
  184    HA   ILE  23           HA       ILE  23  35.344  24.503  13.736
  185    HB   ILE  23           HB       ILE  23  36.815  22.011  14.600
  186   HG12  ILE  23          HG12      ILE  23  34.676  21.394  15.513
  187   HG13  ILE  23          HG11      ILE  23  34.027  23.010  15.259
  188   HG21  ILE  23          HG21      ILE  23  36.144  22.711  16.979
  189   HG22  ILE  23          HG22      ILE  23  35.964  24.342  16.330
  190   HG23  ILE  23          HG23      ILE  23  37.535  23.543  16.281
  191   HD11  ILE  23          HD11      ILE  23  33.285  21.320  13.549
  192   HD12  ILE  23          HD12      ILE  23  34.960  21.187  13.025
  193   HD13  ILE  23          HD13      ILE  23  34.100  22.719  12.854
  194    H    GLU  24           HN       GLU  24  38.717  23.342  13.539
  195    HA   GLU  24           HA       GLU  24  39.865  25.444  15.078
  196    HB2  GLU  24           HB2      GLU  24  41.978  24.836  13.820
  197    HB3  GLU  24           HB1      GLU  24  41.180  23.483  14.619
  198    HG2  GLU  24           HG2      GLU  24  40.089  22.871  12.486
  199    HG3  GLU  24           HG1      GLU  24  40.898  24.222  11.690
  200    H    ASN  25           HN       ASN  25  39.023  25.250  11.643
  201    HA   ASN  25           HA       ASN  25  40.405  27.653  10.880
  202    HB2  ASN  25           HB2      ASN  25  38.199  25.985   9.680
  203    HB3  ASN  25           HB1      ASN  25  38.715  27.482   8.933
  204   HD21  ASN  25          HD21      ASN  25  39.083  24.903   7.673
  205   HD22  ASN  25          HD22      ASN  25  40.751  24.615   7.563
  206    H    VAL  26           HN       VAL  26  37.031  26.927  11.800
  207    HA   VAL  26           HA       VAL  26  36.006  29.569  11.458
  208    HB   VAL  26           HB       VAL  26  35.200  27.496  13.524
  209   HG11  VAL  26          HG11      VAL  26  33.739  29.867  12.328
  210   HG12  VAL  26          HG12      VAL  26  34.281  29.707  13.998
  211   HG13  VAL  26          HG13      VAL  26  33.002  28.661  13.383
  212   HG21  VAL  26          HG21      VAL  26  33.957  27.983  10.810
  213   HG22  VAL  26          HG22      VAL  26  33.687  26.626  11.902
  214   HG23  VAL  26          HG23      VAL  26  35.227  26.789  11.061
  215    H    LYS  27           HN       LYS  27  36.936  27.964  14.496
  216    HA   LYS  27           HA       LYS  27  36.926  30.106  16.243
  217    HB2  LYS  27           HB2      LYS  27  38.937  27.846  16.014
  218    HB3  LYS  27           HB1      LYS  27  38.856  28.941  17.395
  219    HG2  LYS  27           HG2      LYS  27  36.419  28.293  17.638
  220    HG3  LYS  27           HG1      LYS  27  36.705  27.047  16.425
  221    HD2  LYS  27           HD2      LYS  27  38.341  25.954  17.810
  222    HD3  LYS  27           HD1      LYS  27  38.334  27.288  18.966
  223    HE2  LYS  27           HE2      LYS  27  36.009  26.806  19.553
  224    HE3  LYS  27           HE1      LYS  27  35.951  25.516  18.353
  225    HZ1  LYS  27           HZ1      LYS  27  36.720  24.158  19.904
  226    HZ2  LYS  27           HZ2      LYS  27  36.928  25.437  21.004
  227    HZ3  LYS  27           HZ3      LYS  27  38.175  25.031  19.922
  228    H    ALA  28           HN       ALA  28  39.578  29.242  14.003
  229    HA   ALA  28           HA       ALA  28  41.296  31.406  14.800
  230    HB1  ALA  28           HB1      ALA  28  42.318  29.618  13.615
  231    HB2  ALA  28           HB2      ALA  28  42.321  30.965  12.477
  232    HB3  ALA  28           HB3      ALA  28  41.118  29.682  12.325
  233    H    LYS  29           HN       LYS  29  39.266  31.031  11.867
  234    HA   LYS  29           HA       LYS  29  39.566  33.530  10.731
  235    HB2  LYS  29           HB2      LYS  29  37.098  31.819  11.010
  236    HB3  LYS  29           HB1      LYS  29  37.092  33.310  10.068
  237    HG2  LYS  29           HG2      LYS  29  38.541  32.466   8.448
  238    HG3  LYS  29           HG1      LYS  29  39.290  31.322   9.561
  239    HD2  LYS  29           HD2      LYS  29  37.298  29.932   9.538
  240    HD3  LYS  29           HD1      LYS  29  36.455  31.093   8.515
  241    HE2  LYS  29           HE2      LYS  29  37.682  28.972   7.466
  242    HE3  LYS  29           HE1      LYS  29  37.670  30.518   6.622
  243    HZ1  LYS  29           HZ1      LYS  29  39.810  29.902   8.548
  244    HZ2  LYS  29           HZ2      LYS  29  39.834  30.956   7.216
  245    HZ3  LYS  29           HZ3      LYS  29  39.888  29.274   6.974
  246    H    ILE  30           HN       ILE  30  37.565  32.764  13.588
  247    HA   ILE  30           HA       ILE  30  36.513  35.473  13.759
  248    HB   ILE  30           HB       ILE  30  36.556  33.121  15.681
  249   HG12  ILE  30          HG12      ILE  30  34.259  34.378  14.150
  250   HG13  ILE  30          HG11      ILE  30  35.182  33.001  13.550
  251   HG21  ILE  30          HG21      ILE  30  36.420  35.112  17.035
  252   HG22  ILE  30          HG22      ILE  30  34.772  34.498  16.879
  253   HG23  ILE  30          HG23      ILE  30  35.297  35.871  15.907
  254   HD11  ILE  30          HD11      ILE  30  34.577  31.699  15.541
  255   HD12  ILE  30          HD12      ILE  30  33.123  32.278  14.726
  256   HD13  ILE  30          HD13      ILE  30  33.693  33.080  16.190
  257    H    GLN  31           HN       GLN  31  39.085  33.593  15.317
  258    HA   GLN  31           HA       GLN  31  39.910  35.340  17.318
  259    HB2  GLN  31           HB2      GLN  31  40.890  33.114  16.954
  260    HB3  GLN  31           HB1      GLN  31  41.649  33.680  15.468
  261    HG2  GLN  31           HG2      GLN  31  42.975  35.294  16.720
  262    HG3  GLN  31           HG1      GLN  31  42.179  34.831  18.221
  263   HE21  GLN  31          HE21      GLN  31  44.787  34.470  18.498
  264   HE22  GLN  31          HE22      GLN  31  45.278  32.866  18.242
  265    H    ASP  32           HN       ASP  32  41.081  35.346  13.917
  266    HA   ASP  32           HA       ASP  32  42.678  37.704  14.269
  267    HB2  ASP  32           HB2      ASP  32  42.915  35.987  12.424
  268    HB3  ASP  32           HB1      ASP  32  41.488  36.704  11.673
  269    H    LYS  33           HN       LYS  33  39.276  37.238  13.440
  270    HA   LYS  33           HA       LYS  33  38.918  39.968  12.510
  271    HB2  LYS  33           HB2      LYS  33  37.183  37.623  13.095
  272    HB3  LYS  33           HB1      LYS  33  36.421  39.198  12.958
  273    HG2  LYS  33           HG2      LYS  33  36.593  37.747  10.840
  274    HG3  LYS  33           HG1      LYS  33  37.045  39.439  10.698
  275    HD2  LYS  33           HD2      LYS  33  39.352  38.923  10.560
  276    HD3  LYS  33           HD1      LYS  33  39.130  37.329  11.271
  277    HE2  LYS  33           HE2      LYS  33  38.022  36.528   9.274
  278    HE3  LYS  33           HE1      LYS  33  38.029  38.148   8.575
  279    HZ1  LYS  33           HZ1      LYS  33  40.642  37.430   9.359
  280    HZ2  LYS  33           HZ2      LYS  33  40.062  37.812   7.808
  281    HZ3  LYS  33           HZ3      LYS  33  40.001  36.210   8.368
  282    H    GLU  34           HN       GLU  34  38.144  38.235  15.546
  283    HA   GLU  34           HA       GLU  34  37.358  40.823  16.779
  284    HB2  GLU  34           HB2      GLU  34  37.292  38.060  18.019
  285    HB3  GLU  34           HB1      GLU  34  36.464  39.510  18.579
  286    HG2  GLU  34           HG2      GLU  34  35.114  39.560  16.527
  287    HG3  GLU  34           HG1      GLU  34  35.951  38.124  15.935
  288    H    GLY  35           HN       GLY  35  39.892  38.338  17.001
  289    HA2  GLY  35           HA3      GLY  35  42.081  38.715  17.856
  290    HA3  GLY  35           HA2      GLY  35  41.532  40.238  18.557
  291    H    ILE  36           HN       ILE  36  39.505  37.528  19.092
  292    HA   ILE  36           HA       ILE  36  40.214  37.521  21.960
  293    HB   ILE  36           HB       ILE  36  37.898  36.240  20.517
  294   HG12  ILE  36          HG12      ILE  36  38.144  38.922  21.916
  295   HG13  ILE  36          HG11      ILE  36  37.951  38.684  20.181
  296   HG21  ILE  36          HG21      ILE  36  38.255  37.027  23.416
  297   HG22  ILE  36          HG22      ILE  36  38.512  35.394  22.811
  298   HG23  ILE  36          HG23      ILE  36  36.912  36.123  22.719
  299   HD11  ILE  36          HD11      ILE  36  35.777  39.168  21.074
  300   HD12  ILE  36          HD12      ILE  36  35.985  37.975  22.356
  301   HD13  ILE  36          HD13      ILE  36  35.815  37.449  20.681
  302    HA   PRO  37           HA       PRO  37  42.700  33.784  20.922
  303    HB2  PRO  37           HB2      PRO  37  42.418  33.568  23.908
  304    HB3  PRO  37           HB1      PRO  37  43.850  33.298  22.892
  305    HG2  PRO  37           HG2      PRO  37  43.578  35.553  24.250
  306    HG3  PRO  37           HG1      PRO  37  44.227  35.566  22.599
  307    HD2  PRO  37           HD2      PRO  37  41.529  36.430  23.565
  308    HD3  PRO  37           HD1      PRO  37  42.490  37.049  22.203
  309    HA   PRO  38           HA       PRO  38  39.046  31.050  20.576
  310    HB2  PRO  38           HB2      PRO  38  41.350  29.140  20.435
  311    HB3  PRO  38           HB1      PRO  38  39.832  29.130  19.510
  312    HG2  PRO  38           HG2      PRO  38  41.982  30.104  18.411
  313    HG3  PRO  38           HG1      PRO  38  40.457  30.973  18.231
  314    HD2  PRO  38           HD2      PRO  38  42.825  31.660  19.935
  315    HD3  PRO  38           HD1      PRO  38  41.655  32.737  19.137
  316    H    ASP  39           HN       ASP  39  41.795  30.227  22.687
  317    HA   ASP  39           HA       ASP  39  40.558  28.256  24.270
  318    HB2  ASP  39           HB2      ASP  39  42.619  30.354  24.976
  319    HB3  ASP  39           HB1      ASP  39  42.130  29.084  26.096
  320    H    GLN  40           HN       GLN  40  40.185  31.733  24.323
  321    HA   GLN  40           HA       GLN  40  38.637  31.678  26.826
  322    HB2  GLN  40           HB2      GLN  40  39.201  33.918  24.862
  323    HB3  GLN  40           HB1      GLN  40  38.430  34.106  26.433
  324    HG2  GLN  40           HG2      GLN  40  40.485  33.091  27.480
  325    HG3  GLN  40           HG1      GLN  40  41.252  33.155  25.894
  326   HE21  GLN  40          HE21      GLN  40  41.921  34.702  28.414
  327   HE22  GLN  40          HE22      GLN  40  41.854  36.335  27.956
  328    H    GLN  41           HN       GLN  41  37.930  30.735  23.762
  329    HA   GLN  41           HA       GLN  41  35.047  31.496  24.069
  330    HB2  GLN  41           HB2      GLN  41  36.683  31.602  21.518
  331    HB3  GLN  41           HB1      GLN  41  34.934  31.808  21.604
  332    HG2  GLN  41           HG2      GLN  41  35.330  33.708  23.224
  333    HG3  GLN  41           HG1      GLN  41  37.049  33.570  22.862
  334   HE21  GLN  41          HE21      GLN  41  37.475  33.543  20.315
  335   HE22  GLN  41          HE22      GLN  41  36.600  34.692  19.426
  336    H    ARG  42           HN       ARG  42  33.639  29.870  23.634
  337    HA   ARG  42           HA       ARG  42  34.654  27.359  22.358
  338    HB2  ARG  42           HB2      ARG  42  32.981  27.597  24.885
  339    HB3  ARG  42           HB1      ARG  42  33.256  26.086  24.022
  340    HG2  ARG  42           HG2      ARG  42  35.624  27.750  24.865
  341    HG3  ARG  42           HG1      ARG  42  34.812  26.740  26.057
  342    HD2  ARG  42           HD2      ARG  42  35.140  24.764  24.613
  343    HD3  ARG  42           HD1      ARG  42  35.962  25.771  23.421
  344    HE   ARG  42           HE       ARG  42  37.177  25.959  26.058
  345   HH11  ARG  42          HH11      ARG  42  39.234  25.043  26.254
  346   HH12  ARG  42          HH12      ARG  42  39.803  23.955  25.033
  347   HH21  ARG  42          HH21      ARG  42  36.916  24.166  23.124
  348   HH22  ARG  42          HH22      ARG  42  38.490  23.456  23.262
  349    H    LEU  43           HN       LEU  43  33.286  26.708  20.735
  350    HA   LEU  43           HA       LEU  43  30.831  28.276  20.339
  351    HB2  LEU  43           HB2      LEU  43  32.377  26.279  18.680
  352    HB3  LEU  43           HB1      LEU  43  30.760  26.827  18.192
  353    HG   LEU  43           HG       LEU  43  31.497  29.128  18.109
  354   HD11  LEU  43          HD11      LEU  43  33.999  29.574  18.520
  355   HD12  LEU  43          HD12      LEU  43  34.022  28.016  19.342
  356   HD13  LEU  43          HD13      LEU  43  32.996  29.317  19.947
  357   HD21  LEU  43          HD21      LEU  43  32.057  27.521  16.212
  358   HD22  LEU  43          HD22      LEU  43  33.697  27.470  16.860
  359   HD23  LEU  43          HD23      LEU  43  33.028  28.993  16.271
  360    H    ILE  44           HN       ILE  44  28.785  27.452  20.289
  361    HA   ILE  44           HA       ILE  44  28.369  24.613  21.187
  362    HB   ILE  44           HB       ILE  44  26.821  27.093  22.020
  363   HG12  ILE  44          HG12      ILE  44  28.955  26.902  23.201
  364   HG13  ILE  44          HG11      ILE  44  27.637  26.511  24.300
  365   HG21  ILE  44          HG21      ILE  44  26.406  24.142  22.616
  366   HG22  ILE  44          HG22      ILE  44  25.278  25.232  21.810
  367   HG23  ILE  44          HG23      ILE  44  25.624  25.432  23.531
  368   HD11  ILE  44          HD11      ILE  44  29.070  24.754  24.765
  369   HD12  ILE  44          HD12      ILE  44  29.734  24.722  23.137
  370   HD13  ILE  44          HD13      ILE  44  28.151  24.020  23.453
  371    H    PHE  45           HN       PHE  45  26.860  23.497  19.977
  372    HA   PHE  45           HA       PHE  45  25.201  25.058  18.024
  373    HB2  PHE  45           HB2      PHE  45  27.097  24.075  16.835
  374    HB3  PHE  45           HB1      PHE  45  26.745  22.495  17.535
  375    HD1  PHE  45           HD1      PHE  45  25.609  25.068  15.147
  376    HD2  PHE  45           HD2      PHE  45  24.870  21.171  16.778
  377    HE1  PHE  45           HE1      PHE  45  24.005  24.608  13.311
  378    HE2  PHE  45           HE2      PHE  45  23.267  20.701  14.945
  379    HZ   PHE  45           HZ       PHE  45  22.832  22.422  13.211
  380    H    ALA  46           HN       ALA  46  23.185  24.780  18.863
  381    HA   ALA  46           HA       ALA  46  21.295  23.700  19.749
  382    HB1  ALA  46           HB1      ALA  46  22.352  21.587  17.852
  383    HB2  ALA  46           HB2      ALA  46  21.220  22.881  17.455
  384    HB3  ALA  46           HB3      ALA  46  20.732  21.588  18.551
  385    H    GLY  47           HN       GLY  47  23.256  23.524  21.649
  386    HA2  GLY  47           HA3      GLY  47  23.748  22.292  23.578
  387    HA3  GLY  47           HA2      GLY  47  22.509  21.145  23.073
  388    H    LYS  48           HN       LYS  48  24.477  21.285  20.460
  389    HA   LYS  48           HA       LYS  48  25.860  18.808  21.266
  390    HB2  LYS  48           HB2      LYS  48  25.958  20.183  18.600
  391    HB3  LYS  48           HB1      LYS  48  26.341  18.504  18.948
  392    HG2  LYS  48           HG2      LYS  48  23.916  18.296  19.780
  393    HG3  LYS  48           HG1      LYS  48  23.631  19.843  18.980
  394    HD2  LYS  48           HD2      LYS  48  24.482  18.864  16.852
  395    HD3  LYS  48           HD1      LYS  48  24.659  17.310  17.666
  396    HE2  LYS  48           HE2      LYS  48  22.233  17.329  18.191
  397    HE3  LYS  48           HE1      LYS  48  22.071  18.848  17.310
  398    HZ1  LYS  48           HZ1      LYS  48  23.346  16.592  15.950
  399    HZ2  LYS  48           HZ2      LYS  48  22.384  17.841  15.313
  400    HZ3  LYS  48           HZ3      LYS  48  21.661  16.549  16.148
  401    H    GLN  49           HN       GLN  49  28.187  18.576  20.570
  402    HA   GLN  49           HA       GLN  49  29.734  21.089  20.906
  403    HB2  GLN  49           HB2      GLN  49  30.116  18.472  22.301
  404    HB3  GLN  49           HB1      GLN  49  31.385  19.686  22.221
  405    HG2  GLN  49           HG2      GLN  49  29.857  21.326  23.277
  406    HG3  GLN  49           HG1      GLN  49  28.613  20.080  23.390
  407   HE21  GLN  49          HE21      GLN  49  30.860  21.585  25.273
  408   HE22  GLN  49          HE22      GLN  49  31.229  20.330  26.354
  409    H    LEU  50           HN       LEU  50  31.224  21.347  19.312
  410    HA   LEU  50           HA       LEU  50  31.741  19.049  17.492
  411    HB2  LEU  50           HB2      LEU  50  32.689  21.902  17.147
  412    HB3  LEU  50           HB1      LEU  50  32.490  20.664  15.906
  413    HG   LEU  50           HG       LEU  50  30.250  21.939  17.507
  414   HD11  LEU  50          HD11      LEU  50  31.381  23.343  15.717
  415   HD12  LEU  50          HD12      LEU  50  29.657  23.064  15.471
  416   HD13  LEU  50          HD13      LEU  50  30.840  22.141  14.545
  417   HD21  LEU  50          HD21      LEU  50  30.332  19.744  15.426
  418   HD22  LEU  50          HD22      LEU  50  28.873  20.692  15.707
  419   HD23  LEU  50          HD23      LEU  50  29.556  19.721  17.009
  420    H    GLU  51           HN       GLU  51  33.684  18.005  17.479
  421    HA   GLU  51           HA       GLU  51  35.771  18.920  19.382
  422    HB2  GLU  51           HB2      GLU  51  35.572  16.370  17.748
  423    HB3  GLU  51           HB1      GLU  51  36.750  16.697  19.020
  424    HG2  GLU  51           HG2      GLU  51  34.893  16.960  20.647
  425    HG3  GLU  51           HG1      GLU  51  33.743  16.556  19.373
  426    H    ASP  52           HN       ASP  52  38.011  19.076  18.679
  427    HA   ASP  52           HA       ASP  52  38.312  20.413  16.135
  428    HB2  ASP  52           HB2      ASP  52  40.314  19.409  18.173
  429    HB3  ASP  52           HB1      ASP  52  40.782  20.286  16.716
  430    H    GLY  53           HN       GLY  53  39.661  19.665  14.344
  431    HA2  GLY  53           HA3      GLY  53  40.659  18.005  12.965
  432    HA3  GLY  53           HA2      GLY  53  40.399  16.820  14.246
  433    H    ARG  54           HN       ARG  54  37.946  18.945  12.859
  434    HA   ARG  54           HA       ARG  54  36.810  16.771  11.240
  435    HB2  ARG  54           HB2      ARG  54  36.088  16.559  13.784
  436    HB3  ARG  54           HB1      ARG  54  34.958  17.840  13.358
  437    HG2  ARG  54           HG2      ARG  54  33.675  15.960  12.848
  438    HG3  ARG  54           HG1      ARG  54  34.426  16.260  11.289
  439    HD2  ARG  54           HD2      ARG  54  34.691  13.920  11.722
  440    HD3  ARG  54           HD1      ARG  54  36.271  14.649  12.008
  441    HE   ARG  54           HE       ARG  54  36.036  14.157  14.316
  442   HH11  ARG  54          HH11      ARG  54  34.958  13.166  16.036
  443   HH12  ARG  54          HH12      ARG  54  33.309  12.670  15.840
  444   HH21  ARG  54          HH21      ARG  54  33.090  13.775  12.561
  445   HH22  ARG  54          HH22      ARG  54  32.251  13.016  13.872
  446    H    THR  55           HN       THR  55  35.040  17.464   9.915
  447    HA   THR  55           HA       THR  55  34.780  20.441   9.640
  448    HB   THR  55           HB       THR  55  35.060  18.217   7.613
  449    HG1  THR  55           HG1      THR  55  36.401  20.151   6.809
  450   HG21  THR  55          HG21      THR  55  34.566  20.107   5.914
  451   HG22  THR  55          HG22      THR  55  33.732  20.897   7.253
  452   HG23  THR  55          HG23      THR  55  33.196  19.316   6.690
  453    H    LEU  56           HN       LEU  56  32.621  21.154   8.871
  454    HA   LEU  56           HA       LEU  56  30.457  19.891  10.191
  455    HB2  LEU  56           HB2      LEU  56  30.562  21.858   7.893
  456    HB3  LEU  56           HB1      LEU  56  29.033  21.283   8.546
  457    HG   LEU  56           HG       LEU  56  29.912  22.028  10.850
  458   HD11  LEU  56          HD11      LEU  56  31.580  23.935  10.648
  459   HD12  LEU  56          HD12      LEU  56  31.917  23.366   9.014
  460   HD13  LEU  56          HD13      LEU  56  32.251  22.324  10.398
  461   HD21  LEU  56          HD21      LEU  56  29.392  24.463  10.307
  462   HD22  LEU  56          HD22      LEU  56  28.173  23.295   9.798
  463   HD23  LEU  56          HD23      LEU  56  29.293  23.974   8.616
  464    H    SER  57           HN       SER  57  31.442  19.716   6.765
  465    HA   SER  57           HA       SER  57  29.330  17.944   5.954
  466    HB2  SER  57           HB2      SER  57  32.149  18.264   4.871
  467    HB3  SER  57           HB1      SER  57  30.878  17.337   4.077
  468    HG   SER  57           HG       SER  57  31.318  19.808   3.695
  469    H    ASP  58           HN       ASP  58  32.659  17.366   7.009
  470    HA   ASP  58           HA       ASP  58  32.722  14.566   6.935
  471    HB2  ASP  58           HB2      ASP  58  34.688  15.901   7.519
  472    HB3  ASP  58           HB1      ASP  58  33.920  16.401   9.025
  473    H    TYR  59           HN       TYR  59  31.122  16.681   9.296
  474    HA   TYR  59           HA       TYR  59  30.545  14.519  11.160
  475    HB2  TYR  59           HB2      TYR  59  29.662  17.369  10.807
  476    HB3  TYR  59           HB1      TYR  59  28.643  16.323  11.790
  477    HD1  TYR  59           HD1      TYR  59  31.270  18.603  11.976
  478    HD2  TYR  59           HD2      TYR  59  30.108  14.740  13.459
  479    HE1  TYR  59           HE1      TYR  59  32.779  18.896  13.922
  480    HE2  TYR  59           HE2      TYR  59  31.620  15.032  15.402
  481    HH   TYR  59           HH       TYR  59  33.845  16.502  15.797
  482    H    ASN  60           HN       ASN  60  29.178  15.659   8.184
  483    HA   ASN  60           HA       ASN  60  27.423  14.821   6.886
  484    HB2  ASN  60           HB2      ASN  60  28.411  12.591   7.819
  485    HB3  ASN  60           HB1      ASN  60  27.015  12.601   8.893
  486   HD21  ASN  60          HD21      ASN  60  27.872  12.756   5.404
  487   HD22  ASN  60          HD22      ASN  60  26.423  12.059   4.863
  488    H    ILE  61           HN       ILE  61  26.728  16.897   8.404
  489    HA   ILE  61           HA       ILE  61  24.452  16.249  10.151
  490    HB   ILE  61           HB       ILE  61  25.486  18.920   9.146
  491   HG12  ILE  61          HG12      ILE  61  25.835  17.606  11.858
  492   HG13  ILE  61          HG11      ILE  61  27.053  17.547  10.581
  493   HG21  ILE  61          HG21      ILE  61  23.457  18.168  11.269
  494   HG22  ILE  61          HG22      ILE  61  23.174  19.125   9.815
  495   HG23  ILE  61          HG23      ILE  61  24.163  19.776  11.119
  496   HD11  ILE  61          HD11      ILE  61  27.510  19.392  12.162
  497   HD12  ILE  61          HD12      ILE  61  25.923  20.078  11.813
  498   HD13  ILE  61          HD13      ILE  61  27.151  20.009  10.549
  499    H    GLN  62           HN       GLN  62  22.263  16.817   9.674
  500    HA   GLN  62           HA       GLN  62  21.644  17.678   6.891
  501    HB2  GLN  62           HB2      GLN  62  20.569  15.152   8.188
  502    HB3  GLN  62           HB1      GLN  62  19.991  15.831   6.666
  503    HG2  GLN  62           HG2      GLN  62  22.305  15.636   5.746
  504    HG3  GLN  62           HG1      GLN  62  22.799  14.846   7.243
  505   HE21  GLN  62          HE21      GLN  62  22.573  13.761   4.385
  506   HE22  GLN  62          HE22      GLN  62  21.600  12.379   4.538
  507    H    LYS  63           HN       LYS  63  21.076  19.613   8.252
  508    HA   LYS  63           HA       LYS  63  18.580  19.300   9.850
  509    HB2  LYS  63           HB2      LYS  63  20.434  21.670   9.455
  510    HB3  LYS  63           HB1      LYS  63  19.002  21.678  10.481
  511    HG2  LYS  63           HG2      LYS  63  21.137  19.579  10.874
  512    HG3  LYS  63           HG1      LYS  63  21.340  21.188  11.564
  513    HD2  LYS  63           HD2      LYS  63  19.090  20.921  12.672
  514    HD3  LYS  63           HD1      LYS  63  19.074  19.249  12.113
  515    HE2  LYS  63           HE2      LYS  63  21.182  20.498  13.896
  516    HE3  LYS  63           HE1      LYS  63  19.923  19.378  14.416
  517    HZ1  LYS  63           HZ1      LYS  63  22.395  18.852  13.028
  518    HZ2  LYS  63           HZ2      LYS  63  21.049  18.064  12.356
  519    HZ3  LYS  63           HZ3      LYS  63  21.450  17.822  13.989
  520    H    GLU  64           HN       GLU  64  19.437  19.868   6.680
  521    HA   GLU  64           HA       GLU  64  18.325  20.858   4.863
  522    HB2  GLU  64           HB2      GLU  64  15.980  20.279   6.699
  523    HB3  GLU  64           HB1      GLU  64  15.838  20.697   4.991
  524    HG2  GLU  64           HG2      GLU  64  17.160  18.722   4.375
  525    HG3  GLU  64           HG1      GLU  64  17.365  18.313   6.078
  526    H    SEP  65           HN       SEP  65  19.463  22.766   6.547
  527    HA   SEP  65           HA       SEP  65  17.853  25.087   5.920
  528    HB2  SEP  65           HB1      SEP  65  17.672  25.827   8.362
  529    HB3  SEP  65           HB2      SEP  65  18.012  24.153   8.793
  530    H    TPO  66           HN       TPO  66  18.966  27.116   6.731
  531    HA   TPO  66           HA       TPO  66  21.698  27.143   6.102
  532    HB   TPO  66           HB       TPO  66  20.221  29.003   7.990
  533   HG21  TPO  66          HG21      TPO  66  22.883  29.179   6.574
  534   HG22  TPO  66          HG22      TPO  66  22.539  29.417   8.288
  535   HG23  TPO  66          HG23      TPO  66  22.017  30.618   7.107
  536    H    LEU  67           HN       LEU  67  23.559  27.583   7.607
  537    HA   LEU  67           HA       LEU  67  23.424  25.715   9.915
  538    HB2  LEU  67           HB2      LEU  67  25.870  27.174   8.891
  539    HB3  LEU  67           HB1      LEU  67  25.803  25.679   9.825
  540    HG   LEU  67           HG       LEU  67  24.826  26.043   6.976
  541   HD11  LEU  67          HD11      LEU  67  26.703  24.742   6.316
  542   HD12  LEU  67          HD12      LEU  67  27.058  24.269   7.977
  543   HD13  LEU  67          HD13      LEU  67  27.348  25.927   7.452
  544   HD21  LEU  67          HD21      LEU  67  24.710  23.728   8.921
  545   HD22  LEU  67          HD22      LEU  67  24.654  23.472   7.177
  546   HD23  LEU  67          HD23      LEU  67  23.398  24.423   7.968
  547    H    HIS  68           HN       HIS  68  22.939  26.574  11.858
  548    HA   HIS  68           HA       HIS  68  23.662  29.427  12.425
  549    HB2  HIS  68           HB2      HIS  68  21.265  28.901  12.603
  550    HB3  HIS  68           HB1      HIS  68  21.625  27.611  13.750
  551    HD1  HIS  68           HD1      HIS  68  20.308  28.831  15.653
  552    HD2  HIS  68           HD2      HIS  68  23.537  31.006  14.156
  553    HE1  HIS  68           HE1      HIS  68  20.711  30.730  17.282
  554    HE2  HIS  68           HE2      HIS  68  22.676  32.059  16.381
  555    H    LEU  69           HN       LEU  69  24.982  29.886  14.147
  556    HA   LEU  69           HA       LEU  69  25.730  27.695  16.034
  557    HB2  LEU  69           HB2      LEU  69  27.777  29.481  14.678
  558    HB3  LEU  69           HB1      LEU  69  28.095  28.171  15.810
  559    HG   LEU  69           HG       LEU  69  26.693  26.774  13.949
  560   HD11  LEU  69          HD11      LEU  69  27.391  27.519  11.693
  561   HD12  LEU  69          HD12      LEU  69  28.109  28.966  12.399
  562   HD13  LEU  69          HD13      LEU  69  26.365  28.722  12.473
  563   HD21  LEU  69          HD21      LEU  69  29.639  27.485  13.923
  564   HD22  LEU  69          HD22      LEU  69  28.947  26.220  12.908
  565   HD23  LEU  69          HD23      LEU  69  28.878  26.076  14.664
  566    H    VAL  70           HN       VAL  70  26.602  28.526  18.060
  567    HA   VAL  70           HA       VAL  70  26.192  31.464  18.495
  568    HB   VAL  70           HB       VAL  70  25.284  29.196  20.300
  569   HG11  VAL  70          HG11      VAL  70  25.208  32.209  20.609
  570   HG12  VAL  70          HG12      VAL  70  26.047  31.054  21.643
  571   HG13  VAL  70          HG13      VAL  70  24.284  31.100  21.620
  572   HG21  VAL  70          HG21      VAL  70  23.776  29.478  18.413
  573   HG22  VAL  70          HG22      VAL  70  23.773  31.227  18.629
  574   HG23  VAL  70          HG23      VAL  70  23.020  30.190  19.839
  575    H    LEU  71           HN       LEU  71  28.103  32.294  19.205
  576    HA   LEU  71           HA       LEU  71  30.166  30.516  20.298
  577    HB2  LEU  71           HB2      LEU  71  30.634  32.397  18.692
  578    HB3  LEU  71           HB1      LEU  71  30.203  33.532  19.965
  579    HG   LEU  71           HG       LEU  71  32.250  31.455  20.685
  580   HD11  LEU  71          HD11      LEU  71  33.081  32.018  18.495
  581   HD12  LEU  71          HD12      LEU  71  34.060  32.890  19.675
  582   HD13  LEU  71          HD13      LEU  71  32.804  33.737  18.774
  583   HD21  LEU  71          HD21      LEU  71  31.626  33.153  22.328
  584   HD22  LEU  71          HD22      LEU  71  31.966  34.442  21.174
  585   HD23  LEU  71          HD23      LEU  71  33.280  33.450  21.802
  586    H    ARG  72           HN       ARG  72  30.905  30.535  22.441
  587    HA   ARG  72           HA       ARG  72  29.202  32.035  24.405
  588    HB2  ARG  72           HB2      ARG  72  29.203  29.472  24.415
  589    HB3  ARG  72           HB1      ARG  72  30.876  29.577  24.965
  590    HG2  ARG  72           HG2      ARG  72  30.072  31.065  26.845
  591    HG3  ARG  72           HG1      ARG  72  28.421  30.683  26.354
  592    HD2  ARG  72           HD2      ARG  72  28.995  29.142  28.107
  593    HD3  ARG  72           HD1      ARG  72  29.026  28.231  26.597
  594    HE   ARG  72           HE       ARG  72  31.646  29.251  27.108
  595   HH11  ARG  72          HH11      ARG  72  33.201  27.832  27.937
  596   HH12  ARG  72          HH12      ARG  72  32.693  26.374  28.722
  597   HH21  ARG  72          HH21      ARG  72  29.311  26.996  28.273
  598   HH22  ARG  72          HH22      ARG  72  30.491  25.901  28.912
  599    H    LEU  73           HN       LEU  73  30.296  33.032  26.192
  600    HA   LEU  73           HA       LEU  73  33.218  33.550  25.720
  601    HB2  LEU  73           HB2      LEU  73  31.223  35.261  27.232
  602    HB3  LEU  73           HB1      LEU  73  32.878  35.692  26.805
  603    HG   LEU  73           HG       LEU  73  30.702  35.074  24.784
  604   HD11  LEU  73          HD11      LEU  73  30.624  37.499  24.402
  605   HD12  LEU  73          HD12      LEU  73  31.828  37.750  25.668
  606   HD13  LEU  73          HD13      LEU  73  30.228  37.136  26.082
  607   HD21  LEU  73          HD21      LEU  73  33.573  36.004  24.602
  608   HD22  LEU  73          HD22      LEU  73  32.423  36.351  23.311
  609   HD23  LEU  73          HD23      LEU  73  32.788  34.682  23.739
  610    H    ARG  74           HN       ARG  74  34.622  33.075  27.371
  611    HA   ARG  74           HA       ARG  74  33.463  31.846  29.836
  612    HB2  ARG  74           HB2      ARG  74  36.305  31.793  28.768
  613    HB3  ARG  74           HB1      ARG  74  35.705  30.897  30.164
  614    HG2  ARG  74           HG2      ARG  74  33.960  29.905  28.510
  615    HG3  ARG  74           HG1      ARG  74  35.035  30.502  27.246
  616    HD2  ARG  74           HD2      ARG  74  35.779  28.577  29.467
  617    HD3  ARG  74           HD1      ARG  74  35.594  28.179  27.759
  618    HE   ARG  74           HE       ARG  74  37.511  30.156  27.723
  619   HH11  ARG  74          HH11      ARG  74  39.723  29.751  27.944
  620   HH12  ARG  74          HH12      ARG  74  40.252  28.333  28.786
  621   HH21  ARG  74          HH21      ARG  74  37.040  27.226  29.483
  622   HH22  ARG  74          HH22      ARG  74  38.733  26.904  29.657
  623    H    GLY  75           HN       GLY  75  33.911  32.709  31.864
  624    HA2  GLY  75           HA3      GLY  75  34.863  34.184  33.459
  625    HA3  GLY  75           HA2      GLY  75  35.913  34.825  32.193
  626    H    GLY  76           HN       GLY  76  32.847  34.795  30.947
  627    HA2  GLY  76           HA3      GLY  76  31.764  37.183  32.202
  628    HA3  GLY  76           HA2      GLY  76  32.525  37.534  30.649
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1  27.531  26.688   1.329
    2    H2   MET   1           HT2      MET   1  28.525  27.332   2.547
    3    H3   MET   1           HT3      MET   1  28.257  28.204   1.112
    4    HA   MET   1           HA       MET   1  26.042  28.677   1.658
    5    HB2  MET   1           HB2      MET   1  26.456  26.588   3.813
    6    HB3  MET   1           HB1      MET   1  25.059  27.665   3.766
    7    HG2  MET   1           HG2      MET   1  24.449  26.822   1.549
    8    HG3  MET   1           HG1      MET   1  25.879  25.791   1.527
    9    HE1  MET   1           HE1      MET   1  22.856  23.347   1.895
   10    HE2  MET   1           HE2      MET   1  24.322  23.715   0.990
   11    HE3  MET   1           HE3      MET   1  22.981  24.858   0.984
   12    H    GLN   2           HN       GLN   2  25.481  30.381   3.123
   13    HA   GLN   2           HA       GLN   2  27.799  31.565   4.476
   14    HB2  GLN   2           HB2      GLN   2  24.965  32.616   4.556
   15    HB3  GLN   2           HB1      GLN   2  26.474  33.524   4.670
   16    HG2  GLN   2           HG2      GLN   2  27.000  32.825   2.315
   17    HG3  GLN   2           HG1      GLN   2  25.394  32.102   2.221
   18   HE21  GLN   2          HE21      GLN   2  23.764  33.477   1.492
   19   HE22  GLN   2          HE22      GLN   2  23.845  35.173   1.508
   20    H    ILE   3           HN       ILE   3  28.284  30.570   6.412
   21    HA   ILE   3           HA       ILE   3  26.170  29.581   8.174
   22    HB   ILE   3           HB       ILE   3  28.116  29.148   9.742
   23   HG12  ILE   3          HG12      ILE   3  29.738  30.064   7.347
   24   HG13  ILE   3          HG11      ILE   3  29.552  30.994   8.834
   25   HG21  ILE   3          HG21      ILE   3  28.473  28.083   6.927
   26   HG22  ILE   3          HG22      ILE   3  27.248  27.501   8.054
   27   HG23  ILE   3          HG23      ILE   3  28.958  27.294   8.427
   28   HD11  ILE   3          HD11      ILE   3  30.747  28.215   8.615
   29   HD12  ILE   3          HD12      ILE   3  30.523  29.110  10.119
   30   HD13  ILE   3          HD13      ILE   3  31.644  29.707   8.895
   31    H    PHE   4           HN       PHE   4  25.342  30.609   9.964
   32    HA   PHE   4           HA       PHE   4  26.105  33.460  10.343
   33    HB2  PHE   4           HB2      PHE   4  23.767  31.811  11.341
   34    HB3  PHE   4           HB1      PHE   4  24.032  33.500  11.773
   35    HD1  PHE   4           HD1      PHE   4  23.113  31.174   9.080
   36    HD2  PHE   4           HD2      PHE   4  23.843  35.282  10.099
   37    HE1  PHE   4           HE1      PHE   4  22.047  31.889   6.959
   38    HE2  PHE   4           HE2      PHE   4  22.776  35.998   7.978
   39    HZ   PHE   4           HZ       PHE   4  21.876  34.301   6.408
   40    H    VAL   5           HN       VAL   5  26.497  34.280  12.506
   41    HA   VAL   5           HA       VAL   5  27.164  32.260  14.592
   42    HB   VAL   5           HB       VAL   5  29.062  34.434  13.640
   43   HG11  VAL   5          HG11      VAL   5  30.615  33.324  15.278
   44   HG12  VAL   5          HG12      VAL   5  29.247  32.370  15.854
   45   HG13  VAL   5          HG13      VAL   5  29.239  34.125  16.039
   46   HG21  VAL   5          HG21      VAL   5  29.152  32.638  12.066
   47   HG22  VAL   5          HG22      VAL   5  29.035  31.422  13.339
   48   HG23  VAL   5          HG23      VAL   5  30.510  32.373  13.159
   49    H    LYS   6           HN       LYS   6  25.936  32.940  16.296
   50    HA   LYS   6           HA       LYS   6  25.422  35.859  16.635
   51    HB2  LYS   6           HB2      LYS   6  23.491  34.280  16.620
   52    HB3  LYS   6           HB1      LYS   6  24.165  33.486  18.044
   53    HG2  LYS   6           HG2      LYS   6  24.016  35.580  19.314
   54    HG3  LYS   6           HG1      LYS   6  23.404  36.418  17.887
   55    HD2  LYS   6           HD2      LYS   6  21.438  34.927  17.849
   56    HD3  LYS   6           HD1      LYS   6  22.049  34.087  19.276
   57    HE2  LYS   6           HE2      LYS   6  21.934  36.183  20.567
   58    HE3  LYS   6           HE1      LYS   6  21.340  37.035  19.142
   59    HZ1  LYS   6           HZ1      LYS   6  19.298  36.329  19.554
   60    HZ2  LYS   6           HZ2      LYS   6  19.846  35.659  21.017
   61    HZ3  LYS   6           HZ3      LYS   6  19.800  34.710  19.609
   62    H    THR   7           HN       THR   7  26.736  36.916  18.022
   63    HA   THR   7           HA       THR   7  28.233  35.399  20.088
   64    HB   THR   7           HB       THR   7  28.372  38.350  19.406
   65    HG1  THR   7           HG1      THR   7  29.044  36.327  17.917
   66   HG21  THR   7          HG21      THR   7  30.116  36.456  20.990
   67   HG22  THR   7          HG22      THR   7  29.350  37.945  21.544
   68   HG23  THR   7          HG23      THR   7  30.695  38.016  20.407
   69    H    LEU   8           HN       LEU   8  28.124  36.049  22.342
   70    HA   LEU   8           HA       LEU   8  25.517  36.471  23.345
   71    HB2  LEU   8           HB2      LEU   8  26.715  37.158  25.492
   72    HB3  LEU   8           HB1      LEU   8  27.117  35.565  24.858
   73    HG   LEU   8           HG       LEU   8  28.831  37.783  23.827
   74   HD11  LEU   8          HD11      LEU   8  30.233  37.658  25.978
   75   HD12  LEU   8          HD12      LEU   8  28.778  37.027  26.751
   76   HD13  LEU   8          HD13      LEU   8  28.767  38.638  26.037
   77   HD21  LEU   8          HD21      LEU   8  30.513  36.134  23.872
   78   HD22  LEU   8          HD22      LEU   8  29.061  35.191  23.547
   79   HD23  LEU   8          HD23      LEU   8  29.734  35.233  25.174
   80    H    THR   9           HN       THR   9  27.881  38.762  22.208
   81    HA   THR   9           HA       THR   9  26.563  41.065  23.464
   82    HB   THR   9           HB       THR   9  28.189  42.390  22.139
   83    HG1  THR   9           HG1      THR   9  29.794  40.886  21.064
   84   HG21  THR   9          HG21      THR   9  29.563  39.997  23.375
   85   HG22  THR   9          HG22      THR   9  28.782  41.253  24.336
   86   HG23  THR   9          HG23      THR   9  30.149  41.659  23.300
   87    H    GLY  10           HN       GLY  10  25.787  39.096  20.904
   88    HA2  GLY  10           HA3      GLY  10  23.922  39.404  19.442
   89    HA3  GLY  10           HA2      GLY  10  23.955  41.132  19.794
   90    H    LYS  11           HN       LYS  11  27.049  40.708  19.283
   91    HA   LYS  11           HA       LYS  11  27.161  41.906  16.732
   92    HB2  LYS  11           HB2      LYS  11  29.184  40.153  18.154
   93    HB3  LYS  11           HB1      LYS  11  29.534  41.022  16.659
   94    HG2  LYS  11           HG2      LYS  11  28.979  43.155  17.753
   95    HG3  LYS  11           HG1      LYS  11  28.597  42.298  19.247
   96    HD2  LYS  11           HD2      LYS  11  30.921  41.458  19.354
   97    HD3  LYS  11           HD1      LYS  11  31.301  42.341  17.875
   98    HE2  LYS  11           HE2      LYS  11  30.308  43.608  20.445
   99    HE3  LYS  11           HE1      LYS  11  31.988  43.595  19.907
  100    HZ1  LYS  11           HZ1      LYS  11  31.334  45.565  19.033
  101    HZ2  LYS  11           HZ2      LYS  11  29.709  45.097  18.865
  102    HZ3  LYS  11           HZ3      LYS  11  30.868  44.567  17.743
  103    H    THR  12           HN       THR  12  26.364  41.064  14.873
  104    HA   THR  12           HA       THR  12  26.251  38.121  14.516
  105    HB   THR  12           HB       THR  12  25.173  40.378  12.799
  106    HG1  THR  12           HG1      THR  12  23.681  40.362  14.254
  107   HG21  THR  12          HG21      THR  12  24.955  37.369  12.642
  108   HG22  THR  12          HG22      THR  12  25.486  38.488  11.387
  109   HG23  THR  12          HG23      THR  12  23.788  38.436  11.863
  110    H    ILE  13           HN       ILE  13  27.524  37.028  13.067
  111    HA   ILE  13           HA       ILE  13  29.156  38.561  11.104
  112    HB   ILE  13           HB       ILE  13  30.358  36.472  12.951
  113   HG12  ILE  13          HG12      ILE  13  30.560  39.501  13.057
  114   HG13  ILE  13          HG11      ILE  13  29.761  38.475  14.249
  115   HG21  ILE  13          HG21      ILE  13  31.691  38.505  11.141
  116   HG22  ILE  13          HG22      ILE  13  31.350  36.845  10.649
  117   HG23  ILE  13          HG23      ILE  13  32.457  37.161  11.985
  118   HD11  ILE  13          HD11      ILE  13  31.985  37.294  14.563
  119   HD12  ILE  13          HD12      ILE  13  31.941  38.965  15.123
  120   HD13  ILE  13          HD13      ILE  13  32.712  38.570  13.587
  121    H    THR  14           HN       THR  14  29.373  37.412   9.180
  122    HA   THR  14           HA       THR  14  28.486  34.543   9.173
  123    HB   THR  14           HB       THR  14  26.723  36.072   8.275
  124    HG1  THR  14           HG1      THR  14  27.926  34.628   6.171
  125   HG21  THR  14          HG21      THR  14  27.112  37.386   6.319
  126   HG22  THR  14          HG22      THR  14  28.695  36.653   6.057
  127   HG23  THR  14          HG23      THR  14  28.444  37.748   7.417
  128    H    LEU  15           HN       LEU  15  29.675  33.191   7.857
  129    HA   LEU  15           HA       LEU  15  31.963  34.400   6.326
  130    HB2  LEU  15           HB2      LEU  15  31.997  31.749   7.796
  131    HB3  LEU  15           HB1      LEU  15  33.362  32.565   7.037
  132    HG   LEU  15           HG       LEU  15  31.779  33.710   9.357
  133   HD11  LEU  15          HD11      LEU  15  32.910  31.754  10.170
  134   HD12  LEU  15          HD12      LEU  15  33.883  33.143  10.653
  135   HD13  LEU  15          HD13      LEU  15  34.377  32.158   9.276
  136   HD21  LEU  15          HD21      LEU  15  34.279  34.538   7.867
  137   HD22  LEU  15          HD22      LEU  15  33.948  35.109   9.501
  138   HD23  LEU  15          HD23      LEU  15  32.833  35.494   8.193
  139    H    GLU  16           HN       GLU  16  31.656  33.984   4.189
  140    HA   GLU  16           HA       GLU  16  29.933  31.722   3.372
  141    HB2  GLU  16           HB2      GLU  16  31.359  33.670   1.549
  142    HB3  GLU  16           HB1      GLU  16  29.898  32.738   1.221
  143    HG2  GLU  16           HG2      GLU  16  28.825  34.027   3.161
  144    HG3  GLU  16           HG1      GLU  16  30.219  35.103   3.076
  145    H    VAL  17           HN       VAL  17  30.899  29.771   3.136
  146    HA   VAL  17           HA       VAL  17  33.248  29.495   1.440
  147    HB   VAL  17           HB       VAL  17  34.404  30.046   3.504
  148   HG11  VAL  17          HG11      VAL  17  32.570  29.514   5.065
  149   HG12  VAL  17          HG12      VAL  17  34.055  28.693   5.545
  150   HG13  VAL  17          HG13      VAL  17  32.777  27.795   4.726
  151   HG21  VAL  17          HG21      VAL  17  35.168  28.096   2.012
  152   HG22  VAL  17          HG22      VAL  17  34.508  27.034   3.256
  153   HG23  VAL  17          HG23      VAL  17  35.824  28.141   3.648
  154    H    GLU  18           HN       GLU  18  33.600  27.257   0.860
  155    HA   GLU  18           HA       GLU  18  31.411  25.668   0.422
  156    HB2  GLU  18           HB2      GLU  18  34.198  24.693   1.092
  157    HB3  GLU  18           HB1      GLU  18  32.956  23.735   0.285
  158    HG2  GLU  18           HG2      GLU  18  32.881  25.347  -1.563
  159    HG3  GLU  18           HG1      GLU  18  34.076  26.357  -0.749
  160    HA   PRO  19           HA       PRO  19  29.881  24.682   4.595
  161    HB2  PRO  19           HB2      PRO  19  29.022  22.225   3.080
  162    HB3  PRO  19           HB1      PRO  19  28.115  23.187   4.266
  163    HG2  PRO  19           HG2      PRO  19  27.670  23.471   1.664
  164    HG3  PRO  19           HG1      PRO  19  27.658  24.872   2.752
  165    HD2  PRO  19           HD2      PRO  19  29.702  24.096   0.721
  166    HD3  PRO  19           HD1      PRO  19  29.303  25.706   1.365
  167    H    SER  20           HN       SER  20  31.914  22.575   2.649
  168    HA   SER  20           HA       SER  20  32.443  20.681   4.794
  169    HB2  SER  20           HB2      SER  20  34.405  20.056   3.241
  170    HB3  SER  20           HB1      SER  20  32.775  19.833   2.608
  171    HG   SER  20           HG       SER  20  33.014  21.588   1.354
  172    H    ASP  21           HN       ASP  21  32.963  23.723   5.090
  173    HA   ASP  21           HA       ASP  21  35.738  24.213   5.303
  174    HB2  ASP  21           HB2      ASP  21  33.713  25.823   5.599
  175    HB3  ASP  21           HB1      ASP  21  33.743  25.313   7.283
  176    H    THR  22           HN       THR  22  36.988  24.397   7.358
  177    HA   THR  22           HA       THR  22  36.486  22.021   9.112
  178    HB   THR  22           HB       THR  22  38.866  22.191   9.690
  179    HG1  THR  22           HG1      THR  22  39.850  23.998   9.368
  180   HG21  THR  22          HG21      THR  22  38.613  22.465   6.692
  181   HG22  THR  22          HG22      THR  22  38.044  21.038   7.558
  182   HG23  THR  22          HG23      THR  22  39.752  21.472   7.601
  183    H    ILE  23           HN       ILE  23  36.351  22.286  11.346
  184    HA   ILE  23           HA       ILE  23  35.306  24.694  12.384
  185    HB   ILE  23           HB       ILE  23  36.834  22.658  14.022
  186   HG12  ILE  23          HG12      ILE  23  35.321  21.376  12.641
  187   HG13  ILE  23          HG11      ILE  23  34.581  21.520  14.232
  188   HG21  ILE  23          HG21      ILE  23  34.371  24.287  14.690
  189   HG22  ILE  23          HG22      ILE  23  36.011  24.803  15.078
  190   HG23  ILE  23          HG23      ILE  23  35.357  23.334  15.799
  191   HD11  ILE  23          HD11      ILE  23  32.818  22.019  12.743
  192   HD12  ILE  23          HD12      ILE  23  33.858  22.981  11.694
  193   HD13  ILE  23          HD13      ILE  23  33.379  23.603  13.274
  194    H    GLU  24           HN       GLU  24  38.634  23.422  12.805
  195    HA   GLU  24           HA       GLU  24  39.745  25.492  14.287
  196    HB2  GLU  24           HB2      GLU  24  41.894  24.989  13.118
  197    HB3  GLU  24           HB1      GLU  24  41.050  23.532  13.643
  198    HG2  GLU  24           HG2      GLU  24  40.037  23.402  11.323
  199    HG3  GLU  24           HG1      GLU  24  41.139  24.695  10.849
  200    H    ASN  25           HN       ASN  25  39.115  25.454  10.794
  201    HA   ASN  25           HA       ASN  25  40.356  27.979  10.228
  202    HB2  ASN  25           HB2      ASN  25  39.738  26.374   8.451
  203    HB3  ASN  25           HB1      ASN  25  38.032  26.624   8.821
  204   HD21  ASN  25          HD21      ASN  25  37.089  28.054   7.366
  205   HD22  ASN  25          HD22      ASN  25  37.865  29.390   6.665
  206    H    VAL  26           HN       VAL  26  37.042  27.068  11.137
  207    HA   VAL  26           HA       VAL  26  35.898  29.678  10.955
  208    HB   VAL  26           HB       VAL  26  35.207  27.474  12.923
  209   HG11  VAL  26          HG11      VAL  26  32.933  28.533  12.750
  210   HG12  VAL  26          HG12      VAL  26  33.673  29.843  11.831
  211   HG13  VAL  26          HG13      VAL  26  34.147  29.565  13.507
  212   HG21  VAL  26          HG21      VAL  26  34.425  27.952  10.042
  213   HG22  VAL  26          HG22      VAL  26  33.447  26.964  11.127
  214   HG23  VAL  26          HG23      VAL  26  35.105  26.492  10.760
  215    H    LYS  27           HN       LYS  27  37.088  27.921  13.822
  216    HA   LYS  27           HA       LYS  27  36.938  29.895  15.755
  217    HB2  LYS  27           HB2      LYS  27  39.176  27.909  15.259
  218    HB3  LYS  27           HB1      LYS  27  39.023  28.861  16.737
  219    HG2  LYS  27           HG2      LYS  27  36.668  27.910  16.955
  220    HG3  LYS  27           HG1      LYS  27  37.101  26.789  15.667
  221    HD2  LYS  27           HD2      LYS  27  38.982  25.946  16.999
  222    HD3  LYS  27           HD1      LYS  27  38.603  27.094  18.283
  223    HE2  LYS  27           HE2      LYS  27  36.771  24.889  17.291
  224    HE3  LYS  27           HE1      LYS  27  37.680  24.867  18.802
  225    HZ1  LYS  27           HZ1      LYS  27  36.477  27.074  19.247
  226    HZ2  LYS  27           HZ2      LYS  27  35.610  25.626  19.441
  227    HZ3  LYS  27           HZ3      LYS  27  35.395  26.568  18.043
  228    H    ALA  28           HN       ALA  28  39.148  29.739  13.051
  229    HA   ALA  28           HA       ALA  28  41.010  31.734  13.966
  230    HB1  ALA  28           HB1      ALA  28  41.219  30.112  11.949
  231    HB2  ALA  28           HB2      ALA  28  41.850  31.747  11.751
  232    HB3  ALA  28           HB3      ALA  28  40.285  31.316  11.062
  233    H    LYS  29           HN       LYS  29  38.333  32.026  11.613
  234    HA   LYS  29           HA       LYS  29  38.351  34.831  11.371
  235    HB2  LYS  29           HB2      LYS  29  36.137  32.787  11.173
  236    HB3  LYS  29           HB1      LYS  29  35.794  34.504  10.960
  237    HG2  LYS  29           HG2      LYS  29  36.224  33.510   8.780
  238    HG3  LYS  29           HG1      LYS  29  37.556  34.592   9.186
  239    HD2  LYS  29           HD2      LYS  29  38.999  32.788   9.739
  240    HD3  LYS  29           HD1      LYS  29  37.664  31.637   9.812
  241    HE2  LYS  29           HE2      LYS  29  38.561  33.070   7.294
  242    HE3  LYS  29           HE1      LYS  29  39.008  31.417   7.719
  243    HZ1  LYS  29           HZ1      LYS  29  36.580  30.937   7.854
  244    HZ2  LYS  29           HZ2      LYS  29  37.138  31.307   6.292
  245    HZ3  LYS  29           HZ3      LYS  29  36.286  32.470   7.191
  246    H    ILE  30           HN       ILE  30  37.130  32.838  13.965
  247    HA   ILE  30           HA       ILE  30  35.666  35.026  15.250
  248    HB   ILE  30           HB       ILE  30  36.635  32.428  16.484
  249   HG12  ILE  30          HG12      ILE  30  35.332  31.848  14.530
  250   HG13  ILE  30          HG11      ILE  30  34.307  31.615  15.942
  251   HG21  ILE  30          HG21      ILE  30  34.310  34.250  17.173
  252   HG22  ILE  30          HG22      ILE  30  35.847  34.216  18.037
  253   HG23  ILE  30          HG23      ILE  30  34.793  32.800  18.052
  254   HD11  ILE  30          HD11      ILE  30  34.205  33.810  13.882
  255   HD12  ILE  30          HD12      ILE  30  33.521  34.064  15.487
  256   HD13  ILE  30          HD13      ILE  30  32.901  32.773  14.458
  257    H    GLN  31           HN       GLN  31  38.451  33.130  16.378
  258    HA   GLN  31           HA       GLN  31  39.388  34.726  18.401
  259    HB2  GLN  31           HB2      GLN  31  40.439  32.617  17.809
  260    HB3  GLN  31           HB1      GLN  31  41.016  33.291  16.289
  261    HG2  GLN  31           HG2      GLN  31  42.491  34.786  17.398
  262    HG3  GLN  31           HG1      GLN  31  41.763  34.466  18.970
  263   HE21  GLN  31          HE21      GLN  31  42.020  31.621  17.073
  264   HE22  GLN  31          HE22      GLN  31  43.427  30.993  17.788
  265    H    ASP  32           HN       ASP  32  40.195  35.171  14.954
  266    HA   ASP  32           HA       ASP  32  41.822  37.523  15.447
  267    HB2  ASP  32           HB2      ASP  32  40.472  36.633  12.881
  268    HB3  ASP  32           HB1      ASP  32  41.766  37.825  13.008
  269    H    LYS  33           HN       LYS  33  38.599  37.228  13.960
  270    HA   LYS  33           HA       LYS  33  38.077  39.990  13.775
  271    HB2  LYS  33           HB2      LYS  33  36.086  37.784  14.245
  272    HB3  LYS  33           HB1      LYS  33  35.689  39.391  13.670
  273    HG2  LYS  33           HG2      LYS  33  37.724  37.721  12.197
  274    HG3  LYS  33           HG1      LYS  33  36.007  37.445  11.927
  275    HD2  LYS  33           HD2      LYS  33  37.124  40.234  11.753
  276    HD3  LYS  33           HD1      LYS  33  37.293  39.139  10.391
  277    HE2  LYS  33           HE2      LYS  33  34.807  38.778  10.446
  278    HE3  LYS  33           HE1      LYS  33  34.695  40.023  11.688
  279    HZ1  LYS  33           HZ1      LYS  33  35.266  41.666  10.234
  280    HZ2  LYS  33           HZ2      LYS  33  34.432  40.622   9.184
  281    HZ3  LYS  33           HZ3      LYS  33  36.130  40.630   9.207
  282    H    GLU  34           HN       GLU  34  37.401  37.811  16.513
  283    HA   GLU  34           HA       GLU  34  36.354  40.108  18.072
  284    HB2  GLU  34           HB2      GLU  34  36.788  37.305  19.119
  285    HB3  GLU  34           HB1      GLU  34  35.639  38.521  19.672
  286    HG2  GLU  34           HG2      GLU  34  34.438  38.354  17.509
  287    HG3  GLU  34           HG1      GLU  34  35.558  37.090  17.001
  288    H    GLY  35           HN       GLY  35  39.261  38.245  17.699
  289    HA2  GLY  35           HA3      GLY  35  41.411  38.615  18.629
  290    HA3  GLY  35           HA2      GLY  35  40.779  40.104  19.329
  291    H    ILE  36           HN       ILE  36  38.944  37.318  20.008
  292    HA   ILE  36           HA       ILE  36  39.809  37.380  22.834
  293    HB   ILE  36           HB       ILE  36  37.438  36.047  21.536
  294   HG12  ILE  36          HG12      ILE  36  37.723  38.738  22.908
  295   HG13  ILE  36          HG11      ILE  36  37.427  38.484  21.189
  296   HG21  ILE  36          HG21      ILE  36  36.578  35.942  23.805
  297   HG22  ILE  36          HG22      ILE  36  37.976  36.825  24.413
  298   HG23  ILE  36          HG23      ILE  36  38.171  35.193  23.780
  299   HD11  ILE  36          HD11      ILE  36  35.602  37.727  23.472
  300   HD12  ILE  36          HD12      ILE  36  35.336  37.257  21.793
  301   HD13  ILE  36          HD13      ILE  36  35.314  38.960  22.246
  302    HA   PRO  37           HA       PRO  37  42.266  33.648  21.686
  303    HB2  PRO  37           HB2      PRO  37  42.272  33.540  24.693
  304    HB3  PRO  37           HB1      PRO  37  43.608  33.261  23.555
  305    HG2  PRO  37           HG2      PRO  37  43.422  35.555  24.856
  306    HG3  PRO  37           HG1      PRO  37  43.909  35.524  23.151
  307    HD2  PRO  37           HD2      PRO  37  41.293  36.363  24.343
  308    HD3  PRO  37           HD1      PRO  37  42.115  36.967  22.886
  309    HA   PRO  38           HA       PRO  38  38.625  30.887  21.779
  310    HB2  PRO  38           HB2      PRO  38  40.917  28.970  21.580
  311    HB3  PRO  38           HB1      PRO  38  39.335  28.906  20.773
  312    HG2  PRO  38           HG2      PRO  38  41.399  29.815  19.463
  313    HG3  PRO  38           HG1      PRO  38  39.858  30.665  19.342
  314    HD2  PRO  38           HD2      PRO  38  42.340  31.467  20.815
  315    HD3  PRO  38           HD1      PRO  38  41.098  32.490  20.051
  316    H    ASP  39           HN       ASP  39  41.502  30.312  23.756
  317    HA   ASP  39           HA       ASP  39  40.601  28.365  25.526
  318    HB2  ASP  39           HB2      ASP  39  42.872  29.349  25.595
  319    HB3  ASP  39           HB1      ASP  39  42.195  30.831  26.270
  320    H    GLN  40           HN       GLN  40  39.927  31.844  25.682
  321    HA   GLN  40           HA       GLN  40  38.271  31.521  28.084
  322    HB2  GLN  40           HB2      GLN  40  38.712  33.911  26.270
  323    HB3  GLN  40           HB1      GLN  40  37.899  33.943  27.832
  324    HG2  GLN  40           HG2      GLN  40  39.983  33.074  28.895
  325    HG3  GLN  40           HG1      GLN  40  40.788  33.190  27.329
  326   HE21  GLN  40          HE21      GLN  40  42.033  35.058  27.242
  327   HE22  GLN  40          HE22      GLN  40  41.592  36.558  27.901
  328    H    GLN  41           HN       GLN  41  37.728  30.674  24.997
  329    HA   GLN  41           HA       GLN  41  34.798  31.333  25.158
  330    HB2  GLN  41           HB2      GLN  41  36.491  31.256  22.649
  331    HB3  GLN  41           HB1      GLN  41  34.761  31.578  22.722
  332    HG2  GLN  41           HG2      GLN  41  35.161  33.589  24.056
  333    HG3  GLN  41           HG1      GLN  41  36.893  33.252  24.079
  334   HE21  GLN  41          HE21      GLN  41  34.616  35.105  22.484
  335   HE22  GLN  41          HE22      GLN  41  35.425  35.318  21.006
  336    H    ARG  42           HN       ARG  42  33.394  29.711  24.576
  337    HA   ARG  42           HA       ARG  42  34.519  27.130  23.580
  338    HB2  ARG  42           HB2      ARG  42  32.712  27.597  25.962
  339    HB3  ARG  42           HB1      ARG  42  32.755  26.046  25.126
  340    HG2  ARG  42           HG2      ARG  42  35.225  27.424  26.213
  341    HG3  ARG  42           HG1      ARG  42  34.310  26.231  27.129
  342    HD2  ARG  42           HD2      ARG  42  35.837  24.795  26.161
  343    HD3  ARG  42           HD1      ARG  42  34.683  24.827  24.830
  344    HE   ARG  42           HE       ARG  42  36.490  26.990  24.468
  345   HH11  ARG  42          HH11      ARG  42  38.201  26.747  23.009
  346   HH12  ARG  42          HH12      ARG  42  38.723  25.156  22.564
  347   HH21  ARG  42          HH21      ARG  42  36.384  23.547  24.556
  348   HH22  ARG  42          HH22      ARG  42  37.693  23.345  23.440
  349    H    LEU  43           HN       LEU  43  33.270  26.403  21.833
  350    HA   LEU  43           HA       LEU  43  30.938  28.058  21.119
  351    HB2  LEU  43           HB2      LEU  43  32.025  25.686  19.605
  352    HB3  LEU  43           HB1      LEU  43  31.037  27.020  18.985
  353    HG   LEU  43           HG       LEU  43  33.938  27.081  19.863
  354   HD11  LEU  43          HD11      LEU  43  33.431  26.451  17.540
  355   HD12  LEU  43          HD12      LEU  43  34.206  28.035  17.599
  356   HD13  LEU  43          HD13      LEU  43  32.462  27.911  17.357
  357   HD21  LEU  43          HD21      LEU  43  33.042  29.061  20.857
  358   HD22  LEU  43          HD22      LEU  43  31.969  29.337  19.488
  359   HD23  LEU  43          HD23      LEU  43  33.705  29.590  19.308
  360    H    ILE  44           HN       ILE  44  28.839  27.343  21.001
  361    HA   ILE  44           HA       ILE  44  28.245  24.568  21.980
  362    HB   ILE  44           HB       ILE  44  26.707  27.126  22.540
  363   HG12  ILE  44          HG12      ILE  44  28.760  27.037  23.863
  364   HG13  ILE  44          HG11      ILE  44  27.378  26.716  24.906
  365   HG21  ILE  44          HG21      ILE  44  25.416  25.579  24.095
  366   HG22  ILE  44          HG22      ILE  44  26.257  24.228  23.336
  367   HG23  ILE  44          HG23      ILE  44  25.181  25.246  22.377
  368   HD11  ILE  44          HD11      ILE  44  28.773  25.007  25.586
  369   HD12  ILE  44          HD12      ILE  44  29.551  24.868  24.014
  370   HD13  ILE  44          HD13      ILE  44  27.954  24.173  24.268
  371    H    PHE  45           HN       PHE  45  26.933  23.437  20.591
  372    HA   PHE  45           HA       PHE  45  25.085  24.887  18.799
  373    HB2  PHE  45           HB2      PHE  45  27.062  24.825  17.425
  374    HB3  PHE  45           HB1      PHE  45  27.387  23.148  17.861
  375    HD1  PHE  45           HD1      PHE  45  25.267  25.398  15.857
  376    HD2  PHE  45           HD2      PHE  45  26.101  21.321  16.906
  377    HE1  PHE  45           HE1      PHE  45  23.887  24.626  13.943
  378    HE2  PHE  45           HE2      PHE  45  24.722  20.545  14.992
  379    HZ   PHE  45           HZ       PHE  45  23.615  22.198  13.512
  380    H    ALA  46           HN       ALA  46  23.217  23.833  19.261
  381    HA   ALA  46           HA       ALA  46  21.690  22.091  19.591
  382    HB1  ALA  46           HB1      ALA  46  23.701  20.268  18.266
  383    HB2  ALA  46           HB2      ALA  46  22.779  21.454  17.342
  384    HB3  ALA  46           HB3      ALA  46  21.941  20.177  18.222
  385    H    GLY  47           HN       GLY  47  23.836  22.572  21.630
  386    HA2  GLY  47           HA3      GLY  47  24.181  21.575  23.750
  387    HA3  GLY  47           HA2      GLY  47  23.358  20.129  23.171
  388    H    LYS  48           HN       LYS  48  25.660  21.004  20.918
  389    HA   LYS  48           HA       LYS  48  27.763  19.256  22.155
  390    HB2  LYS  48           HB2      LYS  48  26.892  19.339  19.273
  391    HB3  LYS  48           HB1      LYS  48  28.212  18.366  19.907
  392    HG2  LYS  48           HG2      LYS  48  26.623  17.181  21.384
  393    HG3  LYS  48           HG1      LYS  48  25.299  18.145  20.727
  394    HD2  LYS  48           HD2      LYS  48  25.818  17.258  18.459
  395    HD3  LYS  48           HD1      LYS  48  27.067  16.235  19.170
  396    HE2  LYS  48           HE2      LYS  48  24.125  16.158  19.903
  397    HE3  LYS  48           HE1      LYS  48  24.942  14.995  18.858
  398    HZ1  LYS  48           HZ1      LYS  48  25.452  13.883  20.691
  399    HZ2  LYS  48           HZ2      LYS  48  24.884  15.130  21.696
  400    HZ3  LYS  48           HZ3      LYS  48  26.485  15.156  21.128
  401    H    GLN  49           HN       GLN  49  29.940  19.886  21.680
  402    HA   GLN  49           HA       GLN  49  30.204  22.672  20.737
  403    HB2  GLN  49           HB2      GLN  49  32.321  20.979  22.002
  404    HB3  GLN  49           HB1      GLN  49  32.280  22.732  21.879
  405    HG2  GLN  49           HG2      GLN  49  30.244  22.738  23.326
  406    HG3  GLN  49           HG1      GLN  49  30.419  20.994  23.525
  407   HE21  GLN  49          HE21      GLN  49  31.657  20.361  25.295
  408   HE22  GLN  49          HE22      GLN  49  32.797  21.341  26.087
  409    H    LEU  50           HN       LEU  50  32.164  23.128  19.328
  410    HA   LEU  50           HA       LEU  50  32.444  20.963  17.283
  411    HB2  LEU  50           HB2      LEU  50  33.291  23.855  17.021
  412    HB3  LEU  50           HB1      LEU  50  33.013  22.685  15.732
  413    HG   LEU  50           HG       LEU  50  30.898  23.796  17.602
  414   HD11  LEU  50          HD11      LEU  50  31.557  25.464  15.983
  415   HD12  LEU  50          HD12      LEU  50  30.025  24.779  15.447
  416   HD13  LEU  50          HD13      LEU  50  31.531  24.281  14.677
  417   HD21  LEU  50          HD21      LEU  50  30.209  21.593  17.047
  418   HD22  LEU  50          HD22      LEU  50  30.846  21.716  15.406
  419   HD23  LEU  50          HD23      LEU  50  29.394  22.608  15.859
  420    H    GLU  51           HN       GLU  51  34.246  19.746  17.584
  421    HA   GLU  51           HA       GLU  51  36.624  20.930  18.910
  422    HB2  GLU  51           HB2      GLU  51  36.083  18.085  18.005
  423    HB3  GLU  51           HB1      GLU  51  37.448  18.617  18.987
  424    HG2  GLU  51           HG2      GLU  51  34.543  18.946  19.789
  425    HG3  GLU  51           HG1      GLU  51  35.584  17.632  20.343
  426    H    ASP  52           HN       ASP  52  38.741  20.751  17.904
  427    HA   ASP  52           HA       ASP  52  38.712  21.404  15.086
  428    HB2  ASP  52           HB2      ASP  52  41.155  21.498  15.303
  429    HB3  ASP  52           HB1      ASP  52  40.395  22.318  16.668
  430    H    GLY  53           HN       GLY  53  39.799  20.162  13.391
  431    HA2  GLY  53           HA3      GLY  53  40.560  18.159  12.361
  432    HA3  GLY  53           HA2      GLY  53  40.444  17.343  13.921
  433    H    ARG  54           HN       ARG  54  37.950  19.164  12.151
  434    HA   ARG  54           HA       ARG  54  36.528  16.727  11.398
  435    HB2  ARG  54           HB2      ARG  54  36.017  16.945  13.842
  436    HB3  ARG  54           HB1      ARG  54  35.286  18.516  13.508
  437    HG2  ARG  54           HG2      ARG  54  33.539  17.565  12.226
  438    HG3  ARG  54           HG1      ARG  54  34.394  16.036  12.033
  439    HD2  ARG  54           HD2      ARG  54  32.473  16.072  13.738
  440    HD3  ARG  54           HD1      ARG  54  34.012  15.408  14.288
  441    HE   ARG  54           HE       ARG  54  33.680  18.273  14.820
  442   HH11  ARG  54          HH11      ARG  54  33.617  18.826  17.009
  443   HH12  ARG  54          HH12      ARG  54  33.401  17.586  18.198
  444   HH21  ARG  54          HH21      ARG  54  33.231  15.020  15.873
  445   HH22  ARG  54          HH22      ARG  54  33.182  15.431  17.556
  446    H    THR  55           HN       THR  55  34.746  17.164  10.013
  447    HA   THR  55           HA       THR  55  34.556  20.007   9.052
  448    HB   THR  55           HB       THR  55  34.189  17.429   7.490
  449    HG1  THR  55           HG1      THR  55  36.312  17.642   7.693
  450   HG21  THR  55          HG21      THR  55  33.940  20.349   6.786
  451   HG22  THR  55          HG22      THR  55  32.817  19.034   6.445
  452   HG23  THR  55          HG23      THR  55  34.335  19.148   5.558
  453    H    LEU  56           HN       LEU  56  32.358  20.423   7.965
  454    HA   LEU  56           HA       LEU  56  30.257  19.838   9.824
  455    HB2  LEU  56           HB2      LEU  56  30.296  20.981   7.029
  456    HB3  LEU  56           HB1      LEU  56  28.775  20.687   7.868
  457    HG   LEU  56           HG       LEU  56  29.643  22.076   9.785
  458   HD11  LEU  56          HD11      LEU  56  32.004  21.992   9.503
  459   HD12  LEU  56          HD12      LEU  56  31.558  23.649   9.100
  460   HD13  LEU  56          HD13      LEU  56  31.900  22.492   7.816
  461   HD21  LEU  56          HD21      LEU  56  29.661  23.604   7.173
  462   HD22  LEU  56          HD22      LEU  56  29.109  24.164   8.749
  463   HD23  LEU  56          HD23      LEU  56  28.185  22.945   7.875
  464    H    SER  57           HN       SER  57  31.154  18.405   6.699
  465    HA   SER  57           HA       SER  57  28.904  16.639   6.477
  466    HB2  SER  57           HB2      SER  57  31.765  16.307   5.513
  467    HB3  SER  57           HB1      SER  57  30.429  15.261   5.040
  468    HG   SER  57           HG       SER  57  31.126  17.680   4.092
  469    H    ASP  58           HN       ASP  58  32.139  16.205   7.862
  470    HA   ASP  58           HA       ASP  58  31.860  13.568   8.834
  471    HB2  ASP  58           HB2      ASP  58  33.370  15.950   9.930
  472    HB3  ASP  58           HB1      ASP  58  33.471  14.354  10.673
  473    H    TYR  59           HN       TYR  59  30.583  16.600  10.073
  474    HA   TYR  59           HA       TYR  59  29.721  15.492  12.622
  475    HB2  TYR  59           HB2      TYR  59  29.657  18.078  11.253
  476    HB3  TYR  59           HB1      TYR  59  28.102  17.755  12.011
  477    HD1  TYR  59           HD1      TYR  59  31.435  18.919  12.551
  478    HD2  TYR  59           HD2      TYR  59  28.160  16.918  14.483
  479    HE1  TYR  59           HE1      TYR  59  32.370  19.525  14.768
  480    HE2  TYR  59           HE2      TYR  59  29.095  17.524  16.696
  481    HH   TYR  59           HH       TYR  59  31.325  18.111  17.652
  482    H    ASN  60           HN       ASN  60  28.599  15.322   9.405
  483    HA   ASN  60           HA       ASN  60  26.765  14.210   8.479
  484    HB2  ASN  60           HB2      ASN  60  27.234  12.690  10.571
  485    HB3  ASN  60           HB1      ASN  60  25.791  13.455  11.234
  486   HD21  ASN  60          HD21      ASN  60  24.399  11.606  11.063
  487   HD22  ASN  60          HD22      ASN  60  23.944  10.941   9.569
  488    H    ILE  61           HN       ILE  61  26.344  16.747   8.405
  489    HA   ILE  61           HA       ILE  61  24.019  17.583  10.002
  490    HB   ILE  61           HB       ILE  61  25.550  19.337   9.616
  491   HG12  ILE  61          HG12      ILE  61  24.403  20.951   8.208
  492   HG13  ILE  61          HG11      ILE  61  23.554  19.665   7.357
  493   HG21  ILE  61          HG21      ILE  61  26.987  18.379   7.979
  494   HG22  ILE  61          HG22      ILE  61  26.354  19.853   7.250
  495   HG23  ILE  61          HG23      ILE  61  25.694  18.287   6.786
  496   HD11  ILE  61          HD11      ILE  61  22.209  19.155   9.233
  497   HD12  ILE  61          HD12      ILE  61  22.292  20.913   9.253
  498   HD13  ILE  61          HD13      ILE  61  23.301  19.973  10.350
  499    H    GLN  62           HN       GLN  62  22.020  16.920   9.383
  500    HA   GLN  62           HA       GLN  62  21.560  16.022   6.601
  501    HB2  GLN  62           HB2      GLN  62  19.771  15.978   9.050
  502    HB3  GLN  62           HB1      GLN  62  19.372  15.258   7.489
  503    HG2  GLN  62           HG2      GLN  62  21.352  13.796   7.654
  504    HG3  GLN  62           HG1      GLN  62  21.752  14.511   9.215
  505   HE21  GLN  62          HE21      GLN  62  21.094  13.173  10.895
  506   HE22  GLN  62          HE22      GLN  62  19.685  12.226  10.897
  507    H    LYS  63           HN       LYS  63  20.415  18.564   8.822
  508    HA   LYS  63           HA       LYS  63  18.398  19.566   7.018
  509    HB2  LYS  63           HB2      LYS  63  19.855  20.862   9.336
  510    HB3  LYS  63           HB1      LYS  63  18.513  21.617   8.477
  511    HG2  LYS  63           HG2      LYS  63  17.066  19.700   9.044
  512    HG3  LYS  63           HG1      LYS  63  18.407  18.946   9.908
  513    HD2  LYS  63           HD2      LYS  63  18.503  20.849  11.457
  514    HD3  LYS  63           HD1      LYS  63  17.197  21.644  10.580
  515    HE2  LYS  63           HE2      LYS  63  16.300  20.510  12.559
  516    HE3  LYS  63           HE1      LYS  63  15.709  19.723  11.097
  517    HZ1  LYS  63           HZ1      LYS  63  18.138  18.539  11.776
  518    HZ2  LYS  63           HZ2      LYS  63  16.590  17.842  11.810
  519    HZ3  LYS  63           HZ3      LYS  63  17.208  18.612  13.193
  520    H    GLU  64           HN       GLU  64  21.836  20.212   7.417
  521    HA   GLU  64           HA       GLU  64  23.269  21.699   6.258
  522    HB2  GLU  64           HB2      GLU  64  21.442  20.699   4.054
  523    HB3  GLU  64           HB1      GLU  64  22.973  21.532   3.780
  524    HG2  GLU  64           HG2      GLU  64  24.166  19.771   5.019
  525    HG3  GLU  64           HG1      GLU  64  22.639  18.939   5.320
  526    H    SEP  65           HN       SEP  65  20.530  22.776   7.235
  527    HA   SEP  65           HA       SEP  65  19.968  24.917   5.302
  528    HB2  SEP  65           HB1      SEP  65  18.229  23.799   6.793
  529    HB3  SEP  65           HB2      SEP  65  18.210  25.560   6.795
  530    H    TPO  66           HN       TPO  66  19.656  27.185   6.684
  531    HA   TPO  66           HA       TPO  66  22.207  28.303   6.957
  532    HB   TPO  66           HB       TPO  66  21.126  30.129   8.206
  533   HG21  TPO  66          HG21      TPO  66  19.578  28.910   5.916
  534   HG22  TPO  66          HG22      TPO  66  20.746  30.231   5.860
  535   HG23  TPO  66          HG23      TPO  66  19.162  30.483   6.596
  536    H    LEU  67           HN       LEU  67  23.740  27.334   8.240
  537    HA   LEU  67           HA       LEU  67  23.044  26.224  10.860
  538    HB2  LEU  67           HB2      LEU  67  25.813  26.693   9.725
  539    HB3  LEU  67           HB1      LEU  67  25.347  25.548  10.983
  540    HG   LEU  67           HG       LEU  67  24.410  25.447   8.099
  541   HD11  LEU  67          HD11      LEU  67  25.906  23.573   7.841
  542   HD12  LEU  67          HD12      LEU  67  26.308  23.588   9.558
  543   HD13  LEU  67          HD13      LEU  67  26.847  24.903   8.515
  544   HD21  LEU  67          HD21      LEU  67  22.711  24.438   9.405
  545   HD22  LEU  67          HD22      LEU  67  23.868  23.756  10.547
  546   HD23  LEU  67          HD23      LEU  67  23.724  23.078   8.926
  547    H    HIS  68           HN       HIS  68  23.457  27.148  12.836
  548    HA   HIS  68           HA       HIS  68  24.676  29.896  12.875
  549    HB2  HIS  68           HB2      HIS  68  23.067  30.463  14.667
  550    HB3  HIS  68           HB1      HIS  68  22.230  30.030  13.176
  551    HD1  HIS  68           HD1      HIS  68  23.123  28.611  16.573
  552    HD2  HIS  68           HD2      HIS  68  20.609  27.743  13.359
  553    HE1  HIS  68           HE1      HIS  68  21.615  26.720  17.331
  554    HE2  HIS  68           HE2      HIS  68  20.082  26.185  15.383
  555    H    LEU  69           HN       LEU  69  26.274  30.147  14.376
  556    HA   LEU  69           HA       LEU  69  26.696  27.944  16.380
  557    HB2  LEU  69           HB2      LEU  69  28.579  29.521  14.643
  558    HB3  LEU  69           HB1      LEU  69  29.150  29.009  16.230
  559    HG   LEU  69           HG       LEU  69  28.668  26.677  15.696
  560   HD11  LEU  69          HD11      LEU  69  28.050  26.243  13.189
  561   HD12  LEU  69          HD12      LEU  69  27.436  27.896  13.227
  562   HD13  LEU  69          HD13      LEU  69  26.770  26.679  14.317
  563   HD21  LEU  69          HD21      LEU  69  30.201  28.154  13.533
  564   HD22  LEU  69          HD22      LEU  69  30.268  26.408  13.772
  565   HD23  LEU  69          HD23      LEU  69  30.857  27.495  15.030
  566    H    VAL  70           HN       VAL  70  26.539  28.601  18.476
  567    HA   VAL  70           HA       VAL  70  26.485  31.548  19.029
  568    HB   VAL  70           HB       VAL  70  25.507  29.203  20.686
  569   HG11  VAL  70          HG11      VAL  70  24.376  31.066  21.979
  570   HG12  VAL  70          HG12      VAL  70  25.386  32.202  21.084
  571   HG13  VAL  70          HG13      VAL  70  26.130  31.010  22.148
  572   HG21  VAL  70          HG21      VAL  70  23.259  30.278  20.118
  573   HG22  VAL  70          HG22      VAL  70  24.070  29.459  18.785
  574   HG23  VAL  70          HG23      VAL  70  24.121  31.219  18.900
  575    H    LEU  71           HN       LEU  71  28.295  32.398  19.940
  576    HA   LEU  71           HA       LEU  71  30.372  30.647  21.008
  577    HB2  LEU  71           HB2      LEU  71  30.386  33.647  21.320
  578    HB3  LEU  71           HB1      LEU  71  31.741  32.547  21.065
  579    HG   LEU  71           HG       LEU  71  29.622  33.258  19.015
  580   HD11  LEU  71          HD11      LEU  71  32.516  34.037  19.425
  581   HD12  LEU  71          HD12      LEU  71  31.115  35.105  19.352
  582   HD13  LEU  71          HD13      LEU  71  31.669  34.277  17.895
  583   HD21  LEU  71          HD21      LEU  71  30.460  30.958  18.714
  584   HD22  LEU  71          HD22      LEU  71  32.122  31.545  18.817
  585   HD23  LEU  71          HD23      LEU  71  31.104  32.010  17.456
  586    H    ARG  72           HN       ARG  72  31.147  30.684  23.174
  587    HA   ARG  72           HA       ARG  72  29.379  31.961  25.211
  588    HB2  ARG  72           HB2      ARG  72  28.847  29.451  24.735
  589    HB3  ARG  72           HB1      ARG  72  30.381  29.125  25.529
  590    HG2  ARG  72           HG2      ARG  72  29.002  29.039  27.388
  591    HG3  ARG  72           HG1      ARG  72  29.354  30.764  27.396
  592    HD2  ARG  72           HD2      ARG  72  26.934  29.545  26.025
  593    HD3  ARG  72           HD1      ARG  72  26.910  30.205  27.658
  594    HE   ARG  72           HE       ARG  72  27.920  32.299  26.217
  595   HH11  ARG  72          HH11      ARG  72  26.656  33.837  25.148
  596   HH12  ARG  72          HH12      ARG  72  25.065  33.411  24.612
  597   HH21  ARG  72          HH21      ARG  72  25.247  30.160  25.804
  598   HH22  ARG  72          HH22      ARG  72  24.268  31.329  24.983
  599    H    LEU  73           HN       LEU  73  30.535  32.478  27.161
  600    HA   LEU  73           HA       LEU  73  33.518  32.198  26.945
  601    HB2  LEU  73           HB2      LEU  73  33.685  34.258  28.208
  602    HB3  LEU  73           HB1      LEU  73  32.608  34.526  26.842
  603    HG   LEU  73           HG       LEU  73  30.805  33.700  28.774
  604   HD11  LEU  73          HD11      LEU  73  32.684  35.552  30.251
  605   HD12  LEU  73          HD12      LEU  73  32.799  33.804  30.419
  606   HD13  LEU  73          HD13      LEU  73  31.318  34.636  30.888
  607   HD21  LEU  73          HD21      LEU  73  30.170  36.059  28.952
  608   HD22  LEU  73          HD22      LEU  73  30.624  35.691  27.290
  609   HD23  LEU  73          HD23      LEU  73  31.747  36.555  28.338
  610    H    ARG  74           HN       ARG  74  34.619  31.382  28.731
  611    HA   ARG  74           HA       ARG  74  33.075  29.805  30.611
  612    HB2  ARG  74           HB2      ARG  74  36.000  30.426  30.238
  613    HB3  ARG  74           HB1      ARG  74  35.466  29.613  31.708
  614    HG2  ARG  74           HG2      ARG  74  34.539  28.558  29.040
  615    HG3  ARG  74           HG1      ARG  74  36.175  28.194  29.582
  616    HD2  ARG  74           HD2      ARG  74  35.401  27.066  31.525
  617    HD3  ARG  74           HD1      ARG  74  33.772  27.717  31.356
  618    HE   ARG  74           HE       ARG  74  34.883  25.428  29.886
  619   HH11  ARG  74          HH11      ARG  74  33.389  24.318  28.606
  620   HH12  ARG  74          HH12      ARG  74  31.846  25.034  28.277
  621   HH21  ARG  74          HH21      ARG  74  32.491  27.907  30.108
  622   HH22  ARG  74          HH22      ARG  74  31.340  27.064  29.128
  623    H    GLY  75           HN       GLY  75  35.079  32.749  30.932
  624    HA2  GLY  75           HA3      GLY  75  34.908  34.498  32.491
  625    HA3  GLY  75           HA2      GLY  75  33.327  33.857  32.939
  626    H    GLY  76           HN       GLY  76  35.860  31.562  33.075
  627    HA2  GLY  76           HA3      GLY  76  37.055  32.020  35.573
  628    HA3  GLY  76           HA2      GLY  76  35.537  31.191  35.913
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1  27.644  26.781   1.387
    2    H2   MET   1           HT2      MET   1  28.454  27.017   2.861
    3    H3   MET   1           HT3      MET   1  28.554  28.190   1.636
    4    HA   MET   1           HA       MET   1  26.158  28.597   1.838
    5    HB2  MET   1           HB2      MET   1  26.490  26.593   4.086
    6    HB3  MET   1           HB1      MET   1  25.095  27.662   3.938
    7    HG2  MET   1           HG2      MET   1  24.509  26.711   1.793
    8    HG3  MET   1           HG1      MET   1  26.000  25.773   1.751
    9    HE1  MET   1           HE1      MET   1  22.264  25.170   4.286
   10    HE2  MET   1           HE2      MET   1  22.757  26.568   3.336
   11    HE3  MET   1           HE3      MET   1  23.464  26.299   4.928
   12    H    GLN   2           HN       GLN   2  25.592  30.392   3.159
   13    HA   GLN   2           HA       GLN   2  27.850  31.583   4.599
   14    HB2  GLN   2           HB2      GLN   2  26.314  32.912   3.127
   15    HB3  GLN   2           HB1      GLN   2  25.021  32.625   4.293
   16    HG2  GLN   2           HG2      GLN   2  26.310  33.741   6.047
   17    HG3  GLN   2           HG1      GLN   2  27.662  33.969   4.936
   18   HE21  GLN   2          HE21      GLN   2  25.523  35.861   6.332
   19   HE22  GLN   2          HE22      GLN   2  25.072  36.890   5.058
   20    H    ILE   3           HN       ILE   3  28.123  30.344   6.502
   21    HA   ILE   3           HA       ILE   3  25.866  29.699   8.219
   22    HB   ILE   3           HB       ILE   3  27.615  28.979   9.828
   23   HG12  ILE   3          HG12      ILE   3  29.486  30.165   7.752
   24   HG13  ILE   3          HG11      ILE   3  29.275  30.724   9.411
   25   HG21  ILE   3          HG21      ILE   3  28.424  27.157   8.525
   26   HG22  ILE   3          HG22      ILE   3  28.390  28.105   7.039
   27   HG23  ILE   3          HG23      ILE   3  26.881  27.598   7.797
   28   HD11  ILE   3          HD11      ILE   3  31.239  29.369   9.435
   29   HD12  ILE   3          HD12      ILE   3  30.462  28.106   8.480
   30   HD13  ILE   3          HD13      ILE   3  29.966  28.381  10.149
   31    H    PHE   4           HN       PHE   4  25.096  30.861   9.975
   32    HA   PHE   4           HA       PHE   4  26.171  33.618  10.299
   33    HB2  PHE   4           HB2      PHE   4  23.629  32.300  11.302
   34    HB3  PHE   4           HB1      PHE   4  24.068  33.983  11.588
   35    HD1  PHE   4           HD1      PHE   4  22.915  31.538   9.113
   36    HD2  PHE   4           HD2      PHE   4  24.168  35.601   9.728
   37    HE1  PHE   4           HE1      PHE   4  21.985  32.159   6.900
   38    HE2  PHE   4           HE2      PHE   4  23.235  36.222   7.515
   39    HZ   PHE   4           HZ       PHE   4  22.145  34.502   6.101
   40    H    VAL   5           HN       VAL   5  26.389  34.462  12.522
   41    HA   VAL   5           HA       VAL   5  26.908  32.403  14.619
   42    HB   VAL   5           HB       VAL   5  28.859  34.587  13.812
   43   HG11  VAL   5          HG11      VAL   5  30.307  33.348  15.516
   44   HG12  VAL   5          HG12      VAL   5  28.827  32.552  16.050
   45   HG13  VAL   5          HG13      VAL   5  28.981  34.303  16.181
   46   HG21  VAL   5          HG21      VAL   5  30.337  32.593  13.328
   47   HG22  VAL   5          HG22      VAL   5  28.964  32.759  12.233
   48   HG23  VAL   5          HG23      VAL   5  28.916  31.568  13.532
   49    H    LYS   6           HN       LYS   6  26.464  33.181  16.712
   50    HA   LYS   6           HA       LYS   6  25.629  36.054  16.943
   51    HB2  LYS   6           HB2      LYS   6  23.646  34.542  16.786
   52    HB3  LYS   6           HB1      LYS   6  24.238  33.667  18.198
   53    HG2  LYS   6           HG2      LYS   6  24.109  35.708  19.551
   54    HG3  LYS   6           HG1      LYS   6  23.584  36.628  18.140
   55    HD2  LYS   6           HD2      LYS   6  21.564  35.238  17.965
   56    HD3  LYS   6           HD1      LYS   6  22.092  34.279  19.347
   57    HE2  LYS   6           HE2      LYS   6  20.466  35.966  20.073
   58    HE3  LYS   6           HE1      LYS   6  22.052  36.324  20.757
   59    HZ1  LYS   6           HZ1      LYS   6  20.677  38.180  19.599
   60    HZ2  LYS   6           HZ2      LYS   6  21.304  37.501  18.172
   61    HZ3  LYS   6           HZ3      LYS   6  22.355  38.099  19.365
   62    H    THR   7           HN       THR   7  26.923  37.003  18.429
   63    HA   THR   7           HA       THR   7  28.329  35.337  20.434
   64    HB   THR   7           HB       THR   7  29.646  37.307  20.878
   65    HG1  THR   7           HG1      THR   7  27.401  38.521  19.970
   66   HG21  THR   7          HG21      THR   7  30.442  37.878  18.594
   67   HG22  THR   7          HG22      THR   7  29.014  37.093  17.922
   68   HG23  THR   7          HG23      THR   7  30.209  36.141  18.801
   69    H    LEU   8           HN       LEU   8  28.429  36.370  22.720
   70    HA   LEU   8           HA       LEU   8  25.786  36.405  23.810
   71    HB2  LEU   8           HB2      LEU   8  27.770  35.727  25.117
   72    HB3  LEU   8           HB1      LEU   8  28.389  37.374  25.034
   73    HG   LEU   8           HG       LEU   8  26.412  38.188  26.270
   74   HD11  LEU   8          HD11      LEU   8  24.625  36.755  25.784
   75   HD12  LEU   8          HD12      LEU   8  25.055  36.230  27.408
   76   HD13  LEU   8          HD13      LEU   8  25.594  35.299  26.011
   77   HD21  LEU   8          HD21      LEU   8  26.908  36.921  28.438
   78   HD22  LEU   8          HD22      LEU   8  28.299  37.644  27.630
   79   HD23  LEU   8          HD23      LEU   8  27.996  35.913  27.484
   80    H    THR   9           HN       THR   9  27.993  38.968  22.808
   81    HA   THR   9           HA       THR   9  26.348  41.099  23.940
   82    HB   THR   9           HB       THR   9  27.875  42.598  22.687
   83    HG1  THR   9           HG1      THR   9  28.093  41.059  20.917
   84   HG21  THR   9          HG21      THR   9  28.666  41.931  24.835
   85   HG22  THR   9          HG22      THR   9  30.030  41.715  23.739
   86   HG23  THR   9          HG23      THR   9  29.087  40.318  24.259
   87    H    GLY  10           HN       GLY  10  25.969  39.084  21.295
   88    HA2  GLY  10           HA3      GLY  10  24.083  39.202  19.805
   89    HA3  GLY  10           HA2      GLY  10  23.969  40.935  20.111
   90    H    LYS  11           HN       LYS  11  27.092  40.803  19.700
   91    HA   LYS  11           HA       LYS  11  27.222  41.941  17.146
   92    HB2  LYS  11           HB2      LYS  11  29.284  40.262  18.597
   93    HB3  LYS  11           HB1      LYS  11  29.626  41.129  17.102
   94    HG2  LYS  11           HG2      LYS  11  28.983  43.253  18.170
   95    HG3  LYS  11           HG1      LYS  11  28.621  42.393  19.668
   96    HD2  LYS  11           HD2      LYS  11  30.951  41.678  19.862
   97    HD3  LYS  11           HD1      LYS  11  31.337  42.442  18.319
   98    HE2  LYS  11           HE2      LYS  11  32.002  43.907  20.173
   99    HE3  LYS  11           HE1      LYS  11  30.680  44.641  19.264
  100    HZ1  LYS  11           HZ1      LYS  11  29.450  44.659  21.086
  101    HZ2  LYS  11           HZ2      LYS  11  30.754  44.034  21.977
  102    HZ3  LYS  11           HZ3      LYS  11  29.620  42.983  21.272
  103    H    THR  12           HN       THR  12  26.427  41.068  15.297
  104    HA   THR  12           HA       THR  12  26.441  38.126  14.929
  105    HB   THR  12           HB       THR  12  25.259  40.340  13.227
  106    HG1  THR  12           HG1      THR  12  23.779  40.258  14.691
  107   HG21  THR  12          HG21      THR  12  25.640  38.465  11.808
  108   HG22  THR  12          HG22      THR  12  23.949  38.350  12.292
  109   HG23  THR  12          HG23      THR  12  25.158  37.324  13.064
  110    H    ILE  13           HN       ILE  13  27.527  37.095  13.238
  111    HA   ILE  13           HA       ILE  13  29.255  38.727  11.446
  112    HB   ILE  13           HB       ILE  13  30.316  36.364  13.028
  113   HG12  ILE  13          HG12      ILE  13  30.729  39.339  13.476
  114   HG13  ILE  13          HG11      ILE  13  29.864  38.242  14.552
  115   HG21  ILE  13          HG21      ILE  13  31.322  36.926  10.773
  116   HG22  ILE  13          HG22      ILE  13  32.454  37.014  12.122
  117   HG23  ILE  13          HG23      ILE  13  31.777  38.493  11.442
  118   HD11  ILE  13          HD11      ILE  13  32.059  38.445  15.471
  119   HD12  ILE  13          HD12      ILE  13  32.814  38.238  13.889
  120   HD13  ILE  13          HD13      ILE  13  32.017  36.873  14.671
  121    H    THR  14           HN       THR  14  29.403  37.788   9.404
  122    HA   THR  14           HA       THR  14  28.132  35.084   9.058
  123    HB   THR  14           HB       THR  14  26.698  36.606   7.967
  124    HG1  THR  14           HG1      THR  14  27.551  36.430   5.652
  125   HG21  THR  14          HG21      THR  14  27.569  38.442   6.512
  126   HG22  THR  14          HG22      THR  14  29.205  38.011   7.011
  127   HG23  THR  14          HG23      THR  14  28.051  38.613   8.200
  128    H    LEU  15           HN       LEU  15  29.424  33.557   8.171
  129    HA   LEU  15           HA       LEU  15  31.959  34.427   6.804
  130    HB2  LEU  15           HB2      LEU  15  31.495  31.879   8.387
  131    HB3  LEU  15           HB1      LEU  15  33.017  32.419   7.680
  132    HG   LEU  15           HG       LEU  15  31.479  33.835   9.880
  133   HD11  LEU  15          HD11      LEU  15  33.654  33.267  11.140
  134   HD12  LEU  15          HD12      LEU  15  33.972  32.126   9.834
  135   HD13  LEU  15          HD13      LEU  15  32.535  31.938  10.838
  136   HD21  LEU  15          HD21      LEU  15  33.783  35.117   9.928
  137   HD22  LEU  15          HD22      LEU  15  32.563  35.579   8.746
  138   HD23  LEU  15          HD23      LEU  15  33.916  34.564   8.258
  139    H    GLU  16           HN       GLU  16  31.777  34.013   4.663
  140    HA   GLU  16           HA       GLU  16  30.002  31.809   3.739
  141    HB2  GLU  16           HB2      GLU  16  29.780  34.072   2.716
  142    HB3  GLU  16           HB1      GLU  16  31.444  33.949   2.146
  143    HG2  GLU  16           HG2      GLU  16  30.880  31.975   0.818
  144    HG3  GLU  16           HG1      GLU  16  29.228  32.007   1.436
  145    H    VAL  17           HN       VAL  17  30.984  29.870   3.501
  146    HA   VAL  17           HA       VAL  17  33.402  29.650   1.887
  147    HB   VAL  17           HB       VAL  17  34.477  30.130   3.999
  148   HG11  VAL  17          HG11      VAL  17  34.017  28.650   5.985
  149   HG12  VAL  17          HG12      VAL  17  32.650  27.977   5.098
  150   HG13  VAL  17          HG13      VAL  17  32.662  29.686   5.534
  151   HG21  VAL  17          HG21      VAL  17  35.319  28.211   2.550
  152   HG22  VAL  17          HG22      VAL  17  34.522  27.120   3.683
  153   HG23  VAL  17          HG23      VAL  17  35.830  28.167   4.237
  154    H    GLU  18           HN       GLU  18  33.762  27.454   1.218
  155    HA   GLU  18           HA       GLU  18  31.569  25.881   0.681
  156    HB2  GLU  18           HB2      GLU  18  34.382  24.929   1.265
  157    HB3  GLU  18           HB1      GLU  18  33.145  23.964   0.460
  158    HG2  GLU  18           HG2      GLU  18  32.980  25.631  -1.334
  159    HG3  GLU  18           HG1      GLU  18  34.177  26.642  -0.521
  160    HA   PRO  19           HA       PRO  19  30.034  24.577   4.749
  161    HB2  PRO  19           HB2      PRO  19  29.396  22.118   3.129
  162    HB3  PRO  19           HB1      PRO  19  28.390  22.970   4.321
  163    HG2  PRO  19           HG2      PRO  19  28.001  23.307   1.709
  164    HG3  PRO  19           HG1      PRO  19  27.834  24.657   2.845
  165    HD2  PRO  19           HD2      PRO  19  29.987  24.150   0.849
  166    HD3  PRO  19           HD1      PRO  19  29.447  25.686   1.561
  167    H    SER  20           HN       SER  20  32.280  22.748   2.777
  168    HA   SER  20           HA       SER  20  32.908  20.787   4.831
  169    HB2  SER  20           HB2      SER  20  34.933  20.379   3.319
  170    HB3  SER  20           HB1      SER  20  33.350  20.119   2.591
  171    HG   SER  20           HG       SER  20  35.281  21.968   2.015
  172    H    ASP  21           HN       ASP  21  33.273  23.944   5.024
  173    HA   ASP  21           HA       ASP  21  35.990  24.522   5.497
  174    HB2  ASP  21           HB2      ASP  21  33.882  26.070   5.675
  175    HB3  ASP  21           HB1      ASP  21  33.854  25.560   7.361
  176    H    THR  22           HN       THR  22  37.091  24.677   7.696
  177    HA   THR  22           HA       THR  22  36.529  22.197   9.246
  178    HB   THR  22           HB       THR  22  38.774  22.609  10.223
  179    HG1  THR  22           HG1      THR  22  39.942  24.305   8.906
  180   HG21  THR  22          HG21      THR  22  38.583  21.248   8.199
  181   HG22  THR  22          HG22      THR  22  40.059  22.212   8.140
  182   HG23  THR  22          HG23      THR  22  38.650  22.698   7.197
  183    H    ILE  23           HN       ILE  23  36.832  22.443  11.694
  184    HA   ILE  23           HA       ILE  23  35.144  24.661  12.606
  185    HB   ILE  23           HB       ILE  23  36.656  22.670  14.313
  186   HG12  ILE  23          HG12      ILE  23  35.407  21.358  12.714
  187   HG13  ILE  23          HG11      ILE  23  34.512  21.337  14.232
  188   HG21  ILE  23          HG21      ILE  23  34.920  23.126  15.937
  189   HG22  ILE  23          HG22      ILE  23  34.030  24.107  14.773
  190   HG23  ILE  23          HG23      ILE  23  35.584  24.667  15.395
  191   HD11  ILE  23          HD11      ILE  23  33.223  23.369  13.269
  192   HD12  ILE  23          HD12      ILE  23  32.856  21.779  12.606
  193   HD13  ILE  23          HD13      ILE  23  33.900  22.884  11.715
  194    H    GLU  24           HN       GLU  24  38.526  23.639  12.936
  195    HA   GLU  24           HA       GLU  24  39.406  25.712  14.665
  196    HB2  GLU  24           HB2      GLU  24  41.654  25.306  13.436
  197    HB3  GLU  24           HB1      GLU  24  40.939  23.945  14.301
  198    HG2  GLU  24           HG2      GLU  24  40.081  22.994  12.279
  199    HG3  GLU  24           HG1      GLU  24  40.438  24.458  11.361
  200    H    ASN  25           HN       ASN  25  38.687  25.685  11.226
  201    HA   ASN  25           HA       ASN  25  40.046  28.136  10.570
  202    HB2  ASN  25           HB2      ASN  25  39.356  26.664   8.775
  203    HB3  ASN  25           HB1      ASN  25  37.674  26.727   9.305
  204   HD21  ASN  25          HD21      ASN  25  40.303  28.819   8.021
  205   HD22  ASN  25          HD22      ASN  25  39.259  29.939   7.287
  206    H    VAL  26           HN       VAL  26  36.683  27.360  11.488
  207    HA   VAL  26           HA       VAL  26  35.668  30.011  11.438
  208    HB   VAL  26           HB       VAL  26  34.978  27.845  13.451
  209   HG11  VAL  26          HG11      VAL  26  33.425  30.201  12.344
  210   HG12  VAL  26          HG12      VAL  26  34.050  30.046  13.986
  211   HG13  VAL  26          HG13      VAL  26  32.766  28.974  13.426
  212   HG21  VAL  26          HG21      VAL  26  33.136  27.363  11.734
  213   HG22  VAL  26          HG22      VAL  26  34.762  26.837  11.302
  214   HG23  VAL  26          HG23      VAL  26  34.094  28.309  10.595
  215    H    LYS  27           HN       LYS  27  36.743  28.206  14.326
  216    HA   LYS  27           HA       LYS  27  36.894  30.208  16.205
  217    HB2  LYS  27           HB2      LYS  27  38.912  28.006  15.675
  218    HB3  LYS  27           HB1      LYS  27  38.859  28.965  17.156
  219    HG2  LYS  27           HG2      LYS  27  36.484  28.231  17.479
  220    HG3  LYS  27           HG1      LYS  27  36.667  27.170  16.084
  221    HD2  LYS  27           HD2      LYS  27  38.501  25.979  17.194
  222    HD3  LYS  27           HD1      LYS  27  38.379  27.059  18.584
  223    HE2  LYS  27           HE2      LYS  27  36.065  26.296  18.977
  224    HE3  LYS  27           HE1      LYS  27  36.190  25.209  17.595
  225    HZ1  LYS  27           HZ1      LYS  27  37.462  25.028  20.226
  226    HZ2  LYS  27           HZ2      LYS  27  38.308  24.416  18.886
  227    HZ3  LYS  27           HZ3      LYS  27  36.771  23.807  19.274
  228    H    ALA  28           HN       ALA  28  39.085  29.720  13.491
  229    HA   ALA  28           HA       ALA  28  41.095  31.600  14.358
  230    HB1  ALA  28           HB1      ALA  28  41.242  29.793  12.505
  231    HB2  ALA  28           HB2      ALA  28  42.044  31.335  12.212
  232    HB3  ALA  28           HB3      ALA  28  40.483  30.996  11.464
  233    H    LYS  29           HN       LYS  29  38.572  31.948  11.826
  234    HA   LYS  29           HA       LYS  29  38.897  34.688  11.333
  235    HB2  LYS  29           HB2      LYS  29  36.417  32.968  11.324
  236    HB3  LYS  29           HB1      LYS  29  36.413  34.643  10.769
  237    HG2  LYS  29           HG2      LYS  29  37.822  34.193   8.949
  238    HG3  LYS  29           HG1      LYS  29  38.480  32.732   9.684
  239    HD2  LYS  29           HD2      LYS  29  36.249  31.649   9.419
  240    HD3  LYS  29           HD1      LYS  29  35.692  33.082   8.553
  241    HE2  LYS  29           HE2      LYS  29  37.680  32.740   6.991
  242    HE3  LYS  29           HE1      LYS  29  37.879  31.159   7.741
  243    HZ1  LYS  29           HZ1      LYS  29  36.502  30.658   6.003
  244    HZ2  LYS  29           HZ2      LYS  29  35.692  32.152   6.054
  245    HZ3  LYS  29           HZ3      LYS  29  35.356  30.960   7.217
  246    H    ILE  30           HN       ILE  30  37.361  33.090  14.012
  247    HA   ILE  30           HA       ILE  30  36.168  35.540  15.100
  248    HB   ILE  30           HB       ILE  30  36.469  32.689  16.043
  249   HG12  ILE  30          HG12      ILE  30  34.060  32.766  16.129
  250   HG13  ILE  30          HG11      ILE  30  34.049  34.519  15.962
  251   HG21  ILE  30          HG21      ILE  30  35.805  35.104  17.747
  252   HG22  ILE  30          HG22      ILE  30  36.990  33.841  18.077
  253   HG23  ILE  30          HG23      ILE  30  35.267  33.482  18.179
  254   HD11  ILE  30          HD11      ILE  30  33.543  33.091  13.856
  255   HD12  ILE  30          HD12      ILE  30  35.275  32.775  13.832
  256   HD13  ILE  30          HD13      ILE  30  34.678  34.428  13.692
  257    H    GLN  31           HN       GLN  31  38.689  33.375  16.389
  258    HA   GLN  31           HA       GLN  31  39.829  34.863  18.359
  259    HB2  GLN  31           HB2      GLN  31  40.664  32.657  17.590
  260    HB3  GLN  31           HB1      GLN  31  41.394  33.435  16.188
  261    HG2  GLN  31           HG2      GLN  31  42.761  34.833  17.706
  262    HG3  GLN  31           HG1      GLN  31  42.075  33.989  19.088
  263   HE21  GLN  31          HE21      GLN  31  44.721  33.677  19.065
  264   HE22  GLN  31          HE22      GLN  31  45.208  32.191  18.407
  265    H    ASP  32           HN       ASP  32  40.588  35.300  14.900
  266    HA   ASP  32           HA       ASP  32  42.357  37.545  15.386
  267    HB2  ASP  32           HB2      ASP  32  40.984  36.534  12.888
  268    HB3  ASP  32           HB1      ASP  32  42.096  37.903  12.889
  269    H    LYS  33           HN       LYS  33  39.065  37.397  13.993
  270    HA   LYS  33           HA       LYS  33  38.691  40.194  13.787
  271    HB2  LYS  33           HB2      LYS  33  36.725  37.954  14.130
  272    HB3  LYS  33           HB1      LYS  33  36.238  39.614  13.807
  273    HG2  LYS  33           HG2      LYS  33  37.498  39.626  11.729
  274    HG3  LYS  33           HG1      LYS  33  38.146  38.024  12.068
  275    HD2  LYS  33           HD2      LYS  33  35.862  37.086  12.011
  276    HD3  LYS  33           HD1      LYS  33  35.216  38.688  11.650
  277    HE2  LYS  33           HE2      LYS  33  37.257  37.250   9.931
  278    HE3  LYS  33           HE1      LYS  33  35.523  37.264   9.608
  279    HZ1  LYS  33           HZ1      LYS  33  35.560  39.611   9.349
  280    HZ2  LYS  33           HZ2      LYS  33  36.815  38.984   8.392
  281    HZ3  LYS  33           HZ3      LYS  33  37.167  39.718   9.883
  282    H    GLU  34           HN       GLU  34  37.938  38.038  16.532
  283    HA   GLU  34           HA       GLU  34  36.964  40.377  18.084
  284    HB2  GLU  34           HB2      GLU  34  37.073  37.477  18.953
  285    HB3  GLU  34           HB1      GLU  34  36.117  38.781  19.657
  286    HG2  GLU  34           HG2      GLU  34  34.916  39.008  17.465
  287    HG3  GLU  34           HG1      GLU  34  35.782  37.581  16.895
  288    H    GLY  35           HN       GLY  35  39.678  38.105  17.995
  289    HA2  GLY  35           HA3      GLY  35  41.818  38.482  18.983
  290    HA3  GLY  35           HA2      GLY  35  41.151  39.868  19.843
  291    H    ILE  36           HN       ILE  36  39.375  36.912  19.937
  292    HA   ILE  36           HA       ILE  36  40.003  36.609  22.822
  293    HB   ILE  36           HB       ILE  36  37.734  35.483  21.184
  294   HG12  ILE  36          HG12      ILE  36  37.940  37.974  22.902
  295   HG13  ILE  36          HG11      ILE  36  37.714  37.935  21.156
  296   HG21  ILE  36          HG21      ILE  36  38.329  34.344  23.349
  297   HG22  ILE  36          HG22      ILE  36  36.718  35.053  23.335
  298   HG23  ILE  36          HG23      ILE  36  38.035  35.875  24.169
  299   HD11  ILE  36          HD11      ILE  36  35.801  36.970  23.277
  300   HD12  ILE  36          HD12      ILE  36  35.607  36.606  21.562
  301   HD13  ILE  36          HD13      ILE  36  35.551  38.278  22.120
  302    HA   PRO  37           HA       PRO  37  42.524  33.089  21.202
  303    HB2  PRO  37           HB2      PRO  37  42.619  32.640  24.173
  304    HB3  PRO  37           HB1      PRO  37  43.931  32.541  22.979
  305    HG2  PRO  37           HG2      PRO  37  43.712  34.653  24.557
  306    HG3  PRO  37           HG1      PRO  37  44.158  34.844  22.850
  307    HD2  PRO  37           HD2      PRO  37  41.541  35.436  24.186
  308    HD3  PRO  37           HD1      PRO  37  42.320  36.259  22.816
  309    HA   PRO  38           HA       PRO  38  39.183  30.050  20.944
  310    HB2  PRO  38           HB2      PRO  38  41.580  28.285  21.263
  311    HB3  PRO  38           HB1      PRO  38  40.154  28.049  20.228
  312    HG2  PRO  38           HG2      PRO  38  42.349  29.035  19.199
  313    HG3  PRO  38           HG1      PRO  38  40.788  29.729  18.755
  314    HD2  PRO  38           HD2      PRO  38  42.932  30.888  20.484
  315    HD3  PRO  38           HD1      PRO  38  41.686  31.716  19.522
  316    H    ASP  39           HN       ASP  39  41.777  29.168  23.202
  317    HA   ASP  39           HA       ASP  39  40.394  27.540  24.967
  318    HB2  ASP  39           HB2      ASP  39  42.549  29.579  25.538
  319    HB3  ASP  39           HB1      ASP  39  41.969  28.438  26.749
  320    H    GLN  40           HN       GLN  40  40.310  31.086  24.885
  321    HA   GLN  40           HA       GLN  40  38.689  31.233  27.311
  322    HB2  GLN  40           HB2      GLN  40  39.649  33.247  25.278
  323    HB3  GLN  40           HB1      GLN  40  38.537  33.689  26.572
  324    HG2  GLN  40           HG2      GLN  40  41.144  32.264  27.111
  325    HG3  GLN  40           HG1      GLN  40  41.027  34.023  27.065
  326   HE21  GLN  40          HE21      GLN  40  39.190  34.937  28.552
  327   HE22  GLN  40          HE22      GLN  40  38.982  34.171  30.051
  328    H    GLN  41           HN       GLN  41  37.788  29.974  24.533
  329    HA   GLN  41           HA       GLN  41  35.025  31.007  24.778
  330    HB2  GLN  41           HB2      GLN  41  34.935  31.194  22.246
  331    HB3  GLN  41           HB1      GLN  41  35.831  32.462  23.073
  332    HG2  GLN  41           HG2      GLN  41  37.935  31.292  22.601
  333    HG3  GLN  41           HG1      GLN  41  37.041  29.988  21.815
  334   HE21  GLN  41          HE21      GLN  41  37.819  33.472  21.533
  335   HE22  GLN  41          HE22      GLN  41  37.518  33.566  19.866
  336    H    ARG  42           HN       ARG  42  33.470  29.562  24.088
  337    HA   ARG  42           HA       ARG  42  34.366  26.927  22.984
  338    HB2  ARG  42           HB2      ARG  42  32.511  27.373  25.355
  339    HB3  ARG  42           HB1      ARG  42  32.701  25.825  24.534
  340    HG2  ARG  42           HG2      ARG  42  35.158  27.247  25.546
  341    HG3  ARG  42           HG1      ARG  42  34.144  26.379  26.692
  342    HD2  ARG  42           HD2      ARG  42  34.524  24.303  25.653
  343    HD3  ARG  42           HD1      ARG  42  35.063  25.044  24.150
  344    HE   ARG  42           HE       ARG  42  36.803  25.730  26.365
  345   HH11  ARG  42          HH11      ARG  42  38.857  24.791  26.344
  346   HH12  ARG  42          HH12      ARG  42  39.161  23.422  25.326
  347   HH21  ARG  42          HH21      ARG  42  35.935  23.319  24.057
  348   HH22  ARG  42          HH22      ARG  42  37.504  22.589  24.031
  349    H    LEU  43           HN       LEU  43  33.031  26.269  21.315
  350    HA   LEU  43           HA       LEU  43  30.808  28.079  20.634
  351    HB2  LEU  43           HB2      LEU  43  32.205  25.803  19.209
  352    HB3  LEU  43           HB1      LEU  43  30.744  26.571  18.559
  353    HG   LEU  43           HG       LEU  43  31.870  28.749  18.553
  354   HD11  LEU  43          HD11      LEU  43  33.392  28.714  20.355
  355   HD12  LEU  43          HD12      LEU  43  34.452  28.620  18.947
  356   HD13  LEU  43          HD13      LEU  43  34.075  27.163  19.867
  357   HD21  LEU  43          HD21      LEU  43  32.087  27.364  16.565
  358   HD22  LEU  43          HD22      LEU  43  33.455  26.506  17.278
  359   HD23  LEU  43          HD23      LEU  43  33.611  28.208  16.841
  360    H    ILE  44           HN       ILE  44  28.664  27.437  20.506
  361    HA   ILE  44           HA       ILE  44  27.965  24.724  21.606
  362    HB   ILE  44           HB       ILE  44  26.375  27.304  21.824
  363   HG12  ILE  44          HG12      ILE  44  28.354  27.483  23.222
  364   HG13  ILE  44          HG11      ILE  44  26.967  27.166  24.259
  365   HG21  ILE  44          HG21      ILE  44  24.995  25.249  21.811
  366   HG22  ILE  44          HG22      ILE  44  25.000  25.971  23.422
  367   HG23  ILE  44          HG23      ILE  44  26.001  24.559  23.085
  368   HD11  ILE  44          HD11      ILE  44  27.662  24.646  23.975
  369   HD12  ILE  44          HD12      ILE  44  28.558  25.668  25.096
  370   HD13  ILE  44          HD13      ILE  44  29.218  25.324  23.501
  371    H    PHE  45           HN       PHE  45  26.689  23.487  20.214
  372    HA   PHE  45           HA       PHE  45  25.030  24.862  18.200
  373    HB2  PHE  45           HB2      PHE  45  27.102  24.723  16.988
  374    HB3  PHE  45           HB1      PHE  45  27.367  23.061  17.511
  375    HD1  PHE  45           HD1      PHE  45  25.472  25.256  15.245
  376    HD2  PHE  45           HD2      PHE  45  26.084  21.219  16.564
  377    HE1  PHE  45           HE1      PHE  45  24.220  24.425  13.271
  378    HE2  PHE  45           HE2      PHE  45  24.832  20.382  14.591
  379    HZ   PHE  45           HZ       PHE  45  23.899  21.986  12.945
  380    H    ALA  46           HN       ALA  46  23.136  23.807  18.180
  381    HA   ALA  46           HA       ALA  46  21.539  22.127  18.529
  382    HB1  ALA  46           HB1      ALA  46  22.022  20.037  17.385
  383    HB2  ALA  46           HB2      ALA  46  23.751  20.384  17.412
  384    HB3  ALA  46           HB3      ALA  46  22.668  21.373  16.433
  385    H    GLY  47           HN       GLY  47  23.747  22.521  20.718
  386    HA2  GLY  47           HA3      GLY  47  23.644  21.590  22.923
  387    HA3  GLY  47           HA2      GLY  47  22.895  20.138  22.265
  388    H    LYS  48           HN       LYS  48  25.423  20.735  20.226
  389    HA   LYS  48           HA       LYS  48  27.278  18.982  21.785
  390    HB2  LYS  48           HB2      LYS  48  26.412  17.976  19.703
  391    HB3  LYS  48           HB1      LYS  48  26.947  19.384  18.794
  392    HG2  LYS  48           HG2      LYS  48  29.254  18.935  19.381
  393    HG3  LYS  48           HG1      LYS  48  28.773  17.574  20.392
  394    HD2  LYS  48           HD2      LYS  48  27.845  16.432  18.412
  395    HD3  LYS  48           HD1      LYS  48  28.325  17.795  17.398
  396    HE2  LYS  48           HE2      LYS  48  30.685  17.417  17.992
  397    HE3  LYS  48           HE1      LYS  48  30.215  16.064  19.021
  398    HZ1  LYS  48           HZ1      LYS  48  30.976  15.495  16.704
  399    HZ2  LYS  48           HZ2      LYS  48  29.527  16.183  16.145
  400    HZ3  LYS  48           HZ3      LYS  48  29.489  14.835  17.179
  401    H    GLN  49           HN       GLN  49  29.513  19.700  21.905
  402    HA   GLN  49           HA       GLN  49  29.890  22.540  21.250
  403    HB2  GLN  49           HB2      GLN  49  30.507  21.552  23.504
  404    HB3  GLN  49           HB1      GLN  49  31.772  20.646  22.675
  405    HG2  GLN  49           HG2      GLN  49  32.587  22.888  21.757
  406    HG3  GLN  49           HG1      GLN  49  31.502  23.647  22.923
  407   HE21  GLN  49          HE21      GLN  49  31.861  22.992  25.279
  408   HE22  GLN  49          HE22      GLN  49  33.442  22.621  25.772
  409    H    LEU  50           HN       LEU  50  30.924  23.072  19.391
  410    HA   LEU  50           HA       LEU  50  31.980  21.072  17.614
  411    HB2  LEU  50           HB2      LEU  50  32.583  24.037  17.521
  412    HB3  LEU  50           HB1      LEU  50  32.589  22.897  16.176
  413    HG   LEU  50           HG       LEU  50  30.184  23.818  17.775
  414   HD11  LEU  50          HD11      LEU  50  30.926  25.392  16.059
  415   HD12  LEU  50          HD12      LEU  50  29.430  24.616  15.541
  416   HD13  LEU  50          HD13      LEU  50  30.973  24.101  14.860
  417   HD21  LEU  50          HD21      LEU  50  30.541  21.557  15.800
  418   HD22  LEU  50          HD22      LEU  50  28.981  22.362  15.970
  419   HD23  LEU  50          HD23      LEU  50  29.703  21.540  17.353
  420    H    GLU  51           HN       GLU  51  34.130  20.589  17.100
  421    HA   GLU  51           HA       GLU  51  36.225  21.577  19.017
  422    HB2  GLU  51           HB2      GLU  51  36.073  18.753  17.940
  423    HB3  GLU  51           HB1      GLU  51  37.104  19.365  19.236
  424    HG2  GLU  51           HG2      GLU  51  34.964  19.939  20.495
  425    HG3  GLU  51           HG1      GLU  51  34.101  18.996  19.279
  426    H    ASP  52           HN       ASP  52  38.407  21.508  18.158
  427    HA   ASP  52           HA       ASP  52  38.657  22.459  15.496
  428    HB2  ASP  52           HB2      ASP  52  41.078  22.132  15.803
  429    HB3  ASP  52           HB1      ASP  52  40.360  22.839  17.250
  430    H    GLY  53           HN       GLY  53  39.641  21.402  13.633
  431    HA2  GLY  53           HA3      GLY  53  40.176  19.538  12.263
  432    HA3  GLY  53           HA2      GLY  53  39.897  18.478  13.645
  433    H    ARG  54           HN       ARG  54  38.850  17.593  11.332
  434    HA   ARG  54           HA       ARG  54  36.863  16.914  10.319
  435    HB2  ARG  54           HB2      ARG  54  36.453  16.585  12.923
  436    HB3  ARG  54           HB1      ARG  54  35.306  17.901  12.698
  437    HG2  ARG  54           HG2      ARG  54  33.943  16.051  12.279
  438    HG3  ARG  54           HG1      ARG  54  34.476  16.445  10.649
  439    HD2  ARG  54           HD2      ARG  54  36.207  14.727  10.753
  440    HD3  ARG  54           HD1      ARG  54  35.819  14.394  12.441
  441    HE   ARG  54           HE       ARG  54  33.500  14.067  10.742
  442   HH11  ARG  54          HH11      ARG  54  32.800  11.945  10.397
  443   HH12  ARG  54          HH12      ARG  54  33.867  10.628  10.750
  444   HH21  ARG  54          HH21      ARG  54  36.465  12.667  11.810
  445   HH22  ARG  54          HH22      ARG  54  35.942  11.036  11.550
  446    H    THR  55           HN       THR  55  34.876  17.753   9.307
  447    HA   THR  55           HA       THR  55  34.731  20.744   9.268
  448    HB   THR  55           HB       THR  55  34.121  20.546   6.886
  449    HG1  THR  55           HG1      THR  55  33.398  18.664   6.346
  450   HG21  THR  55          HG21      THR  55  36.448  20.911   7.284
  451   HG22  THR  55          HG22      THR  55  36.355  19.636   6.070
  452   HG23  THR  55          HG23      THR  55  36.700  19.229   7.751
  453    H    LEU  56           HN       LEU  56  32.499  21.470   8.465
  454    HA   LEU  56           HA       LEU  56  30.461  20.352  10.122
  455    HB2  LEU  56           HB2      LEU  56  30.122  22.035   7.620
  456    HB3  LEU  56           HB1      LEU  56  28.932  21.834   8.904
  457    HG   LEU  56           HG       LEU  56  31.696  22.899   9.516
  458   HD11  LEU  56          HD11      LEU  56  30.661  24.297   7.711
  459   HD12  LEU  56          HD12      LEU  56  30.882  25.166   9.228
  460   HD13  LEU  56          HD13      LEU  56  29.283  24.576   8.776
  461   HD21  LEU  56          HD21      LEU  56  30.391  24.016  11.362
  462   HD22  LEU  56          HD22      LEU  56  30.372  22.257  11.446
  463   HD23  LEU  56          HD23      LEU  56  28.967  23.127  10.829
  464    H    SER  57           HN       SER  57  31.060  20.025   6.618
  465    HA   SER  57           HA       SER  57  28.826  18.283   6.125
  466    HB2  SER  57           HB2      SER  57  30.018  17.689   4.045
  467    HB3  SER  57           HB1      SER  57  30.051  19.430   4.304
  468    HG   SER  57           HG       SER  57  32.097  17.972   3.864
  469    H    ASP  58           HN       ASP  58  32.266  17.634   6.716
  470    HA   ASP  58           HA       ASP  58  32.214  14.829   6.661
  471    HB2  ASP  58           HB2      ASP  58  33.817  16.733   8.368
  472    HB3  ASP  58           HB1      ASP  58  34.083  14.993   8.398
  473    H    TYR  59           HN       TYR  59  31.016  17.012   9.182
  474    HA   TYR  59           HA       TYR  59  30.716  14.891  11.153
  475    HB2  TYR  59           HB2      TYR  59  29.762  17.735  10.894
  476    HB3  TYR  59           HB1      TYR  59  28.960  16.693  12.067
  477    HD1  TYR  59           HD1      TYR  59  31.534  19.016  11.728
  478    HD2  TYR  59           HD2      TYR  59  30.741  15.165  13.467
  479    HE1  TYR  59           HE1      TYR  59  33.387  19.359  13.337
  480    HE2  TYR  59           HE2      TYR  59  32.596  15.512  15.074
  481    HH   TYR  59           HH       TYR  59  34.243  16.846  15.720
  482    H    ASN  60           HN       ASN  60  28.923  15.986   8.392
  483    HA   ASN  60           HA       ASN  60  26.958  15.176   7.421
  484    HB2  ASN  60           HB2      ASN  60  28.183  12.972   7.982
  485    HB3  ASN  60           HB1      ASN  60  27.084  12.858   9.357
  486   HD21  ASN  60          HD21      ASN  60  25.814  11.092   8.545
  487   HD22  ASN  60          HD22      ASN  60  24.840  11.227   7.162
  488    H    ILE  61           HN       ILE  61  26.446  17.135   9.179
  489    HA   ILE  61           HA       ILE  61  24.531  16.245  11.229
  490    HB   ILE  61           HB       ILE  61  25.116  19.054  10.248
  491   HG12  ILE  61          HG12      ILE  61  27.199  18.080  11.017
  492   HG13  ILE  61          HG11      ILE  61  26.610  19.168  12.270
  493   HG21  ILE  61          HG21      ILE  61  23.950  18.031  12.853
  494   HG22  ILE  61          HG22      ILE  61  23.024  18.771  11.547
  495   HG23  ILE  61          HG23      ILE  61  24.219  19.722  12.430
  496   HD11  ILE  61          HD11      ILE  61  26.647  16.159  12.245
  497   HD12  ILE  61          HD12      ILE  61  25.475  17.011  13.248
  498   HD13  ILE  61          HD13      ILE  61  27.201  17.263  13.500
  499    H    GLN  62           HN       GLN  62  22.464  15.760  10.692
  500    HA   GLN  62           HA       GLN  62  21.361  16.688   8.110
  501    HB2  GLN  62           HB2      GLN  62  20.187  14.873  10.239
  502    HB3  GLN  62           HB1      GLN  62  19.486  15.172   8.648
  503    HG2  GLN  62           HG2      GLN  62  21.534  14.266   7.588
  504    HG3  GLN  62           HG1      GLN  62  22.202  13.934   9.186
  505   HE21  GLN  62          HE21      GLN  62  21.937  11.773   9.737
  506   HE22  GLN  62          HE22      GLN  62  20.604  10.811   9.314
  507    H    LYS  63           HN       LYS  63  21.533  18.976   9.237
  508    HA   LYS  63           HA       LYS  63  19.386  19.568  11.140
  509    HB2  LYS  63           HB2      LYS  63  21.590  20.805  11.059
  510    HB3  LYS  63           HB1      LYS  63  21.060  21.522   9.537
  511    HG2  LYS  63           HG2      LYS  63  19.107  22.501  10.641
  512    HG3  LYS  63           HG1      LYS  63  19.558  21.732  12.164
  513    HD2  LYS  63           HD2      LYS  63  21.720  22.991  12.105
  514    HD3  LYS  63           HD1      LYS  63  21.145  23.837  10.668
  515    HE2  LYS  63           HE2      LYS  63  19.749  23.837  13.361
  516    HE3  LYS  63           HE1      LYS  63  20.743  25.154  12.735
  517    HZ1  LYS  63           HZ1      LYS  63  18.089  24.257  11.886
  518    HZ2  LYS  63           HZ2      LYS  63  19.128  24.896  10.704
  519    HZ3  LYS  63           HZ3      LYS  63  18.696  25.832  12.055
  520    H    GLU  64           HN       GLU  64  19.885  19.743   7.668
  521    HA   GLU  64           HA       GLU  64  18.430  20.370   5.931
  522    HB2  GLU  64           HB2      GLU  64  17.191  18.457   7.107
  523    HB3  GLU  64           HB1      GLU  64  16.220  19.706   7.887
  524    HG2  GLU  64           HG2      GLU  64  15.527  20.571   5.703
  525    HG3  GLU  64           HG1      GLU  64  16.549  19.386   4.890
  526    H    SEP  65           HN       SEP  65  19.330  22.609   7.043
  527    HA   SEP  65           HA       SEP  65  17.390  24.579   6.545
  528    HB2  SEP  65           HB1      SEP  65  17.415  23.556   9.360
  529    HB3  SEP  65           HB2      SEP  65  16.064  24.168   8.409
  530    H    TPO  66           HN       TPO  66  18.131  26.783   7.437
  531    HA   TPO  66           HA       TPO  66  20.819  27.267   6.830
  532    HB   TPO  66           HB       TPO  66  19.307  28.859   8.909
  533   HG21  TPO  66          HG21      TPO  66  21.733  29.361   8.289
  534   HG22  TPO  66          HG22      TPO  66  20.596  30.696   8.108
  535   HG23  TPO  66          HG23      TPO  66  21.130  29.796   6.689
  536    H    LEU  67           HN       LEU  67  22.738  27.209   7.998
  537    HA   LEU  67           HA       LEU  67  22.688  25.684  10.516
  538    HB2  LEU  67           HB2      LEU  67  25.108  26.901   9.166
  539    HB3  LEU  67           HB1      LEU  67  25.058  25.523  10.265
  540    HG   LEU  67           HG       LEU  67  23.844  25.619   7.486
  541   HD11  LEU  67          HD11      LEU  67  26.327  24.335   8.640
  542   HD12  LEU  67          HD12      LEU  67  26.204  25.419   7.255
  543   HD13  LEU  67          HD13      LEU  67  25.593  23.771   7.139
  544   HD21  LEU  67          HD21      LEU  67  22.469  24.164   8.757
  545   HD22  LEU  67          HD22      LEU  67  23.833  23.542   9.686
  546   HD23  LEU  67          HD23      LEU  67  23.634  23.085   7.994
  547    H    HIS  68           HN       HIS  68  22.431  26.714  12.412
  548    HA   HIS  68           HA       HIS  68  23.336  29.564  12.673
  549    HB2  HIS  68           HB2      HIS  68  21.326  27.984  14.308
  550    HB3  HIS  68           HB1      HIS  68  21.755  29.674  14.570
  551    HD1  HIS  68           HD1      HIS  68  21.344  31.267  12.356
  552    HD2  HIS  68           HD2      HIS  68  19.253  27.660  12.501
  553    HE1  HIS  68           HE1      HIS  68  19.440  31.473  10.695
  554    HE2  HIS  68           HE2      HIS  68  18.161  29.283  10.776
  555    H    LEU  69           HN       LEU  69  24.996  29.982  14.052
  556    HA   LEU  69           HA       LEU  69  25.823  27.850  16.004
  557    HB2  LEU  69           HB2      LEU  69  27.581  29.725  14.383
  558    HB3  LEU  69           HB1      LEU  69  28.155  28.647  15.651
  559    HG   LEU  69           HG       LEU  69  26.881  26.798  14.187
  560   HD11  LEU  69          HD11      LEU  69  25.989  28.321  12.501
  561   HD12  LEU  69          HD12      LEU  69  27.211  27.297  11.758
  562   HD13  LEU  69          HD13      LEU  69  27.599  28.962  12.181
  563   HD21  LEU  69          HD21      LEU  69  29.579  27.955  13.410
  564   HD22  LEU  69          HD22      LEU  69  29.017  26.321  13.060
  565   HD23  LEU  69          HD23      LEU  69  29.300  26.817  14.729
  566    H    VAL  70           HN       VAL  70  26.596  28.637  18.034
  567    HA   VAL  70           HA       VAL  70  26.293  31.578  18.523
  568    HB   VAL  70           HB       VAL  70  25.265  29.345  20.309
  569   HG11  VAL  70          HG11      VAL  70  26.027  31.201  21.645
  570   HG12  VAL  70          HG12      VAL  70  24.270  31.311  21.557
  571   HG13  VAL  70          HG13      VAL  70  25.272  32.365  20.557
  572   HG21  VAL  70          HG21      VAL  70  23.931  29.820  18.205
  573   HG22  VAL  70          HG22      VAL  70  23.699  31.461  18.807
  574   HG23  VAL  70          HG23      VAL  70  23.052  30.091  19.710
  575    H    LEU  71           HN       LEU  71  28.322  32.216  19.109
  576    HA   LEU  71           HA       LEU  71  30.096  30.296  20.527
  577    HB2  LEU  71           HB2      LEU  71  30.905  31.536  18.514
  578    HB3  LEU  71           HB1      LEU  71  30.698  33.046  19.395
  579    HG   LEU  71           HG       LEU  71  32.326  30.941  20.783
  580   HD11  LEU  71          HD11      LEU  71  33.228  32.344  18.263
  581   HD12  LEU  71          HD12      LEU  71  33.275  30.619  18.619
  582   HD13  LEU  71          HD13      LEU  71  34.367  31.720  19.457
  583   HD21  LEU  71          HD21      LEU  71  33.738  32.958  21.289
  584   HD22  LEU  71          HD22      LEU  71  32.069  33.142  21.814
  585   HD23  LEU  71          HD23      LEU  71  32.621  33.936  20.342
  586    H    ARG  72           HN       ARG  72  31.030  30.788  22.550
  587    HA   ARG  72           HA       ARG  72  29.809  33.095  24.041
  588    HB2  ARG  72           HB2      ARG  72  29.100  30.698  24.705
  589    HB3  ARG  72           HB1      ARG  72  30.750  30.502  25.290
  590    HG2  ARG  72           HG2      ARG  72  30.382  32.655  26.623
  591    HG3  ARG  72           HG1      ARG  72  28.670  32.479  26.237
  592    HD2  ARG  72           HD2      ARG  72  30.413  30.529  27.763
  593    HD3  ARG  72           HD1      ARG  72  29.028  31.433  28.377
  594    HE   ARG  72           HE       ARG  72  27.927  29.978  26.322
  595   HH11  ARG  72          HH11      ARG  72  27.129  27.877  26.559
  596   HH12  ARG  72          HH12      ARG  72  27.762  26.861  27.811
  597   HH21  ARG  72          HH21      ARG  72  29.975  29.250  29.000
  598   HH22  ARG  72          HH22      ARG  72  29.372  27.637  29.192
  599    H    LEU  73           HN       LEU  73  31.295  34.285  25.348
  600    HA   LEU  73           HA       LEU  73  34.190  33.548  25.001
  601    HB2  LEU  73           HB2      LEU  73  34.505  36.090  25.386
  602    HB3  LEU  73           HB1      LEU  73  33.928  35.566  23.807
  603    HG   LEU  73           HG       LEU  73  31.841  36.148  25.889
  604   HD11  LEU  73          HD11      LEU  73  33.280  38.065  26.217
  605   HD12  LEU  73          HD12      LEU  73  31.900  38.580  25.248
  606   HD13  LEU  73          HD13      LEU  73  33.460  38.287  24.476
  607   HD21  LEU  73          HD21      LEU  73  31.916  37.052  23.004
  608   HD22  LEU  73          HD22      LEU  73  30.514  36.713  24.017
  609   HD23  LEU  73          HD23      LEU  73  31.507  35.388  23.415
  610    H    ARG  74           HN       ARG  74  35.185  33.061  26.897
  611    HA   ARG  74           HA       ARG  74  33.815  33.304  29.423
  612    HB2  ARG  74           HB2      ARG  74  36.674  32.634  28.684
  613    HB3  ARG  74           HB1      ARG  74  36.105  32.658  30.353
  614    HG2  ARG  74           HG2      ARG  74  34.328  31.019  29.733
  615    HG3  ARG  74           HG1      ARG  74  35.009  30.939  28.108
  616    HD2  ARG  74           HD2      ARG  74  37.123  30.106  28.986
  617    HD3  ARG  74           HD1      ARG  74  36.547  30.297  30.641
  618    HE   ARG  74           HE       ARG  74  34.778  28.585  29.131
  619   HH11  ARG  74          HH11      ARG  74  34.842  26.379  29.618
  620   HH12  ARG  74          HH12      ARG  74  36.198  25.734  30.481
  621   HH21  ARG  74          HH21      ARG  74  37.828  28.784  30.732
  622   HH22  ARG  74          HH22      ARG  74  37.888  27.095  31.111
  623    H    GLY  75           HN       GLY  75  34.639  34.578  31.283
  624    HA2  GLY  75           HA3      GLY  75  35.624  36.505  32.259
  625    HA3  GLY  75           HA2      GLY  75  36.377  36.872  30.707
  626    H    GLY  76           HN       GLY  76  33.162  36.215  30.144
  627    HA2  GLY  76           HA3      GLY  76  32.090  38.857  30.835
  628    HA3  GLY  76           HA2      GLY  76  32.369  38.620  29.108
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1  29.788  28.275   3.910
    2    H2   MET   1           HT2      MET   1  29.946  27.682   2.325
    3    H3   MET   1           HT3      MET   1  28.641  27.187   3.293
    4    HA   MET   1           HA       MET   1  28.925  29.527   1.660
    5    HB2  MET   1           HB2      MET   1  26.622  28.142   3.068
    6    HB3  MET   1           HB1      MET   1  26.434  29.478   1.933
    7    HG2  MET   1           HG2      MET   1  27.521  28.155   0.169
    8    HG3  MET   1           HG1      MET   1  27.754  26.821   1.300
    9    HE1  MET   1           HE1      MET   1  25.019  25.799  -1.337
   10    HE2  MET   1           HE2      MET   1  26.334  25.089  -0.405
   11    HE3  MET   1           HE3      MET   1  26.627  26.536  -1.365
   12    H    GLN   2           HN       GLN   2  26.790  31.041   2.771
   13    HA   GLN   2           HA       GLN   2  28.257  32.647   4.679
   14    HB2  GLN   2           HB2      GLN   2  25.355  32.728   3.798
   15    HB3  GLN   2           HB1      GLN   2  26.120  33.950   4.814
   16    HG2  GLN   2           HG2      GLN   2  27.773  34.397   3.036
   17    HG3  GLN   2           HG1      GLN   2  27.003  33.182   2.017
   18   HE21  GLN   2          HE21      GLN   2  26.053  34.474   0.389
   19   HE22  GLN   2          HE22      GLN   2  24.950  35.726   0.700
   20    H    ILE   3           HN       ILE   3  28.665  31.432   6.550
   21    HA   ILE   3           HA       ILE   3  26.413  30.105   7.932
   22    HB   ILE   3           HB       ILE   3  28.231  29.526   9.614
   23   HG12  ILE   3          HG12      ILE   3  30.023  30.683   7.453
   24   HG13  ILE   3          HG11      ILE   3  29.719  31.449   9.012
   25   HG21  ILE   3          HG21      ILE   3  28.791  28.750   6.737
   26   HG22  ILE   3          HG22      ILE   3  27.514  28.043   7.724
   27   HG23  ILE   3          HG23      ILE   3  29.203  27.821   8.178
   28   HD11  ILE   3          HD11      ILE   3  30.972  28.724   8.574
   29   HD12  ILE   3          HD12      ILE   3  30.594  29.418  10.151
   30   HD13  ILE   3          HD13      ILE   3  31.805  30.180   9.120
   31    H    PHE   4           HN       PHE   4  25.379  30.940   9.698
   32    HA   PHE   4           HA       PHE   4  26.011  33.729  10.461
   33    HB2  PHE   4           HB2      PHE   4  23.727  31.848  11.097
   34    HB3  PHE   4           HB1      PHE   4  23.893  33.429  11.860
   35    HD1  PHE   4           HD1      PHE   4  23.511  31.691   8.596
   36    HD2  PHE   4           HD2      PHE   4  23.370  35.443  10.683
   37    HE1  PHE   4           HE1      PHE   4  22.498  32.763   6.602
   38    HE2  PHE   4           HE2      PHE   4  22.357  36.514   8.689
   39    HZ   PHE   4           HZ       PHE   4  21.919  35.174   6.649
   40    H    VAL   5           HN       VAL   5  26.443  34.347  12.637
   41    HA   VAL   5           HA       VAL   5  26.999  32.173  14.598
   42    HB   VAL   5           HB       VAL   5  29.018  34.265  13.751
   43   HG11  VAL   5          HG11      VAL   5  29.174  33.993  16.135
   44   HG12  VAL   5          HG12      VAL   5  30.475  33.037  15.425
   45   HG13  VAL   5          HG13      VAL   5  29.010  32.242  16.001
   46   HG21  VAL   5          HG21      VAL   5  30.376  32.138  13.314
   47   HG22  VAL   5          HG22      VAL   5  29.060  32.467  12.188
   48   HG23  VAL   5          HG23      VAL   5  28.852  31.263  13.460
   49    H    LYS   6           HN       LYS   6  25.641  32.815  16.211
   50    HA   LYS   6           HA       LYS   6  25.322  35.713  16.797
   51    HB2  LYS   6           HB2      LYS   6  23.311  34.246  16.634
   52    HB3  LYS   6           HB1      LYS   6  23.911  33.317  18.007
   53    HG2  LYS   6           HG2      LYS   6  23.841  35.316  19.424
   54    HG3  LYS   6           HG1      LYS   6  23.309  36.289  18.052
   55    HD2  LYS   6           HD2      LYS   6  21.277  34.877  17.857
   56    HD3  LYS   6           HD1      LYS   6  21.799  33.957  19.269
   57    HE2  LYS   6           HE2      LYS   6  21.279  36.944  19.253
   58    HE3  LYS   6           HE1      LYS   6  20.149  35.730  19.853
   59    HZ1  LYS   6           HZ1      LYS   6  22.749  35.375  20.956
   60    HZ2  LYS   6           HZ2      LYS   6  21.259  35.577  21.750
   61    HZ3  LYS   6           HZ3      LYS   6  22.162  36.935  21.273
   62    H    THR   7           HN       THR   7  26.477  36.638  18.411
   63    HA   THR   7           HA       THR   7  28.138  34.971  20.163
   64    HB   THR   7           HB       THR   7  29.015  37.115  20.980
   65    HG1  THR   7           HG1      THR   7  26.934  38.168  19.372
   66   HG21  THR   7          HG21      THR   7  29.682  38.076  18.701
   67   HG22  THR   7          HG22      THR   7  28.661  36.824  17.995
   68   HG23  THR   7          HG23      THR   7  30.058  36.374  18.972
   69    H    LEU   8           HN       LEU   8  28.158  35.639  22.583
   70    HA   LEU   8           HA       LEU   8  25.550  35.077  23.676
   71    HB2  LEU   8           HB2      LEU   8  27.715  34.405  24.746
   72    HB3  LEU   8           HB1      LEU   8  28.016  36.101  25.113
   73    HG   LEU   8           HG       LEU   8  25.877  36.162  26.407
   74   HD11  LEU   8          HD11      LEU   8  24.481  34.465  25.633
   75   HD12  LEU   8          HD12      LEU   8  25.133  33.696  27.075
   76   HD13  LEU   8          HD13      LEU   8  25.795  33.297  25.490
   77   HD21  LEU   8          HD21      LEU   8  26.747  34.624  28.271
   78   HD22  LEU   8          HD22      LEU   8  27.861  35.862  27.689
   79   HD23  LEU   8          HD23      LEU   8  28.044  34.190  27.158
   80    H    THR   9           HN       THR   9  27.461  38.027  23.277
   81    HA   THR   9           HA       THR   9  25.608  39.660  24.835
   82    HB   THR   9           HB       THR   9  26.949  41.555  24.000
   83    HG1  THR   9           HG1      THR   9  28.879  40.446  22.718
   84   HG21  THR   9          HG21      THR   9  28.806  39.267  24.662
   85   HG22  THR   9          HG22      THR   9  27.753  40.008  25.866
   86   HG23  THR   9          HG23      THR   9  28.999  40.971  25.071
   87    H    GLY  10           HN       GLY  10  25.259  38.164  21.938
   88    HA2  GLY  10           HA3      GLY  10  23.365  38.431  20.494
   89    HA3  GLY  10           HA2      GLY  10  23.168  40.082  21.080
   90    H    LYS  11           HN       LYS  11  26.235  40.339  20.662
   91    HA   LYS  11           HA       LYS  11  26.183  41.734  18.213
   92    HB2  LYS  11           HB2      LYS  11  28.445  40.386  19.704
   93    HB3  LYS  11           HB1      LYS  11  28.719  41.273  18.205
   94    HG2  LYS  11           HG2      LYS  11  27.961  43.321  19.151
   95    HG3  LYS  11           HG1      LYS  11  27.245  42.501  20.540
   96    HD2  LYS  11           HD2      LYS  11  29.336  43.536  21.234
   97    HD3  LYS  11           HD1      LYS  11  29.535  41.782  21.241
   98    HE2  LYS  11           HE2      LYS  11  30.764  41.807  19.203
   99    HE3  LYS  11           HE1      LYS  11  30.283  43.466  18.845
  100    HZ1  LYS  11           HZ1      LYS  11  31.488  44.083  20.950
  101    HZ2  LYS  11           HZ2      LYS  11  32.468  43.581  19.657
  102    HZ3  LYS  11           HZ3      LYS  11  32.145  42.521  20.944
  103    H    THR  12           HN       THR  12  25.593  40.859  16.286
  104    HA   THR  12           HA       THR  12  26.166  38.004  15.729
  105    HB   THR  12           HB       THR  12  24.636  40.069  14.116
  106    HG1  THR  12           HG1      THR  12  22.883  39.267  15.082
  107   HG21  THR  12          HG21      THR  12  25.378  38.375  12.616
  108   HG22  THR  12          HG22      THR  12  23.728  37.926  13.044
  109   HG23  THR  12          HG23      THR  12  25.090  37.098  13.798
  110    H    ILE  13           HN       ILE  13  27.267  37.352  13.807
  111    HA   ILE  13           HA       ILE  13  28.761  39.393  12.283
  112    HB   ILE  13           HB       ILE  13  30.265  38.825  14.186
  113   HG12  ILE  13          HG12      ILE  13  31.257  37.562  11.617
  114   HG13  ILE  13          HG11      ILE  13  31.091  39.306  11.824
  115   HG21  ILE  13          HG21      ILE  13  30.328  36.033  13.036
  116   HG22  ILE  13          HG22      ILE  13  29.293  36.473  14.398
  117   HG23  ILE  13          HG23      ILE  13  31.046  36.602  14.542
  118   HD11  ILE  13          HD11      ILE  13  32.757  37.491  13.593
  119   HD12  ILE  13          HD12      ILE  13  32.616  39.243  13.748
  120   HD13  ILE  13          HD13      ILE  13  33.395  38.541  12.329
  121    H    THR  14           HN       THR  14  29.388  38.572  10.202
  122    HA   THR  14           HA       THR  14  28.213  35.885   9.525
  123    HB   THR  14           HB       THR  14  27.776  36.816   7.287
  124    HG1  THR  14           HG1      THR  14  28.328  39.382   8.220
  125   HG21  THR  14          HG21      THR  14  26.079  37.020   9.114
  126   HG22  THR  14          HG22      THR  14  25.950  38.297   7.903
  127   HG23  THR  14          HG23      THR  14  26.705  38.632   9.461
  128    H    LEU  15           HN       LEU  15  29.523  34.469   8.449
  129    HA   LEU  15           HA       LEU  15  32.200  35.442   7.490
  130    HB2  LEU  15           HB2      LEU  15  31.637  32.788   8.851
  131    HB3  LEU  15           HB1      LEU  15  33.210  33.394   8.337
  132    HG   LEU  15           HG       LEU  15  31.509  34.915  10.328
  133   HD11  LEU  15          HD11      LEU  15  31.891  32.608  11.178
  134   HD12  LEU  15          HD12      LEU  15  32.757  33.818  12.124
  135   HD13  LEU  15          HD13      LEU  15  33.626  32.832  10.947
  136   HD21  LEU  15          HD21      LEU  15  34.466  34.849   9.642
  137   HD22  LEU  15          HD22      LEU  15  33.796  35.732  11.011
  138   HD23  LEU  15          HD23      LEU  15  33.344  36.182   9.369
  139    H    GLU  16           HN       GLU  16  32.209  35.149   5.304
  140    HA   GLU  16           HA       GLU  16  30.501  33.032   4.119
  141    HB2  GLU  16           HB2      GLU  16  31.463  34.143   1.945
  142    HB3  GLU  16           HB1      GLU  16  30.272  35.022   2.902
  143    HG2  GLU  16           HG2      GLU  16  31.981  36.344   3.964
  144    HG3  GLU  16           HG1      GLU  16  33.261  35.354   3.263
  145    H    VAL  17           HN       VAL  17  31.430  31.049   4.042
  146    HA   VAL  17           HA       VAL  17  33.967  30.704   2.643
  147    HB   VAL  17           HB       VAL  17  34.858  31.173   4.850
  148   HG11  VAL  17          HG11      VAL  17  33.028  28.969   5.845
  149   HG12  VAL  17          HG12      VAL  17  32.748  30.693   6.089
  150   HG13  VAL  17          HG13      VAL  17  34.151  29.915   6.821
  151   HG21  VAL  17          HG21      VAL  17  34.833  28.162   4.557
  152   HG22  VAL  17          HG22      VAL  17  36.126  29.176   5.196
  153   HG23  VAL  17          HG23      VAL  17  35.749  29.209   3.474
  154    H    GLU  18           HN       GLU  18  34.285  28.487   2.031
  155    HA   GLU  18           HA       GLU  18  32.049  26.999   1.364
  156    HB2  GLU  18           HB2      GLU  18  34.868  26.116   2.000
  157    HB3  GLU  18           HB1      GLU  18  33.652  24.973   1.436
  158    HG2  GLU  18           HG2      GLU  18  34.902  25.788  -0.484
  159    HG3  GLU  18           HG1      GLU  18  33.266  26.445  -0.556
  160    HA   PRO  19           HA       PRO  19  30.526  25.344   5.200
  161    HB2  PRO  19           HB2      PRO  19  29.288  23.052   4.359
  162    HB3  PRO  19           HB1      PRO  19  28.649  24.671   4.010
  163    HG2  PRO  19           HG2      PRO  19  30.260  22.864   2.256
  164    HG3  PRO  19           HG1      PRO  19  28.829  23.830   1.857
  165    HD2  PRO  19           HD2      PRO  19  31.351  24.656   1.238
  166    HD3  PRO  19           HD1      PRO  19  30.053  25.801   1.639
  167    H    SER  20           HN       SER  20  32.836  23.609   3.321
  168    HA   SER  20           HA       SER  20  33.143  21.395   5.212
  169    HB2  SER  20           HB2      SER  20  35.243  20.973   3.815
  170    HB3  SER  20           HB1      SER  20  33.708  20.886   2.957
  171    HG   SER  20           HG       SER  20  34.072  23.091   2.343
  172    H    ASP  21           HN       ASP  21  33.725  24.526   5.645
  173    HA   ASP  21           HA       ASP  21  36.414  24.873   6.359
  174    HB2  ASP  21           HB2      ASP  21  34.420  26.546   6.537
  175    HB3  ASP  21           HB1      ASP  21  34.203  25.882   8.155
  176    H    THR  22           HN       THR  22  37.373  24.788   8.622
  177    HA   THR  22           HA       THR  22  36.559  22.250   9.953
  178    HB   THR  22           HB       THR  22  39.082  23.846  10.443
  179    HG1  THR  22           HG1      THR  22  38.490  21.952   8.428
  180   HG21  THR  22          HG21      THR  22  39.939  21.570  11.012
  181   HG22  THR  22          HG22      THR  22  38.316  20.933  10.752
  182   HG23  THR  22          HG23      THR  22  38.612  22.087  12.051
  183    H    ILE  23           HN       ILE  23  36.755  22.292  12.399
  184    HA   ILE  23           HA       ILE  23  35.166  24.429  13.489
  185    HB   ILE  23           HB       ILE  23  36.844  22.322  14.866
  186   HG12  ILE  23          HG12      ILE  23  33.850  22.404  14.425
  187   HG13  ILE  23          HG11      ILE  23  34.951  21.607  13.300
  188   HG21  ILE  23          HG21      ILE  23  36.418  24.054  16.457
  189   HG22  ILE  23          HG22      ILE  23  35.196  22.818  16.757
  190   HG23  ILE  23          HG23      ILE  23  34.771  24.283  15.871
  191   HD11  ILE  23          HD11      ILE  23  34.740  20.997  16.253
  192   HD12  ILE  23          HD12      ILE  23  35.785  20.179  15.094
  193   HD13  ILE  23          HD13      ILE  23  34.035  20.025  14.965
  194    H    GLU  24           HN       GLU  24  38.618  23.592  13.797
  195    HA   GLU  24           HA       GLU  24  39.302  25.856  15.428
  196    HB2  GLU  24           HB2      GLU  24  41.665  25.320  14.458
  197    HB3  GLU  24           HB1      GLU  24  40.881  24.108  15.471
  198    HG2  GLU  24           HG2      GLU  24  40.227  22.806  13.591
  199    HG3  GLU  24           HG1      GLU  24  40.579  24.117  12.464
  200    H    ASN  25           HN       ASN  25  38.859  25.420  11.989
  201    HA   ASN  25           HA       ASN  25  40.328  27.718  11.115
  202    HB2  ASN  25           HB2      ASN  25  38.109  26.021   9.973
  203    HB3  ASN  25           HB1      ASN  25  38.652  27.466   9.139
  204   HD21  ASN  25          HD21      ASN  25  39.007  24.805   8.055
  205   HD22  ASN  25          HD22      ASN  25  40.674  24.494   7.985
  206    H    VAL  26           HN       VAL  26  36.963  27.152  12.088
  207    HA   VAL  26           HA       VAL  26  36.033  29.825  11.550
  208    HB   VAL  26           HB       VAL  26  35.038  27.789  13.574
  209   HG11  VAL  26          HG11      VAL  26  33.732  30.230  12.334
  210   HG12  VAL  26          HG12      VAL  26  34.182  30.035  14.026
  211   HG13  VAL  26          HG13      VAL  26  32.897  29.046  13.337
  212   HG21  VAL  26          HG21      VAL  26  33.942  28.351  10.814
  213   HG22  VAL  26          HG22      VAL  26  33.585  26.986  11.873
  214   HG23  VAL  26          HG23      VAL  26  35.164  27.115  11.102
  215    H    LYS  27           HN       LYS  27  36.914  28.205  14.597
  216    HA   LYS  27           HA       LYS  27  36.804  30.381  16.338
  217    HB2  LYS  27           HB2      LYS  27  38.806  28.102  16.242
  218    HB3  LYS  27           HB1      LYS  27  38.641  29.209  17.606
  219    HG2  LYS  27           HG2      LYS  27  36.179  28.566  17.673
  220    HG3  LYS  27           HG1      LYS  27  36.572  27.285  16.528
  221    HD2  LYS  27           HD2      LYS  27  38.108  26.263  18.080
  222    HD3  LYS  27           HD1      LYS  27  37.976  27.628  19.190
  223    HE2  LYS  27           HE2      LYS  27  36.591  25.753  19.972
  224    HE3  LYS  27           HE1      LYS  27  35.577  27.122  19.517
  225    HZ1  LYS  27           HZ1      LYS  27  35.590  25.931  17.220
  226    HZ2  LYS  27           HZ2      LYS  27  34.530  25.416  18.443
  227    HZ3  LYS  27           HZ3      LYS  27  35.967  24.558  18.143
  228    H    ALA  28           HN       ALA  28  39.543  29.427  14.248
  229    HA   ALA  28           HA       ALA  28  41.232  31.614  15.063
  230    HB1  ALA  28           HB1      ALA  28  42.386  31.088  12.822
  231    HB2  ALA  28           HB2      ALA  28  41.193  29.801  12.643
  232    HB3  ALA  28           HB3      ALA  28  42.316  29.779  14.004
  233    H    LYS  29           HN       LYS  29  39.295  31.108  12.108
  234    HA   LYS  29           HA       LYS  29  39.663  33.554  10.851
  235    HB2  LYS  29           HB2      LYS  29  37.221  31.800  11.080
  236    HB3  LYS  29           HB1      LYS  29  37.189  33.281  10.122
  237    HG2  LYS  29           HG2      LYS  29  38.793  32.497   8.597
  238    HG3  LYS  29           HG1      LYS  29  39.410  31.280   9.715
  239    HD2  LYS  29           HD2      LYS  29  37.289  30.041   9.526
  240    HD3  LYS  29           HD1      LYS  29  36.693  31.235   8.373
  241    HE2  LYS  29           HE2      LYS  29  39.204  29.579   7.983
  242    HE3  LYS  29           HE1      LYS  29  37.640  29.204   7.260
  243    HZ1  LYS  29           HZ1      LYS  29  39.592  31.017   6.367
  244    HZ2  LYS  29           HZ2      LYS  29  38.183  31.886   6.747
  245    HZ3  LYS  29           HZ3      LYS  29  38.119  30.605   5.634
  246    H    ILE  30           HN       ILE  30  37.440  32.883  13.584
  247    HA   ILE  30           HA       ILE  30  36.395  35.584  13.613
  248    HB   ILE  30           HB       ILE  30  36.364  33.327  15.642
  249   HG12  ILE  30          HG12      ILE  30  34.135  34.447  13.920
  250   HG13  ILE  30          HG11      ILE  30  35.122  33.066  13.441
  251   HG21  ILE  30          HG21      ILE  30  36.104  35.374  16.884
  252   HG22  ILE  30          HG22      ILE  30  34.481  34.720  16.655
  253   HG23  ILE  30          HG23      ILE  30  35.044  36.055  15.651
  254   HD11  ILE  30          HD11      ILE  30  34.451  31.885  15.515
  255   HD12  ILE  30          HD12      ILE  30  33.053  32.297  14.520
  256   HD13  ILE  30          HD13      ILE  30  33.429  33.255  15.952
  257    H    GLN  31           HN       GLN  31  38.849  33.807  15.485
  258    HA   GLN  31           HA       GLN  31  39.526  35.681  17.411
  259    HB2  GLN  31           HB2      GLN  31  40.595  33.529  17.371
  260    HB3  GLN  31           HB1      GLN  31  41.288  33.833  15.784
  261    HG2  GLN  31           HG2      GLN  31  41.933  35.709  18.035
  262    HG3  GLN  31           HG1      GLN  31  42.763  34.157  17.962
  263   HE21  GLN  31          HE21      GLN  31  43.751  37.019  17.418
  264   HE22  GLN  31          HE22      GLN  31  44.466  36.925  15.881
  265    H    ASP  32           HN       ASP  32  40.837  35.510  14.101
  266    HA   ASP  32           HA       ASP  32  42.484  37.840  14.343
  267    HB2  ASP  32           HB2      ASP  32  42.713  36.077  12.574
  268    HB3  ASP  32           HB1      ASP  32  41.253  36.712  11.814
  269    H    LYS  33           HN       LYS  33  39.074  37.436  13.474
  270    HA   LYS  33           HA       LYS  33  38.835  40.193  12.534
  271    HB2  LYS  33           HB2      LYS  33  36.769  38.104  13.164
  272    HB3  LYS  33           HB1      LYS  33  36.428  39.653  12.400
  273    HG2  LYS  33           HG2      LYS  33  37.871  39.098  10.529
  274    HG3  LYS  33           HG1      LYS  33  38.372  37.604  11.309
  275    HD2  LYS  33           HD2      LYS  33  36.077  36.753  11.214
  276    HD3  LYS  33           HD1      LYS  33  35.535  38.258  10.469
  277    HE2  LYS  33           HE2      LYS  33  37.608  36.388   9.284
  278    HE3  LYS  33           HE1      LYS  33  35.920  36.471   8.780
  279    HZ1  LYS  33           HZ1      LYS  33  38.034  38.051   7.911
  280    HZ2  LYS  33           HZ2      LYS  33  37.014  39.062   8.817
  281    HZ3  LYS  33           HZ3      LYS  33  36.395  38.190   7.497
  282    H    GLU  34           HN       GLU  34  37.820  38.410  15.462
  283    HA   GLU  34           HA       GLU  34  36.899  40.952  16.675
  284    HB2  GLU  34           HB2      GLU  34  36.844  38.136  17.806
  285    HB3  GLU  34           HB1      GLU  34  36.022  39.550  18.463
  286    HG2  GLU  34           HG2      GLU  34  34.703  39.759  16.391
  287    HG3  GLU  34           HG1      GLU  34  35.518  38.342  15.730
  288    H    GLY  35           HN       GLY  35  39.544  38.614  16.953
  289    HA2  GLY  35           HA3      GLY  35  41.676  39.170  17.880
  290    HA3  GLY  35           HA2      GLY  35  40.942  40.519  18.750
  291    H    ILE  36           HN       ILE  36  39.123  37.668  18.897
  292    HA   ILE  36           HA       ILE  36  39.817  37.289  21.737
  293    HB   ILE  36           HB       ILE  36  37.640  36.019  20.084
  294   HG12  ILE  36          HG12      ILE  36  37.632  38.520  21.802
  295   HG13  ILE  36          HG11      ILE  36  37.460  38.472  20.046
  296   HG21  ILE  36          HG21      ILE  36  38.314  34.958  22.281
  297   HG22  ILE  36          HG22      ILE  36  36.644  35.513  22.215
  298   HG23  ILE  36          HG23      ILE  36  37.858  36.467  23.067
  299   HD11  ILE  36          HD11      ILE  36  35.250  38.640  20.946
  300   HD12  ILE  36          HD12      ILE  36  35.568  37.356  22.111
  301   HD13  ILE  36          HD13      ILE  36  35.453  36.978  20.393
  302    HA   PRO  37           HA       PRO  37  42.587  33.918  20.284
  303    HB2  PRO  37           HB2      PRO  37  42.210  33.180  23.174
  304    HB3  PRO  37           HB1      PRO  37  43.700  33.210  22.211
  305    HG2  PRO  37           HG2      PRO  37  43.153  35.161  23.930
  306    HG3  PRO  37           HG1      PRO  37  43.911  35.507  22.365
  307    HD2  PRO  37           HD2      PRO  37  41.103  36.031  23.247
  308    HD3  PRO  37           HD1      PRO  37  42.098  36.912  22.065
  309    HA   PRO  38           HA       PRO  38  39.579  30.681  19.744
  310    HB2  PRO  38           HB2      PRO  38  41.115  28.538  19.200
  311    HB3  PRO  38           HB1      PRO  38  41.056  29.938  18.104
  312    HG2  PRO  38           HG2      PRO  38  43.042  29.316  20.239
  313    HG3  PRO  38           HG1      PRO  38  43.346  29.760  18.548
  314    HD2  PRO  38           HD2      PRO  38  43.492  31.590  20.542
  315    HD3  PRO  38           HD1      PRO  38  42.866  32.023  18.934
  316    H    ASP  39           HN       ASP  39  42.095  30.106  22.146
  317    HA   ASP  39           HA       ASP  39  40.806  27.796  23.330
  318    HB2  ASP  39           HB2      ASP  39  43.263  28.428  23.552
  319    HB3  ASP  39           HB1      ASP  39  42.749  29.670  24.693
  320    H    GLN  40           HN       GLN  40  40.321  31.200  23.554
  321    HA   GLN  40           HA       GLN  40  38.867  30.999  26.126
  322    HB2  GLN  40           HB2      GLN  40  39.438  33.352  24.300
  323    HB3  GLN  40           HB1      GLN  40  38.646  33.452  25.870
  324    HG2  GLN  40           HG2      GLN  40  40.695  32.327  26.857
  325    HG3  GLN  40           HG1      GLN  40  41.479  32.568  25.300
  326   HE21  GLN  40          HE21      GLN  40  39.532  35.164  25.366
  327   HE22  GLN  40          HE22      GLN  40  40.517  36.284  26.176
  328    H    GLN  41           HN       GLN  41  38.099  30.185  23.069
  329    HA   GLN  41           HA       GLN  41  35.257  31.120  23.358
  330    HB2  GLN  41           HB2      GLN  41  36.824  30.773  20.785
  331    HB3  GLN  41           HB1      GLN  41  35.134  31.264  20.914
  332    HG2  GLN  41           HG2      GLN  41  35.786  33.278  22.147
  333    HG3  GLN  41           HG1      GLN  41  37.477  32.779  22.100
  334   HE21  GLN  41          HE21      GLN  41  38.570  32.802  19.975
  335   HE22  GLN  41          HE22      GLN  41  37.940  33.718  18.693
  336    H    ARG  42           HN       ARG  42  33.739  29.560  23.164
  337    HA   ARG  42           HA       ARG  42  34.520  26.871  22.101
  338    HB2  ARG  42           HB2      ARG  42  33.115  27.542  24.695
  339    HB3  ARG  42           HB1      ARG  42  32.940  25.964  23.935
  340    HG2  ARG  42           HG2      ARG  42  35.629  27.203  24.583
  341    HG3  ARG  42           HG1      ARG  42  34.777  26.134  25.694
  342    HD2  ARG  42           HD2      ARG  42  34.694  24.534  23.554
  343    HD3  ARG  42           HD1      ARG  42  36.096  25.489  23.078
  344    HE   ARG  42           HE       ARG  42  37.323  24.518  24.859
  345   HH11  ARG  42          HH11      ARG  42  37.560  22.969  26.485
  346   HH12  ARG  42          HH12      ARG  42  36.161  22.154  27.100
  347   HH21  ARG  42          HH21      ARG  42  33.944  23.837  25.032
  348   HH22  ARG  42          HH22      ARG  42  34.115  22.646  26.277
  349    H    LEU  43           HN       LEU  43  33.059  26.256  20.515
  350    HA   LEU  43           HA       LEU  43  30.688  27.950  20.133
  351    HB2  LEU  43           HB2      LEU  43  31.495  25.570  18.476
  352    HB3  LEU  43           HB1      LEU  43  30.492  26.951  18.000
  353    HG   LEU  43           HG       LEU  43  33.478  26.887  18.512
  354   HD11  LEU  43          HD11      LEU  43  32.671  26.307  16.264
  355   HD12  LEU  43          HD12      LEU  43  33.504  27.863  16.241
  356   HD13  LEU  43          HD13      LEU  43  31.740  27.803  16.214
  357   HD21  LEU  43          HD21      LEU  43  32.778  28.883  19.628
  358   HD22  LEU  43          HD22      LEU  43  31.575  29.226  18.386
  359   HD23  LEU  43          HD23      LEU  43  33.289  29.404  18.020
  360    H    ILE  44           HN       ILE  44  28.601  27.296  20.280
  361    HA   ILE  44           HA       ILE  44  28.032  24.535  21.333
  362    HB   ILE  44           HB       ILE  44  26.603  27.130  22.014
  363   HG12  ILE  44          HG12      ILE  44  28.780  27.052  23.109
  364   HG13  ILE  44          HG11      ILE  44  27.525  26.740  24.303
  365   HG21  ILE  44          HG21      ILE  44  25.440  25.664  23.708
  366   HG22  ILE  44          HG22      ILE  44  26.226  24.267  22.972
  367   HG23  ILE  44          HG23      ILE  44  25.073  25.221  22.038
  368   HD11  ILE  44          HD11      ILE  44  28.011  24.197  23.654
  369   HD12  ILE  44          HD12      ILE  44  29.017  25.045  24.824
  370   HD13  ILE  44          HD13      ILE  44  29.564  24.867  23.160
  371    H    PHE  45           HN       PHE  45  26.431  23.439  20.201
  372    HA   PHE  45           HA       PHE  45  24.711  25.005  18.324
  373    HB2  PHE  45           HB2      PHE  45  26.494  24.201  16.931
  374    HB3  PHE  45           HB1      PHE  45  26.437  22.603  17.673
  375    HD1  PHE  45           HD1      PHE  45  24.390  25.021  15.685
  376    HD2  PHE  45           HD2      PHE  45  25.047  20.928  16.788
  377    HE1  PHE  45           HE1      PHE  45  22.714  24.303  14.003
  378    HE2  PHE  45           HE2      PHE  45  23.370  20.202  15.107
  379    HZ   PHE  45           HZ       PHE  45  22.203  21.892  13.714
  380    H    ALA  46           HN       ALA  46  22.719  24.607  19.110
  381    HA   ALA  46           HA       ALA  46  20.889  23.448  20.016
  382    HB1  ALA  46           HB1      ALA  46  22.027  21.405  18.092
  383    HB2  ALA  46           HB2      ALA  46  20.820  22.638  17.729
  384    HB3  ALA  46           HB3      ALA  46  20.421  21.308  18.816
  385    H    GLY  47           HN       GLY  47  22.921  23.327  21.893
  386    HA2  GLY  47           HA3      GLY  47  23.431  22.106  23.819
  387    HA3  GLY  47           HA2      GLY  47  22.226  20.927  23.311
  388    H    LYS  48           HN       LYS  48  24.272  21.171  20.716
  389    HA   LYS  48           HA       LYS  48  25.661  18.696  21.515
  390    HB2  LYS  48           HB2      LYS  48  25.739  20.161  18.891
  391    HB3  LYS  48           HB1      LYS  48  26.287  18.518  19.187
  392    HG2  LYS  48           HG2      LYS  48  23.873  18.058  19.985
  393    HG3  LYS  48           HG1      LYS  48  23.460  19.581  19.198
  394    HD2  LYS  48           HD2      LYS  48  24.584  18.657  17.104
  395    HD3  LYS  48           HD1      LYS  48  24.622  17.097  17.922
  396    HE2  LYS  48           HE2      LYS  48  22.132  18.738  17.375
  397    HE3  LYS  48           HE1      LYS  48  22.618  17.287  16.500
  398    HZ1  LYS  48           HZ1      LYS  48  22.195  15.947  18.301
  399    HZ2  LYS  48           HZ2      LYS  48  20.959  17.103  18.455
  400    HZ3  LYS  48           HZ3      LYS  48  22.349  17.205  19.427
  401    H    GLN  49           HN       GLN  49  28.023  18.522  20.886
  402    HA   GLN  49           HA       GLN  49  29.505  21.054  21.353
  403    HB2  GLN  49           HB2      GLN  49  29.899  18.398  22.670
  404    HB3  GLN  49           HB1      GLN  49  31.142  19.640  22.675
  405    HG2  GLN  49           HG2      GLN  49  29.631  21.195  23.795
  406    HG3  GLN  49           HG1      GLN  49  28.316  20.023  23.706
  407   HE21  GLN  49          HE21      GLN  49  30.051  21.255  26.044
  408   HE22  GLN  49          HE22      GLN  49  30.439  19.889  26.973
  409    H    LEU  50           HN       LEU  50  30.960  21.409  19.753
  410    HA   LEU  50           HA       LEU  50  31.608  19.192  17.893
  411    HB2  LEU  50           HB2      LEU  50  32.510  22.074  17.706
  412    HB3  LEU  50           HB1      LEU  50  32.398  20.887  16.406
  413    HG   LEU  50           HG       LEU  50  30.058  22.029  17.961
  414   HD11  LEU  50          HD11      LEU  50  31.147  23.594  16.342
  415   HD12  LEU  50          HD12      LEU  50  29.502  23.165  15.877
  416   HD13  LEU  50          HD13      LEU  50  30.874  22.411  15.064
  417   HD21  LEU  50          HD21      LEU  50  30.294  19.929  15.798
  418   HD22  LEU  50          HD22      LEU  50  28.800  20.837  16.033
  419   HD23  LEU  50          HD23      LEU  50  29.432  19.829  17.334
  420    H    GLU  51           HN       GLU  51  33.479  18.072  18.087
  421    HA   GLU  51           HA       GLU  51  35.582  19.084  19.929
  422    HB2  GLU  51           HB2      GLU  51  36.496  16.818  19.793
  423    HB3  GLU  51           HB1      GLU  51  34.772  16.738  20.156
  424    HG2  GLU  51           HG2      GLU  51  34.390  16.501  17.643
  425    HG3  GLU  51           HG1      GLU  51  36.129  16.246  17.499
  426    H    ASP  52           HN       ASP  52  37.629  19.646  19.209
  427    HA   ASP  52           HA       ASP  52  38.006  20.549  16.559
  428    HB2  ASP  52           HB2      ASP  52  39.999  19.774  18.701
  429    HB3  ASP  52           HB1      ASP  52  40.480  20.496  17.164
  430    H    GLY  53           HN       GLY  53  39.383  19.685  14.855
  431    HA2  GLY  53           HA3      GLY  53  40.505  17.927  13.684
  432    HA3  GLY  53           HA2      GLY  53  40.083  16.814  14.985
  433    H    ARG  54           HN       ARG  54  37.764  18.947  13.426
  434    HA   ARG  54           HA       ARG  54  36.720  16.780  11.720
  435    HB2  ARG  54           HB2      ARG  54  35.191  17.815  14.120
  436    HB3  ARG  54           HB1      ARG  54  34.426  16.949  12.788
  437    HG2  ARG  54           HG2      ARG  54  36.145  15.090  13.198
  438    HG3  ARG  54           HG1      ARG  54  36.528  15.920  14.707
  439    HD2  ARG  54           HD2      ARG  54  34.199  15.735  15.433
  440    HD3  ARG  54           HD1      ARG  54  33.766  14.967  13.906
  441    HE   ARG  54           HE       ARG  54  35.887  13.521  15.239
  442   HH11  ARG  54          HH11      ARG  54  35.329  11.534  16.161
  443   HH12  ARG  54          HH12      ARG  54  33.663  11.161  16.440
  444   HH21  ARG  54          HH21      ARG  54  32.504  14.174  15.174
  445   HH22  ARG  54          HH22      ARG  54  32.060  12.656  15.879
  446    H    THR  55           HN       THR  55  35.114  17.498  10.241
  447    HA   THR  55           HA       THR  55  34.954  20.479   9.922
  448    HB   THR  55           HB       THR  55  35.194  18.203   7.951
  449    HG1  THR  55           HG1      THR  55  36.470  20.701   8.334
  450   HG21  THR  55          HG21      THR  55  34.783  20.021   6.180
  451   HG22  THR  55          HG22      THR  55  34.012  20.940   7.472
  452   HG23  THR  55          HG23      THR  55  33.365  19.371   7.000
  453    H    LEU  56           HN       LEU  56  32.859  21.296   9.146
  454    HA   LEU  56           HA       LEU  56  30.603  20.159  10.397
  455    HB2  LEU  56           HB2      LEU  56  30.693  21.949   7.949
  456    HB3  LEU  56           HB1      LEU  56  29.287  21.700   8.980
  457    HG   LEU  56           HG       LEU  56  31.894  22.655  10.175
  458   HD11  LEU  56          HD11      LEU  56  30.879  24.997   9.932
  459   HD12  LEU  56          HD12      LEU  56  29.825  24.295   8.704
  460   HD13  LEU  56          HD13      LEU  56  31.574  24.286   8.475
  461   HD21  LEU  56          HD21      LEU  56  28.960  22.953  10.907
  462   HD22  LEU  56          HD22      LEU  56  30.277  23.746  11.769
  463   HD23  LEU  56          HD23      LEU  56  30.169  21.988  11.754
  464    H    SER  57           HN       SER  57  31.646  19.907   6.986
  465    HA   SER  57           HA       SER  57  29.465  18.228   6.160
  466    HB2  SER  57           HB2      SER  57  32.306  18.422   5.104
  467    HB3  SER  57           HB1      SER  57  31.002  17.549   4.301
  468    HG   SER  57           HG       SER  57  30.527  20.186   5.073
  469    H    ASP  58           HN       ASP  58  32.771  17.486   7.208
  470    HA   ASP  58           HA       ASP  58  32.728  14.702   7.144
  471    HB2  ASP  58           HB2      ASP  58  34.729  15.913   7.819
  472    HB3  ASP  58           HB1      ASP  58  33.929  16.488   9.281
  473    H    TYR  59           HN       TYR  59  31.161  16.836   9.513
  474    HA   TYR  59           HA       TYR  59  30.418  14.644  11.281
  475    HB2  TYR  59           HB2      TYR  59  29.974  17.567  11.122
  476    HB3  TYR  59           HB1      TYR  59  28.594  16.701  11.785
  477    HD1  TYR  59           HD1      TYR  59  31.403  18.423  12.760
  478    HD2  TYR  59           HD2      TYR  59  29.481  14.637  13.427
  479    HE1  TYR  59           HE1      TYR  59  32.527  18.239  14.963
  480    HE2  TYR  59           HE2      TYR  59  30.609  14.453  15.627
  481    HH   TYR  59           HH       TYR  59  32.582  15.334  16.763
  482    H    ASN  60           HN       ASN  60  29.150  15.984   8.334
  483    HA   ASN  60           HA       ASN  60  27.275  15.401   7.058
  484    HB2  ASN  60           HB2      ASN  60  27.063  12.946   8.816
  485    HB3  ASN  60           HB1      ASN  60  26.549  13.130   7.140
  486   HD21  ASN  60          HD21      ASN  60  28.599  14.000   5.709
  487   HD22  ASN  60          HD22      ASN  60  30.015  13.092   5.938
  488    H    ILE  61           HN       ILE  61  26.636  17.266   8.838
  489    HA   ILE  61           HA       ILE  61  24.504  16.399  10.652
  490    HB   ILE  61           HB       ILE  61  25.150  19.233   9.808
  491   HG12  ILE  61          HG12      ILE  61  26.423  17.556  11.996
  492   HG13  ILE  61          HG11      ILE  61  27.225  18.119  10.528
  493   HG21  ILE  61          HG21      ILE  61  24.170  19.824  11.924
  494   HG22  ILE  61          HG22      ILE  61  24.111  18.137  12.433
  495   HG23  ILE  61          HG23      ILE  61  23.055  18.703  11.140
  496   HD11  ILE  61          HD11      ILE  61  27.833  19.675  12.239
  497   HD12  ILE  61          HD12      ILE  61  26.171  19.789  12.818
  498   HD13  ILE  61          HD13      ILE  61  26.612  20.486  11.259
  499    H    GLN  62           HN       GLN  62  22.376  16.253  10.113
  500    HA   GLN  62           HA       GLN  62  21.541  17.058   7.386
  501    HB2  GLN  62           HB2      GLN  62  20.034  15.586   9.572
  502    HB3  GLN  62           HB1      GLN  62  19.477  15.814   7.913
  503    HG2  GLN  62           HG2      GLN  62  21.409  14.559   7.068
  504    HG3  GLN  62           HG1      GLN  62  22.020  14.366   8.712
  505   HE21  GLN  62          HE21      GLN  62  21.661  11.968   7.637
  506   HE22  GLN  62          HE22      GLN  62  20.196  11.240   8.091
  507    H    LYS  63           HN       LYS  63  21.942  19.391   8.364
  508    HA   LYS  63           HA       LYS  63  19.924  20.439  10.153
  509    HB2  LYS  63           HB2      LYS  63  22.206  21.468   9.719
  510    HB3  LYS  63           HB1      LYS  63  21.590  21.991   8.155
  511    HG2  LYS  63           HG2      LYS  63  21.152  23.882   9.451
  512    HG3  LYS  63           HG1      LYS  63  19.621  23.023   9.590
  513    HD2  LYS  63           HD2      LYS  63  20.314  22.080  11.747
  514    HD3  LYS  63           HD1      LYS  63  21.896  22.844  11.592
  515    HE2  LYS  63           HE2      LYS  63  19.243  24.307  11.734
  516    HE3  LYS  63           HE1      LYS  63  20.411  24.173  13.048
  517    HZ1  LYS  63           HZ1      LYS  63  20.379  25.997  10.904
  518    HZ2  LYS  63           HZ2      LYS  63  21.794  25.061  10.810
  519    HZ3  LYS  63           HZ3      LYS  63  21.440  25.932  12.225
  520    H    GLU  64           HN       GLU  64  20.176  20.047   6.671
  521    HA   GLU  64           HA       GLU  64  18.638  20.510   4.958
  522    HB2  GLU  64           HB2      GLU  64  17.364  18.936   6.591
  523    HB3  GLU  64           HB1      GLU  64  16.496  20.388   7.088
  524    HG2  GLU  64           HG2      GLU  64  15.781  20.783   4.775
  525    HG3  GLU  64           HG1      GLU  64  16.702  19.380   4.234
  526    H    SEP  65           HN       SEP  65  19.802  22.785   6.322
  527    HA   SEP  65           HA       SEP  65  18.202  24.891   5.293
  528    HB2  SEP  65           HB1      SEP  65  17.738  24.172   8.171
  529    HB3  SEP  65           HB2      SEP  65  16.575  24.697   6.958
  530    H    TPO  66           HN       TPO  66  18.943  27.082   6.523
  531    HA   TPO  66           HA       TPO  66  21.706  27.381   6.096
  532    HB   TPO  66           HB       TPO  66  20.071  28.984   8.082
  533   HG21  TPO  66          HG21      TPO  66  21.609  30.783   7.495
  534   HG22  TPO  66          HG22      TPO  66  22.408  29.750   6.311
  535   HG23  TPO  66          HG23      TPO  66  22.533  29.381   8.031
  536    H    LEU  67           HN       LEU  67  23.507  27.461   7.540
  537    HA   LEU  67           HA       LEU  67  23.226  25.674   9.885
  538    HB2  LEU  67           HB2      LEU  67  25.755  26.989   8.869
  539    HB3  LEU  67           HB1      LEU  67  25.612  25.540   9.863
  540    HG   LEU  67           HG       LEU  67  24.653  25.807   6.997
  541   HD11  LEU  67          HD11      LEU  67  27.089  25.731   7.127
  542   HD12  LEU  67          HD12      LEU  67  26.491  24.175   6.550
  543   HD13  LEU  67          HD13      LEU  67  27.014  24.351   8.224
  544   HD21  LEU  67          HD21      LEU  67  24.542  23.579   9.040
  545   HD22  LEU  67          HD22      LEU  67  24.488  23.242   7.309
  546   HD23  LEU  67          HD23      LEU  67  23.230  24.227   8.054
  547    H    HIS  68           HN       HIS  68  22.777  26.573  11.820
  548    HA   HIS  68           HA       HIS  68  23.591  29.408  12.348
  549    HB2  HIS  68           HB2      HIS  68  21.566  27.637  13.757
  550    HB3  HIS  68           HB1      HIS  68  21.908  29.319  14.158
  551    HD1  HIS  68           HD1      HIS  68  21.553  31.044  12.029
  552    HD2  HIS  68           HD2      HIS  68  19.605  27.361  11.825
  553    HE1  HIS  68           HE1      HIS  68  19.733  31.290  10.282
  554    HE2  HIS  68           HE2      HIS  68  18.542  29.055  10.149
  555    H    LEU  69           HN       LEU  69  25.019  29.847  13.987
  556    HA   LEU  69           HA       LEU  69  25.790  27.650  15.866
  557    HB2  LEU  69           HB2      LEU  69  27.718  29.410  14.317
  558    HB3  LEU  69           HB1      LEU  69  28.175  28.258  15.567
  559    HG   LEU  69           HG       LEU  69  26.685  27.488  13.038
  560   HD11  LEU  69          HD11      LEU  69  29.640  27.198  13.646
  561   HD12  LEU  69          HD12      LEU  69  28.959  28.425  12.577
  562   HD13  LEU  69          HD13      LEU  69  28.818  26.717  12.162
  563   HD21  LEU  69          HD21      LEU  69  26.340  25.775  14.630
  564   HD22  LEU  69          HD22      LEU  69  27.945  25.968  15.330
  565   HD23  LEU  69          HD23      LEU  69  27.757  25.212  13.749
  566    H    VAL  70           HN       VAL  70  26.564  28.430  17.898
  567    HA   VAL  70           HA       VAL  70  26.263  31.383  18.358
  568    HB   VAL  70           HB       VAL  70  25.419  29.133  20.218
  569   HG11  VAL  70          HG11      VAL  70  25.175  32.151  20.405
  570   HG12  VAL  70          HG12      VAL  70  26.179  31.118  21.422
  571   HG13  VAL  70          HG13      VAL  70  24.421  31.014  21.522
  572   HG21  VAL  70          HG21      VAL  70  23.637  31.134  18.811
  573   HG22  VAL  70          HG22      VAL  70  23.159  29.670  19.669
  574   HG23  VAL  70          HG23      VAL  70  23.995  29.552  18.122
  575    H    LEU  71           HN       LEU  71  28.271  32.134  18.920
  576    HA   LEU  71           HA       LEU  71  30.283  30.304  20.005
  577    HB2  LEU  71           HB2      LEU  71  30.729  32.160  18.334
  578    HB3  LEU  71           HB1      LEU  71  30.446  33.310  19.633
  579    HG   LEU  71           HG       LEU  71  32.426  31.127  20.207
  580   HD11  LEU  71          HD11      LEU  71  34.236  32.357  19.053
  581   HD12  LEU  71          HD12      LEU  71  33.040  33.447  18.353
  582   HD13  LEU  71          HD13      LEU  71  33.044  31.740  17.911
  583   HD21  LEU  71          HD21      LEU  71  33.613  33.028  21.292
  584   HD22  LEU  71          HD22      LEU  71  31.961  32.866  21.878
  585   HD23  LEU  71          HD23      LEU  71  32.360  34.123  20.709
  586    H    ARG  72           HN       ARG  72  30.989  30.242  22.134
  587    HA   ARG  72           HA       ARG  72  29.429  31.865  24.108
  588    HB2  ARG  72           HB2      ARG  72  29.442  29.298  24.188
  589    HB3  ARG  72           HB1      ARG  72  31.130  29.430  24.680
  590    HG2  ARG  72           HG2      ARG  72  30.510  30.761  26.624
  591    HG3  ARG  72           HG1      ARG  72  28.825  30.790  26.103
  592    HD2  ARG  72           HD2      ARG  72  28.758  28.305  26.281
  593    HD3  ARG  72           HD1      ARG  72  30.410  28.332  26.902
  594    HE   ARG  72           HE       ARG  72  28.944  30.074  28.546
  595   HH11  ARG  72          HH11      ARG  72  28.066  29.345  30.498
  596   HH12  ARG  72          HH12      ARG  72  27.761  27.655  30.718
  597   HH21  ARG  72          HH21      ARG  72  28.910  26.769  27.568
  598   HH22  ARG  72          HH22      ARG  72  28.239  26.196  29.059
  599    H    LEU  73           HN       LEU  73  30.579  33.048  25.707
  600    HA   LEU  73           HA       LEU  73  33.328  33.782  24.936
  601    HB2  LEU  73           HB2      LEU  73  31.750  34.805  27.308
  602    HB3  LEU  73           HB1      LEU  73  33.098  35.590  26.486
  603    HG   LEU  73           HG       LEU  73  30.379  35.027  25.261
  604   HD11  LEU  73          HD11      LEU  73  31.638  37.688  25.974
  605   HD12  LEU  73          HD12      LEU  73  30.508  36.841  27.030
  606   HD13  LEU  73          HD13      LEU  73  29.984  37.391  25.439
  607   HD21  LEU  73          HD21      LEU  73  31.956  34.983  23.485
  608   HD22  LEU  73          HD22      LEU  73  32.933  36.261  24.206
  609   HD23  LEU  73          HD23      LEU  73  31.365  36.643  23.492
  610    H    ARG  74           HN       ARG  74  35.096  32.886  25.856
  611    HA   ARG  74           HA       ARG  74  36.391  31.540  27.277
  612    HB2  ARG  74           HB2      ARG  74  34.588  32.976  29.241
  613    HB3  ARG  74           HB1      ARG  74  35.930  31.948  29.744
  614    HG2  ARG  74           HG2      ARG  74  37.496  33.340  28.448
  615    HG3  ARG  74           HG1      ARG  74  36.159  34.364  27.924
  616    HD2  ARG  74           HD2      ARG  74  36.837  33.905  30.837
  617    HD3  ARG  74           HD1      ARG  74  37.484  35.252  29.902
  618    HE   ARG  74           HE       ARG  74  34.682  35.300  29.560
  619   HH11  ARG  74          HH11      ARG  74  33.424  36.686  30.827
  620   HH12  ARG  74          HH12      ARG  74  34.042  37.253  32.342
  621   HH21  ARG  74          HH21      ARG  74  37.048  35.545  32.056
  622   HH22  ARG  74          HH22      ARG  74  36.094  36.606  33.040
  623    H    GLY  75           HN       GLY  75  34.415  30.946  29.875
  624    HA2  GLY  75           HA3      GLY  75  32.953  29.168  30.441
  625    HA3  GLY  75           HA2      GLY  75  32.869  28.731  28.733
  626    H    GLY  76           HN       GLY  76  33.124  26.500  29.778
  627    HA2  GLY  76           HA3      GLY  76  35.801  25.555  29.334
  628    HA3  GLY  76           HA2      GLY  76  35.472  25.625  31.066
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1  29.827  27.617   2.008
    2    H2   MET   1           HT2      MET   1  29.657  27.217   3.650
    3    H3   MET   1           HT3      MET   1  30.218  28.756   3.203
    4    HA   MET   1           HA       MET   1  27.911  28.775   1.920
    5    HB2  MET   1           HB2      MET   1  27.493  26.447   2.924
    6    HB3  MET   1           HB1      MET   1  27.309  27.270   4.474
    7    HG2  MET   1           HG2      MET   1  25.489  28.626   3.589
    8    HG3  MET   1           HG1      MET   1  25.719  27.943   1.980
    9    HE1  MET   1           HE1      MET   1  22.366  26.359   2.864
   10    HE2  MET   1           HE2      MET   1  23.313  27.365   1.770
   11    HE3  MET   1           HE3      MET   1  22.900  27.967   3.375
   12    H    GLN   2           HN       GLN   2  26.366  30.289   2.989
   13    HA   GLN   2           HA       GLN   2  27.786  32.214   4.627
   14    HB2  GLN   2           HB2      GLN   2  24.840  32.064   3.915
   15    HB3  GLN   2           HB1      GLN   2  25.669  33.470   4.585
   16    HG2  GLN   2           HG2      GLN   2  27.160  33.515   2.599
   17    HG3  GLN   2           HG1      GLN   2  26.273  32.150   1.922
   18   HE21  GLN   2          HE21      GLN   2  24.763  32.833   0.408
   19   HE22  GLN   2          HE22      GLN   2  23.880  34.282   0.489
   20    H    ILE   3           HN       ILE   3  28.286  31.277   6.638
   21    HA   ILE   3           HA       ILE   3  26.038  30.165   8.256
   22    HB   ILE   3           HB       ILE   3  29.036  30.151   8.709
   23   HG12  ILE   3          HG12      ILE   3  27.141  27.862   8.108
   24   HG13  ILE   3          HG11      ILE   3  28.081  28.689   6.866
   25   HG21  ILE   3          HG21      ILE   3  28.370  28.480  10.520
   26   HG22  ILE   3          HG22      ILE   3  26.717  29.061  10.320
   27   HG23  ILE   3          HG23      ILE   3  27.980  30.166  10.860
   28   HD11  ILE   3          HD11      ILE   3  29.332  27.444   9.325
   29   HD12  ILE   3          HD12      ILE   3  30.155  28.032   7.881
   30   HD13  ILE   3          HD13      ILE   3  29.153  26.583   7.795
   31    H    PHE   4           HN       PHE   4  25.189  31.312   9.911
   32    HA   PHE   4           HA       PHE   4  26.244  34.018  10.449
   33    HB2  PHE   4           HB2      PHE   4  23.751  32.524  11.286
   34    HB3  PHE   4           HB1      PHE   4  24.172  34.098  11.963
   35    HD1  PHE   4           HD1      PHE   4  23.433  32.291   8.793
   36    HD2  PHE   4           HD2      PHE   4  23.866  36.109  10.713
   37    HE1  PHE   4           HE1      PHE   4  22.499  33.407   6.785
   38    HE2  PHE   4           HE2      PHE   4  22.931  37.225   8.706
   39    HZ   PHE   4           HZ       PHE   4  22.248  35.874   6.742
   40    H    VAL   5           HN       VAL   5  26.616  34.737  12.672
   41    HA   VAL   5           HA       VAL   5  27.305  32.563  14.611
   42    HB   VAL   5           HB       VAL   5  29.057  34.924  13.849
   43   HG11  VAL   5          HG11      VAL   5  29.247  34.541  16.219
   44   HG12  VAL   5          HG12      VAL   5  30.660  33.808  15.458
   45   HG13  VAL   5          HG13      VAL   5  29.317  32.796  15.984
   46   HG21  VAL   5          HG21      VAL   5  30.660  33.036  13.269
   47   HG22  VAL   5          HG22      VAL   5  29.265  33.185  12.200
   48   HG23  VAL   5          HG23      VAL   5  29.295  31.932  13.440
   49    H    LYS   6           HN       LYS   6  25.769  33.031  16.154
   50    HA   LYS   6           HA       LYS   6  25.285  35.881  16.892
   51    HB2  LYS   6           HB2      LYS   6  23.332  34.412  16.411
   52    HB3  LYS   6           HB1      LYS   6  23.816  33.371  17.751
   53    HG2  LYS   6           HG2      LYS   6  23.559  35.224  19.328
   54    HG3  LYS   6           HG1      LYS   6  23.165  36.323  18.005
   55    HD2  LYS   6           HD2      LYS   6  21.161  35.014  17.481
   56    HD3  LYS   6           HD1      LYS   6  21.563  33.859  18.752
   57    HE2  LYS   6           HE2      LYS   6  19.893  35.451  19.577
   58    HE3  LYS   6           HE1      LYS   6  21.419  35.688  20.428
   59    HZ1  LYS   6           HZ1      LYS   6  21.224  37.230  18.019
   60    HZ2  LYS   6           HZ2      LYS   6  21.642  37.722  19.591
   61    HZ3  LYS   6           HZ3      LYS   6  20.008  37.615  19.135
   62    H    THR   7           HN       THR   7  26.262  36.689  18.672
   63    HA   THR   7           HA       THR   7  27.637  34.840  20.540
   64    HB   THR   7           HB       THR   7  28.678  36.870  21.435
   65    HG1  THR   7           HG1      THR   7  27.781  38.653  19.675
   66   HG21  THR   7          HG21      THR   7  29.777  35.982  19.500
   67   HG22  THR   7          HG22      THR   7  29.699  37.729  19.274
   68   HG23  THR   7          HG23      THR   7  28.571  36.679  18.418
   69    H    LEU   8           HN       LEU   8  27.306  35.134  22.899
   70    HA   LEU   8           HA       LEU   8  24.509  35.218  23.582
   71    HB2  LEU   8           HB2      LEU   8  26.891  35.452  25.444
   72    HB3  LEU   8           HB1      LEU   8  25.254  34.976  25.891
   73    HG   LEU   8           HG       LEU   8  27.079  33.464  24.000
   74   HD11  LEU   8          HD11      LEU   8  26.239  33.038  26.872
   75   HD12  LEU   8          HD12      LEU   8  27.873  33.128  26.218
   76   HD13  LEU   8          HD13      LEU   8  26.864  31.724  25.875
   77   HD21  LEU   8          HD21      LEU   8  25.177  31.696  24.426
   78   HD22  LEU   8          HD22      LEU   8  24.914  32.964  23.233
   79   HD23  LEU   8          HD23      LEU   8  24.203  33.107  24.840
   80    H    THR   9           HN       THR   9  26.946  37.651  23.305
   81    HA   THR   9           HA       THR   9  25.574  39.580  25.035
   82    HB   THR   9           HB       THR   9  27.271  41.166  24.213
   83    HG1  THR   9           HG1      THR   9  28.533  39.199  22.728
   84   HG21  THR   9          HG21      THR   9  29.313  39.828  24.877
   85   HG22  THR   9          HG22      THR   9  28.274  38.404  24.934
   86   HG23  THR   9          HG23      THR   9  27.977  39.756  26.028
   87    H    GLY  10           HN       GLY  10  24.848  38.310  22.084
   88    HA2  GLY  10           HA3      GLY  10  23.015  39.023  20.714
   89    HA3  GLY  10           HA2      GLY  10  23.166  40.650  21.383
   90    H    LYS  11           HN       LYS  11  26.214  40.265  20.879
   91    HA   LYS  11           HA       LYS  11  26.291  41.703  18.396
   92    HB2  LYS  11           HB2      LYS  11  28.389  40.338  20.085
   93    HB3  LYS  11           HB1      LYS  11  28.808  41.080  18.542
   94    HG2  LYS  11           HG2      LYS  11  27.217  42.671  20.549
   95    HG3  LYS  11           HG1      LYS  11  28.954  42.492  20.782
   96    HD2  LYS  11           HD2      LYS  11  27.925  43.332  18.077
   97    HD3  LYS  11           HD1      LYS  11  28.010  44.523  19.371
   98    HE2  LYS  11           HE2      LYS  11  30.388  42.782  18.729
   99    HE3  LYS  11           HE1      LYS  11  30.076  44.260  17.821
  100    HZ1  LYS  11           HZ1      LYS  11  31.198  45.234  19.469
  101    HZ2  LYS  11           HZ2      LYS  11  31.001  43.921  20.530
  102    HZ3  LYS  11           HZ3      LYS  11  29.764  45.074  20.362
  103    H    THR  12           HN       THR  12  25.332  40.546  16.713
  104    HA   THR  12           HA       THR  12  26.359  37.808  16.116
  105    HB   THR  12           HB       THR  12  24.034  39.365  14.938
  106    HG1  THR  12           HG1      THR  12  23.279  38.731  16.813
  107   HG21  THR  12          HG21      THR  12  23.427  37.119  13.988
  108   HG22  THR  12          HG22      THR  12  25.002  36.526  14.512
  109   HG23  THR  12          HG23      THR  12  24.900  37.802  13.301
  110    H    ILE  13           HN       ILE  13  27.984  37.653  14.618
  111    HA   ILE  13           HA       ILE  13  28.354  39.896  12.676
  112    HB   ILE  13           HB       ILE  13  30.672  39.072  12.498
  113   HG12  ILE  13          HG12      ILE  13  29.747  37.052  14.569
  114   HG13  ILE  13          HG11      ILE  13  30.283  36.695  12.926
  115   HG21  ILE  13          HG21      ILE  13  29.927  39.341  15.418
  116   HG22  ILE  13          HG22      ILE  13  29.915  40.706  14.302
  117   HG23  ILE  13          HG23      ILE  13  31.421  39.849  14.632
  118   HD11  ILE  13          HD11      ILE  13  31.934  37.775  15.216
  119   HD12  ILE  13          HD12      ILE  13  32.491  37.812  13.543
  120   HD13  ILE  13          HD13      ILE  13  32.167  36.268  14.330
  121    H    THR  14           HN       THR  14  28.924  39.278  10.474
  122    HA   THR  14           HA       THR  14  27.579  36.746   9.643
  123    HB   THR  14           HB       THR  14  27.624  37.751   7.379
  124    HG1  THR  14           HG1      THR  14  28.985  39.290   7.038
  125   HG21  THR  14          HG21      THR  14  25.761  38.225   8.980
  126   HG22  THR  14          HG22      THR  14  26.018  39.522   7.812
  127   HG23  THR  14          HG23      THR  14  26.605  39.695   9.467
  128    H    LEU  15           HN       LEU  15  28.849  35.026   9.162
  129    HA   LEU  15           HA       LEU  15  31.669  35.503   8.252
  130    HB2  LEU  15           HB2      LEU  15  31.134  34.430  10.621
  131    HB3  LEU  15           HB1      LEU  15  30.811  32.984   9.672
  132    HG   LEU  15           HG       LEU  15  33.151  33.549   8.554
  133   HD11  LEU  15          HD11      LEU  15  33.325  34.929  11.251
  134   HD12  LEU  15          HD12      LEU  15  33.473  35.704   9.677
  135   HD13  LEU  15          HD13      LEU  15  34.705  34.563  10.217
  136   HD21  LEU  15          HD21      LEU  15  34.262  32.145  10.247
  137   HD22  LEU  15          HD22      LEU  15  32.648  31.527   9.900
  138   HD23  LEU  15          HD23      LEU  15  32.941  32.444  11.377
  139    H    GLU  16           HN       GLU  16  31.754  34.978   6.107
  140    HA   GLU  16           HA       GLU  16  30.011  32.765   5.093
  141    HB2  GLU  16           HB2      GLU  16  31.473  34.971   3.611
  142    HB3  GLU  16           HB1      GLU  16  30.447  33.746   2.866
  143    HG2  GLU  16           HG2      GLU  16  28.528  34.543   4.208
  144    HG3  GLU  16           HG1      GLU  16  29.554  35.782   4.929
  145    H    VAL  17           HN       VAL  17  31.035  30.849   4.858
  146    HA   VAL  17           HA       VAL  17  33.657  30.731   3.557
  147    HB   VAL  17           HB       VAL  17  34.490  31.068   5.759
  148   HG11  VAL  17          HG11      VAL  17  32.326  29.133   6.616
  149   HG12  VAL  17          HG12      VAL  17  32.460  30.841   7.035
  150   HG13  VAL  17          HG13      VAL  17  33.618  29.680   7.684
  151   HG21  VAL  17          HG21      VAL  17  34.340  28.053   5.628
  152   HG22  VAL  17          HG22      VAL  17  35.673  29.061   6.192
  153   HG23  VAL  17          HG23      VAL  17  35.300  28.974   4.470
  154    H    GLU  18           HN       GLU  18  34.047  28.656   2.686
  155    HA   GLU  18           HA       GLU  18  31.863  27.091   1.954
  156    HB2  GLU  18           HB2      GLU  18  34.789  26.392   2.237
  157    HB3  GLU  18           HB1      GLU  18  33.617  25.236   1.604
  158    HG2  GLU  18           HG2      GLU  18  32.978  26.826  -0.161
  159    HG3  GLU  18           HG1      GLU  18  34.118  28.009   0.482
  160    HA   PRO  19           HA       PRO  19  30.875  24.806   5.643
  161    HB2  PRO  19           HB2      PRO  19  29.613  22.624   4.625
  162    HB3  PRO  19           HB1      PRO  19  28.912  24.254   4.524
  163    HG2  PRO  19           HG2      PRO  19  30.425  22.724   2.446
  164    HG3  PRO  19           HG1      PRO  19  28.923  23.653   2.281
  165    HD2  PRO  19           HD2      PRO  19  31.352  24.676   1.566
  166    HD3  PRO  19           HD1      PRO  19  30.032  25.693   2.186
  167    H    SER  20           HN       SER  20  32.872  23.255   3.196
  168    HA   SER  20           HA       SER  20  33.443  20.906   4.807
  169    HB2  SER  20           HB2      SER  20  35.420  20.733   3.130
  170    HB3  SER  20           HB1      SER  20  33.778  20.566   2.514
  171    HG   SER  20           HG       SER  20  34.075  22.320   1.399
  172    H    ASP  21           HN       ASP  21  34.401  24.126   5.019
  173    HA   ASP  21           HA       ASP  21  37.104  24.013   5.798
  174    HB2  ASP  21           HB2      ASP  21  34.764  25.751   6.548
  175    HB3  ASP  21           HB1      ASP  21  36.270  25.928   7.435
  176    H    THR  22           HN       THR  22  38.087  23.677   7.912
  177    HA   THR  22           HA       THR  22  36.684  21.645   9.488
  178    HB   THR  22           HB       THR  22  38.788  21.467  10.716
  179    HG1  THR  22           HG1      THR  22  40.363  23.109   9.457
  180   HG21  THR  22          HG21      THR  22  38.543  20.503   8.376
  181   HG22  THR  22          HG22      THR  22  40.201  20.770   8.913
  182   HG23  THR  22          HG23      THR  22  39.443  21.905   7.796
  183    H    ILE  23           HN       ILE  23  36.892  21.899  11.982
  184    HA   ILE  23           HA       ILE  23  35.347  24.212  12.754
  185    HB   ILE  23           HB       ILE  23  36.770  22.107  14.392
  186   HG12  ILE  23          HG12      ILE  23  33.833  22.527  13.769
  187   HG13  ILE  23          HG11      ILE  23  34.874  21.435  12.862
  188   HG21  ILE  23          HG21      ILE  23  36.521  24.015  15.823
  189   HG22  ILE  23          HG22      ILE  23  35.160  22.956  16.193
  190   HG23  ILE  23          HG23      ILE  23  34.922  24.376  15.175
  191   HD11  ILE  23          HD11      ILE  23  35.067  19.937  14.616
  192   HD12  ILE  23          HD12      ILE  23  33.436  20.542  14.893
  193   HD13  ILE  23          HD13      ILE  23  34.779  21.166  15.846
  194    H    GLU  24           HN       GLU  24  38.706  23.220  13.474
  195    HA   GLU  24           HA       GLU  24  39.476  25.487  14.962
  196    HB2  GLU  24           HB2      GLU  24  41.807  24.955  14.020
  197    HB3  GLU  24           HB1      GLU  24  40.995  23.654  14.891
  198    HG2  GLU  24           HG2      GLU  24  40.283  22.628  12.811
  199    HG3  GLU  24           HG1      GLU  24  40.904  23.992  11.880
  200    H    ASN  25           HN       ASN  25  39.125  25.066  11.481
  201    HA   ASN  25           HA       ASN  25  40.532  27.415  10.681
  202    HB2  ASN  25           HB2      ASN  25  38.349  25.727   9.458
  203    HB3  ASN  25           HB1      ASN  25  38.925  27.178   8.665
  204   HD21  ASN  25          HD21      ASN  25  39.297  24.514   7.571
  205   HD22  ASN  25          HD22      ASN  25  40.964  24.203   7.542
  206    H    VAL  26           HN       VAL  26  37.175  26.782  11.636
  207    HA   VAL  26           HA       VAL  26  36.191  29.434  11.094
  208    HB   VAL  26           HB       VAL  26  35.236  27.439  13.173
  209   HG11  VAL  26          HG11      VAL  26  33.880  29.768  11.786
  210   HG12  VAL  26          HG12      VAL  26  34.318  29.680  13.492
  211   HG13  VAL  26          HG13      VAL  26  33.068  28.615  12.847
  212   HG21  VAL  26          HG21      VAL  26  34.238  27.826  10.340
  213   HG22  VAL  26          HG22      VAL  26  33.777  26.561  11.478
  214   HG23  VAL  26          HG23      VAL  26  35.400  26.582  10.793
  215    H    LYS  27           HN       LYS  27  37.007  27.869  14.192
  216    HA   LYS  27           HA       LYS  27  36.902  30.046  15.906
  217    HB2  LYS  27           HB2      LYS  27  38.998  27.844  15.839
  218    HB3  LYS  27           HB1      LYS  27  38.649  28.872  17.232
  219    HG2  LYS  27           HG2      LYS  27  36.357  28.024  17.320
  220    HG3  LYS  27           HG1      LYS  27  36.636  27.062  15.871
  221    HD2  LYS  27           HD2      LYS  27  38.275  25.696  16.998
  222    HD3  LYS  27           HD1      LYS  27  38.258  26.749  18.410
  223    HE2  LYS  27           HE2      LYS  27  35.704  25.430  17.502
  224    HE3  LYS  27           HE1      LYS  27  36.873  24.525  18.464
  225    HZ1  LYS  27           HZ1      LYS  27  36.506  25.782  20.280
  226    HZ2  LYS  27           HZ2      LYS  27  34.994  26.029  19.542
  227    HZ3  LYS  27           HZ3      LYS  27  36.216  27.201  19.397
  228    H    ALA  28           HN       ALA  28  39.664  29.096  13.851
  229    HA   ALA  28           HA       ALA  28  41.329  31.310  14.672
  230    HB1  ALA  28           HB1      ALA  28  41.370  29.423  12.311
  231    HB2  ALA  28           HB2      ALA  28  42.454  29.451  13.702
  232    HB3  ALA  28           HB3      ALA  28  42.552  30.722  12.482
  233    H    LYS  29           HN       LYS  29  39.383  30.729  11.736
  234    HA   LYS  29           HA       LYS  29  39.831  33.125  10.393
  235    HB2  LYS  29           HB2      LYS  29  37.371  31.403  10.637
  236    HB3  LYS  29           HB1      LYS  29  37.348  32.869   9.658
  237    HG2  LYS  29           HG2      LYS  29  38.963  32.055   8.156
  238    HG3  LYS  29           HG1      LYS  29  39.558  30.846   9.294
  239    HD2  LYS  29           HD2      LYS  29  37.409  29.639   9.102
  240    HD3  LYS  29           HD1      LYS  29  36.863  30.814   7.906
  241    HE2  LYS  29           HE2      LYS  29  39.410  29.213   7.582
  242    HE3  LYS  29           HE1      LYS  29  37.855  28.667   6.957
  243    HZ1  LYS  29           HZ1      LYS  29  37.748  30.389   5.458
  244    HZ2  LYS  29           HZ2      LYS  29  39.412  30.051   5.456
  245    HZ3  LYS  29           HZ3      LYS  29  38.813  31.377   6.333
  246    H    ILE  30           HN       ILE  30  37.640  32.575  13.177
  247    HA   ILE  30           HA       ILE  30  36.621  35.284  13.108
  248    HB   ILE  30           HB       ILE  30  36.557  33.063  15.176
  249   HG12  ILE  30          HG12      ILE  30  34.332  34.249  13.490
  250   HG13  ILE  30          HG11      ILE  30  35.269  32.840  12.995
  251   HG21  ILE  30          HG21      ILE  30  36.380  35.114  16.420
  252   HG22  ILE  30          HG22      ILE  30  34.729  34.530  16.205
  253   HG23  ILE  30          HG23      ILE  30  35.339  35.840  15.196
  254   HD11  ILE  30          HD11      ILE  30  33.225  32.097  14.105
  255   HD12  ILE  30          HD12      ILE  30  33.600  33.087  15.515
  256   HD13  ILE  30          HD13      ILE  30  34.613  31.701  15.116
  257    H    GLN  31           HN       GLN  31  39.150  33.543  14.900
  258    HA   GLN  31           HA       GLN  31  39.831  35.468  16.811
  259    HB2  GLN  31           HB2      GLN  31  40.872  33.280  16.798
  260    HB3  GLN  31           HB1      GLN  31  41.596  33.582  15.224
  261    HG2  GLN  31           HG2      GLN  31  43.036  35.276  16.118
  262    HG3  GLN  31           HG1      GLN  31  42.192  35.269  17.666
  263   HE21  GLN  31          HE21      GLN  31  43.622  32.702  15.551
  264   HE22  GLN  31          HE22      GLN  31  44.486  31.953  16.803
  265    H    ASP  32           HN       ASP  32  41.093  35.179  13.477
  266    HA   ASP  32           HA       ASP  32  42.747  37.512  13.635
  267    HB2  ASP  32           HB2      ASP  32  41.508  36.072  11.278
  268    HB3  ASP  32           HB1      ASP  32  42.651  37.404  11.110
  269    H    LYS  33           HN       LYS  33  39.342  37.072  12.752
  270    HA   LYS  33           HA       LYS  33  39.046  39.780  11.763
  271    HB2  LYS  33           HB2      LYS  33  37.025  37.718  12.594
  272    HB3  LYS  33           HB1      LYS  33  36.623  39.240  11.808
  273    HG2  LYS  33           HG2      LYS  33  37.934  38.637   9.861
  274    HG3  LYS  33           HG1      LYS  33  38.516  37.178  10.653
  275    HD2  LYS  33           HD2      LYS  33  36.213  36.309  10.760
  276    HD3  LYS  33           HD1      LYS  33  35.623  37.769   9.963
  277    HE2  LYS  33           HE2      LYS  33  37.010  37.256   7.988
  278    HE3  LYS  33           HE1      LYS  33  37.609  35.801   8.784
  279    HZ1  LYS  33           HZ1      LYS  33  35.629  35.623   7.172
  280    HZ2  LYS  33           HZ2      LYS  33  34.713  36.233   8.466
  281    HZ3  LYS  33           HZ3      LYS  33  35.566  34.774   8.638
  282    H    GLU  34           HN       GLU  34  38.179  38.162  14.839
  283    HA   GLU  34           HA       GLU  34  37.350  40.791  15.951
  284    HB2  GLU  34           HB2      GLU  34  37.266  38.045  17.236
  285    HB3  GLU  34           HB1      GLU  34  36.485  39.513  17.824
  286    HG2  GLU  34           HG2      GLU  34  35.124  39.613  15.761
  287    HG3  GLU  34           HG1      GLU  34  35.880  38.120  15.202
  288    H    GLY  35           HN       GLY  35  39.896  38.338  16.335
  289    HA2  GLY  35           HA3      GLY  35  42.074  38.814  17.187
  290    HA3  GLY  35           HA2      GLY  35  41.465  40.315  17.886
  291    H    ILE  36           HN       ILE  36  39.512  37.551  18.398
  292    HA   ILE  36           HA       ILE  36  40.136  37.594  21.269
  293    HB   ILE  36           HB       ILE  36  38.019  36.101  19.714
  294   HG12  ILE  36          HG12      ILE  36  37.943  38.744  21.201
  295   HG13  ILE  36          HG11      ILE  36  37.860  38.546  19.451
  296   HG21  ILE  36          HG21      ILE  36  38.165  36.810  22.653
  297   HG22  ILE  36          HG22      ILE  36  38.589  35.226  22.006
  298   HG23  ILE  36          HG23      ILE  36  36.941  35.824  21.860
  299   HD11  ILE  36          HD11      ILE  36  35.864  37.580  21.498
  300   HD12  ILE  36          HD12      ILE  36  35.823  37.112  19.799
  301   HD13  ILE  36          HD13      ILE  36  35.608  38.802  20.254
  302    HA   PRO  37           HA       PRO  37  42.583  33.849  20.678
  303    HB2  PRO  37           HB2      PRO  37  43.015  33.144  23.266
  304    HB3  PRO  37           HB1      PRO  37  43.799  34.554  22.525
  305    HG2  PRO  37           HG2      PRO  37  41.389  34.448  24.289
  306    HG3  PRO  37           HG1      PRO  37  42.764  35.569  24.332
  307    HD2  PRO  37           HD2      PRO  37  40.362  36.215  23.174
  308    HD3  PRO  37           HD1      PRO  37  41.910  36.896  22.629
  309    HA   PRO  38           HA       PRO  38  39.153  30.849  20.432
  310    HB2  PRO  38           HB2      PRO  38  41.580  29.097  20.514
  311    HB3  PRO  38           HB1      PRO  38  40.098  28.905  19.553
  312    HG2  PRO  38           HG2      PRO  38  42.210  29.952  18.440
  313    HG3  PRO  38           HG1      PRO  38  40.631  30.684  18.152
  314    HD2  PRO  38           HD2      PRO  38  42.888  31.686  19.843
  315    HD3  PRO  38           HD1      PRO  38  41.648  32.603  18.955
  316    H    ASP  39           HN       ASP  39  41.764  30.557  22.841
  317    HA   ASP  39           HA       ASP  39  40.491  28.532  24.417
  318    HB2  ASP  39           HB2      ASP  39  42.563  30.631  25.085
  319    HB3  ASP  39           HB1      ASP  39  42.036  29.402  26.235
  320    H    GLN  40           HN       GLN  40  39.858  31.914  24.096
  321    HA   GLN  40           HA       GLN  40  38.460  32.053  26.703
  322    HB2  GLN  40           HB2      GLN  40  39.096  34.053  24.532
  323    HB3  GLN  40           HB1      GLN  40  37.952  34.431  25.817
  324    HG2  GLN  40           HG2      GLN  40  40.746  33.414  26.365
  325    HG3  GLN  40           HG1      GLN  40  40.356  35.132  26.269
  326   HE21  GLN  40          HE21      GLN  40  41.060  33.141  28.614
  327   HE22  GLN  40          HE22      GLN  40  39.894  33.525  29.786
  328    H    GLN  41           HN       GLN  41  37.722  30.926  23.651
  329    HA   GLN  41           HA       GLN  41  34.810  31.307  24.152
  330    HB2  GLN  41           HB2      GLN  41  34.600  31.654  21.628
  331    HB3  GLN  41           HB1      GLN  41  35.241  33.009  22.549
  332    HG2  GLN  41           HG2      GLN  41  37.528  32.358  21.954
  333    HG3  GLN  41           HG1      GLN  41  36.917  30.945  21.093
  334   HE21  GLN  41          HE21      GLN  41  37.069  31.365  18.882
  335   HE22  GLN  41          HE22      GLN  41  36.635  32.827  18.138
  336    H    ARG  42           HN       ARG  42  33.594  29.553  23.644
  337    HA   ARG  42           HA       ARG  42  34.850  27.280  22.150
  338    HB2  ARG  42           HB2      ARG  42  33.368  27.226  24.797
  339    HB3  ARG  42           HB1      ARG  42  33.517  25.792  23.785
  340    HG2  ARG  42           HG2      ARG  42  36.004  27.351  24.472
  341    HG3  ARG  42           HG1      ARG  42  35.306  26.283  25.687
  342    HD2  ARG  42           HD2      ARG  42  35.573  24.361  24.311
  343    HD3  ARG  42           HD1      ARG  42  35.876  25.331  22.871
  344    HE   ARG  42           HE       ARG  42  37.833  24.678  24.955
  345   HH11  ARG  42          HH11      ARG  42  39.941  25.374  24.524
  346   HH12  ARG  42          HH12      ARG  42  40.218  26.520  23.254
  347   HH21  ARG  42          HH21      ARG  42  36.870  26.762  22.384
  348   HH22  ARG  42          HH22      ARG  42  38.480  27.306  22.043
  349    H    LEU  43           HN       LEU  43  33.395  26.374  20.634
  350    HA   LEU  43           HA       LEU  43  30.930  27.905  20.262
  351    HB2  LEU  43           HB2      LEU  43  32.396  25.787  18.688
  352    HB3  LEU  43           HB1      LEU  43  30.762  26.302  18.225
  353    HG   LEU  43           HG       LEU  43  31.493  28.591  17.962
  354   HD11  LEU  43          HD11      LEU  43  34.067  27.552  19.156
  355   HD12  LEU  43          HD12      LEU  43  33.072  28.892  19.718
  356   HD13  LEU  43          HD13      LEU  43  34.011  29.053  18.235
  357   HD21  LEU  43          HD21      LEU  43  31.963  26.862  16.152
  358   HD22  LEU  43          HD22      LEU  43  33.630  26.841  16.730
  359   HD23  LEU  43          HD23      LEU  43  32.943  28.327  16.071
  360    H    ILE  44           HN       ILE  44  28.947  27.219  20.449
  361    HA   ILE  44           HA       ILE  44  28.376  24.441  21.463
  362    HB   ILE  44           HB       ILE  44  27.018  27.042  22.251
  363   HG12  ILE  44          HG12      ILE  44  29.199  26.827  23.320
  364   HG13  ILE  44          HG11      ILE  44  27.937  26.535  24.512
  365   HG21  ILE  44          HG21      ILE  44  25.821  25.543  23.906
  366   HG22  ILE  44          HG22      ILE  44  26.514  24.157  23.064
  367   HG23  ILE  44          HG23      ILE  44  25.395  25.227  22.222
  368   HD11  ILE  44          HD11      ILE  44  29.860  24.593  23.272
  369   HD12  ILE  44          HD12      ILE  44  28.292  23.999  23.810
  370   HD13  ILE  44          HD13      ILE  44  29.384  24.768  24.958
  371    H    PHE  45           HN       PHE  45  26.720  23.379  20.361
  372    HA   PHE  45           HA       PHE  45  25.018  24.995  18.509
  373    HB2  PHE  45           HB2      PHE  45  26.801  24.118  17.130
  374    HB3  PHE  45           HB1      PHE  45  26.626  22.514  17.842
  375    HD1  PHE  45           HD1      PHE  45  25.084  25.008  15.592
  376    HD2  PHE  45           HD2      PHE  45  24.820  21.045  17.211
  377    HE1  PHE  45           HE1      PHE  45  23.378  24.427  13.887
  378    HE2  PHE  45           HE2      PHE  45  23.114  20.459  15.507
  379    HZ   PHE  45           HZ       PHE  45  22.393  22.152  13.845
  380    H    ALA  46           HN       ALA  46  23.014  24.647  19.281
  381    HA   ALA  46           HA       ALA  46  21.159  23.538  20.201
  382    HB1  ALA  46           HB1      ALA  46  21.220  22.702  17.860
  383    HB2  ALA  46           HB2      ALA  46  20.543  21.518  18.978
  384    HB3  ALA  46           HB3      ALA  46  22.198  21.337  18.398
  385    H    GLY  47           HN       GLY  47  23.161  23.397  22.088
  386    HA2  GLY  47           HA3      GLY  47  23.642  22.184  24.026
  387    HA3  GLY  47           HA2      GLY  47  22.435  21.008  23.513
  388    H    LYS  48           HN       LYS  48  24.493  21.219  20.939
  389    HA   LYS  48           HA       LYS  48  25.848  18.733  21.754
  390    HB2  LYS  48           HB2      LYS  48  26.023  20.207  19.138
  391    HB3  LYS  48           HB1      LYS  48  26.522  18.549  19.445
  392    HG2  LYS  48           HG2      LYS  48  24.066  18.162  20.185
  393    HG3  LYS  48           HG1      LYS  48  23.725  19.683  19.358
  394    HD2  LYS  48           HD2      LYS  48  24.848  18.712  17.307
  395    HD3  LYS  48           HD1      LYS  48  24.901  17.165  18.153
  396    HE2  LYS  48           HE2      LYS  48  22.909  17.167  16.796
  397    HE3  LYS  48           HE1      LYS  48  22.402  17.354  18.474
  398    HZ1  LYS  48           HZ1      LYS  48  21.550  19.341  18.038
  399    HZ2  LYS  48           HZ2      LYS  48  21.773  19.011  16.386
  400    HZ3  LYS  48           HZ3      LYS  48  22.958  19.867  17.253
  401    H    GLN  49           HN       GLN  49  28.203  18.501  21.240
  402    HA   GLN  49           HA       GLN  49  29.729  20.990  21.798
  403    HB2  GLN  49           HB2      GLN  49  30.087  18.235  22.901
  404    HB3  GLN  49           HB1      GLN  49  31.349  19.454  22.997
  405    HG2  GLN  49           HG2      GLN  49  29.781  20.959  24.186
  406    HG3  GLN  49           HG1      GLN  49  28.542  19.703  24.121
  407   HE21  GLN  49          HE21      GLN  49  28.414  19.127  26.337
  408   HE22  GLN  49          HE22      GLN  49  29.732  18.542  27.232
  409    H    LEU  50           HN       LEU  50  31.067  21.462  20.133
  410    HA   LEU  50           HA       LEU  50  31.791  19.308  18.216
  411    HB2  LEU  50           HB2      LEU  50  31.845  22.326  18.156
  412    HB3  LEU  50           HB1      LEU  50  32.759  21.392  16.974
  413    HG   LEU  50           HG       LEU  50  30.758  20.291  16.187
  414   HD11  LEU  50          HD11      LEU  50  29.482  21.645  18.568
  415   HD12  LEU  50          HD12      LEU  50  29.492  19.929  18.164
  416   HD13  LEU  50          HD13      LEU  50  28.520  21.051  17.213
  417   HD21  LEU  50          HD21      LEU  50  30.412  23.279  16.564
  418   HD22  LEU  50          HD22      LEU  50  29.376  22.311  15.517
  419   HD23  LEU  50          HD23      LEU  50  31.100  22.447  15.168
  420    H    GLU  51           HN       GLU  51  33.815  18.445  18.185
  421    HA   GLU  51           HA       GLU  51  35.829  19.510  20.093
  422    HB2  GLU  51           HB2      GLU  51  37.016  17.389  19.648
  423    HB3  GLU  51           HB1      GLU  51  35.346  17.094  20.132
  424    HG2  GLU  51           HG2      GLU  51  34.725  16.939  17.711
  425    HG3  GLU  51           HG1      GLU  51  36.437  17.076  17.304
  426    H    ASP  52           HN       ASP  52  38.049  19.861  19.384
  427    HA   ASP  52           HA       ASP  52  38.302  21.425  17.034
  428    HB2  ASP  52           HB2      ASP  52  39.880  21.370  19.031
  429    HB3  ASP  52           HB1      ASP  52  40.565  19.897  18.343
  430    H    GLY  53           HN       GLY  53  39.358  20.937  15.008
  431    HA2  GLY  53           HA3      GLY  53  40.029  19.542  13.219
  432    HA3  GLY  53           HA2      GLY  53  40.048  18.181  14.342
  433    H    ARG  54           HN       ARG  54  38.989  17.433  12.073
  434    HA   ARG  54           HA       ARG  54  37.068  16.354  11.274
  435    HB2  ARG  54           HB2      ARG  54  36.424  16.560  13.877
  436    HB3  ARG  54           HB1      ARG  54  35.258  17.718  13.246
  437    HG2  ARG  54           HG2      ARG  54  34.025  15.742  13.114
  438    HG3  ARG  54           HG1      ARG  54  34.730  15.800  11.500
  439    HD2  ARG  54           HD2      ARG  54  36.555  14.305  12.241
  440    HD3  ARG  54           HD1      ARG  54  35.852  14.254  13.857
  441    HE   ARG  54           HE       ARG  54  33.835  13.454  12.041
  442   HH11  ARG  54          HH11      ARG  54  33.432  11.252  11.726
  443   HH12  ARG  54          HH12      ARG  54  34.658  10.095  12.123
  444   HH21  ARG  54          HH21      ARG  54  36.938  12.483  13.183
  445   HH22  ARG  54          HH22      ARG  54  36.644  10.792  12.948
  446    H    THR  55           HN       THR  55  35.232  16.962   9.921
  447    HA   THR  55           HA       THR  55  35.146  19.896   9.294
  448    HB   THR  55           HB       THR  55  35.021  17.467   7.483
  449    HG1  THR  55           HG1      THR  55  36.983  18.030   6.983
  450   HG21  THR  55          HG21      THR  55  33.467  18.903   6.481
  451   HG22  THR  55          HG22      THR  55  34.972  19.361   5.693
  452   HG23  THR  55          HG23      THR  55  34.321  20.356   6.996
  453    H    LEU  56           HN       LEU  56  33.057  20.663   8.472
  454    HA   LEU  56           HA       LEU  56  30.820  19.682   9.967
  455    HB2  LEU  56           HB2      LEU  56  30.692  21.365   7.452
  456    HB3  LEU  56           HB1      LEU  56  29.489  21.279   8.735
  457    HG   LEU  56           HG       LEU  56  32.330  22.283   9.101
  458   HD11  LEU  56          HD11      LEU  56  29.698  23.700   8.659
  459   HD12  LEU  56          HD12      LEU  56  31.219  23.924   7.795
  460   HD13  LEU  56          HD13      LEU  56  31.057  24.494   9.454
  461   HD21  LEU  56          HD21      LEU  56  31.182  23.192  11.258
  462   HD22  LEU  56          HD22      LEU  56  31.606  21.484  11.206
  463   HD23  LEU  56          HD23      LEU  56  29.938  21.984  10.926
  464    H    SER  57           HN       SER  57  31.760  19.227   6.560
  465    HA   SER  57           HA       SER  57  29.454  17.717   5.781
  466    HB2  SER  57           HB2      SER  57  32.330  17.519   4.823
  467    HB3  SER  57           HB1      SER  57  30.963  16.738   4.033
  468    HG   SER  57           HG       SER  57  30.332  19.278   4.449
  469    H    ASP  58           HN       ASP  58  32.624  16.702   6.994
  470    HA   ASP  58           HA       ASP  58  32.237  13.933   7.153
  471    HB2  ASP  58           HB2      ASP  58  33.704  15.795   9.038
  472    HB3  ASP  58           HB1      ASP  58  33.774  14.039   9.181
  473    H    TYR  59           HN       TYR  59  30.998  16.461   9.302
  474    HA   TYR  59           HA       TYR  59  29.966  14.590  11.274
  475    HB2  TYR  59           HB2      TYR  59  29.686  17.535  10.744
  476    HB3  TYR  59           HB1      TYR  59  28.490  16.770  11.788
  477    HD1  TYR  59           HD1      TYR  59  31.543  18.463  11.830
  478    HD2  TYR  59           HD2      TYR  59  29.615  15.024  13.545
  479    HE1  TYR  59           HE1      TYR  59  33.121  18.525  13.740
  480    HE2  TYR  59           HE2      TYR  59  31.201  15.088  15.449
  481    HH   TYR  59           HH       TYR  59  32.878  16.171  16.407
  482    H    ASN  60           HN       ASN  60  28.932  15.618   8.164
  483    HA   ASN  60           HA       ASN  60  26.989  15.158   6.945
  484    HB2  ASN  60           HB2      ASN  60  27.606  12.839   7.862
  485    HB3  ASN  60           HB1      ASN  60  26.353  13.108   9.073
  486   HD21  ASN  60          HD21      ASN  60  26.902  12.755   5.568
  487   HD22  ASN  60          HD22      ASN  60  25.283  12.418   5.182
  488    H    ILE  61           HN       ILE  61  26.493  17.388   8.138
  489    HA   ILE  61           HA       ILE  61  24.601  17.472  10.264
  490    HB   ILE  61           HB       ILE  61  24.941  19.405   7.948
  491   HG12  ILE  61          HG12      ILE  61  26.096  19.530  10.748
  492   HG13  ILE  61          HG11      ILE  61  26.989  18.911   9.358
  493   HG21  ILE  61          HG21      ILE  61  22.835  19.804   9.074
  494   HG22  ILE  61          HG22      ILE  61  23.978  21.035   9.609
  495   HG23  ILE  61          HG23      ILE  61  23.603  19.666  10.654
  496   HD11  ILE  61          HD11      ILE  61  25.736  21.668   9.457
  497   HD12  ILE  61          HD12      ILE  61  26.827  21.038   8.221
  498   HD13  ILE  61          HD13      ILE  61  27.425  21.345   9.852
  499    H    GLN  62           HN       GLN  62  22.410  17.133  10.298
  500    HA   GLN  62           HA       GLN  62  21.132  15.747   8.161
  501    HB2  GLN  62           HB2      GLN  62  19.993  17.217  10.553
  502    HB3  GLN  62           HB1      GLN  62  19.020  16.232   9.461
  503    HG2  GLN  62           HG2      GLN  62  20.435  14.273   9.954
  504    HG3  GLN  62           HG1      GLN  62  21.413  15.254  11.047
  505   HE21  GLN  62          HE21      GLN  62  20.849  14.480  13.109
  506   HE22  GLN  62          HE22      GLN  62  19.256  14.362  13.683
  507    H    LYS  63           HN       LYS  63  20.613  19.126   9.276
  508    HA   LYS  63           HA       LYS  63  18.817  19.782   7.156
  509    HB2  LYS  63           HB2      LYS  63  20.620  21.522   8.856
  510    HB3  LYS  63           HB1      LYS  63  19.418  22.164   7.737
  511    HG2  LYS  63           HG2      LYS  63  17.643  20.936   8.934
  512    HG3  LYS  63           HG1      LYS  63  18.844  20.297  10.056
  513    HD2  LYS  63           HD2      LYS  63  19.417  22.602  10.749
  514    HD3  LYS  63           HD1      LYS  63  18.189  23.229   9.648
  515    HE2  LYS  63           HE2      LYS  63  17.649  21.326  11.947
  516    HE3  LYS  63           HE1      LYS  63  17.350  23.063  11.983
  517    HZ1  LYS  63           HZ1      LYS  63  16.041  21.023  10.286
  518    HZ2  LYS  63           HZ2      LYS  63  15.941  22.685   9.946
  519    HZ3  LYS  63           HZ3      LYS  63  15.319  22.073  11.404
  520    H    GLU  64           HN       GLU  64  22.357  19.851   7.327
  521    HA   GLU  64           HA       GLU  64  23.941  20.492   5.710
  522    HB2  GLU  64           HB2      GLU  64  22.892  18.308   4.892
  523    HB3  GLU  64           HB1      GLU  64  21.934  19.298   3.790
  524    HG2  GLU  64           HG2      GLU  64  23.962  20.208   2.779
  525    HG3  GLU  64           HG1      GLU  64  24.962  19.327   3.934
  526    H    SEP  65           HN       SEP  65  22.783  22.796   6.255
  527    HA   SEP  65           HA       SEP  65  22.763  24.216   3.738
  528    HB2  SEP  65           HB1      SEP  65  20.382  25.104   4.059
  529    HB3  SEP  65           HB2      SEP  65  20.134  23.744   5.150
  530    H    TPO  66           HN       TPO  66  21.487  26.545   4.447
  531    HA   TPO  66           HA       TPO  66  23.300  27.931   6.039
  532    HB   TPO  66           HB       TPO  66  21.804  29.340   4.932
  533   HG21  TPO  66          HG21      TPO  66  19.292  29.015   5.147
  534   HG22  TPO  66          HG22      TPO  66  19.643  27.489   5.956
  535   HG23  TPO  66          HG23      TPO  66  20.145  27.737   4.284
  536    H    LEU  67           HN       LEU  67  23.199  28.675   8.280
  537    HA   LEU  67           HA       LEU  67  21.294  27.613  10.148
  538    HB2  LEU  67           HB2      LEU  67  23.231  25.748   9.336
  539    HB3  LEU  67           HB1      LEU  67  23.851  26.328  10.876
  540    HG   LEU  67           HG       LEU  67  21.037  25.277  10.423
  541   HD11  LEU  67          HD11      LEU  67  23.538  24.006  11.561
  542   HD12  LEU  67          HD12      LEU  67  22.552  23.434  10.215
  543   HD13  LEU  67          HD13      LEU  67  21.922  23.368  11.861
  544   HD21  LEU  67          HD21      LEU  67  20.907  26.725  12.278
  545   HD22  LEU  67          HD22      LEU  67  22.538  26.338  12.821
  546   HD23  LEU  67          HD23      LEU  67  21.236  25.168  13.033
  547    H    HIS  68           HN       HIS  68  21.832  28.255  12.369
  548    HA   HIS  68           HA       HIS  68  23.820  30.501  12.473
  549    HB2  HIS  68           HB2      HIS  68  21.329  30.007  14.143
  550    HB3  HIS  68           HB1      HIS  68  22.427  31.376  14.325
  551    HD1  HIS  68           HD1      HIS  68  20.098  29.829  11.744
  552    HD2  HIS  68           HD2      HIS  68  21.912  33.491  12.586
  553    HE1  HIS  68           HE1      HIS  68  19.130  31.505  10.105
  554    HE2  HIS  68           HE2      HIS  68  20.227  33.735  10.609
  555    H    LEU  69           HN       LEU  69  25.147  30.626  14.429
  556    HA   LEU  69           HA       LEU  69  25.229  28.088  16.037
  557    HB2  LEU  69           HB2      LEU  69  27.621  29.791  15.280
  558    HB3  LEU  69           HB1      LEU  69  27.634  28.208  16.053
  559    HG   LEU  69           HG       LEU  69  26.567  28.734  13.261
  560   HD11  LEU  69          HD11      LEU  69  28.680  27.435  12.622
  561   HD12  LEU  69          HD12      LEU  69  29.254  27.767  14.258
  562   HD13  LEU  69          HD13      LEU  69  28.920  29.100  13.153
  563   HD21  LEU  69          HD21      LEU  69  27.010  26.254  14.940
  564   HD22  LEU  69          HD22      LEU  69  26.900  26.174  13.182
  565   HD23  LEU  69          HD23      LEU  69  25.537  26.770  14.122
  566    H    VAL  70           HN       VAL  70  26.143  28.468  18.250
  567    HA   VAL  70           HA       VAL  70  25.867  31.316  19.153
  568    HB   VAL  70           HB       VAL  70  24.952  30.246  21.331
  569   HG11  VAL  70          HG11      VAL  70  23.565  31.611  19.864
  570   HG12  VAL  70          HG12      VAL  70  22.640  30.207  20.389
  571   HG13  VAL  70          HG13      VAL  70  23.332  30.249  18.767
  572   HG21  VAL  70          HG21      VAL  70  23.730  28.123  20.971
  573   HG22  VAL  70          HG22      VAL  70  25.463  27.909  20.759
  574   HG23  VAL  70          HG23      VAL  70  24.410  28.008  19.350
  575    H    LEU  71           HN       LEU  71  27.860  31.894  19.719
  576    HA   LEU  71           HA       LEU  71  29.821  29.944  20.706
  577    HB2  LEU  71           HB2      LEU  71  29.878  32.900  20.095
  578    HB3  LEU  71           HB1      LEU  71  31.221  32.131  20.939
  579    HG   LEU  71           HG       LEU  71  31.621  30.630  19.103
  580   HD11  LEU  71          HD11      LEU  71  29.418  30.048  18.392
  581   HD12  LEU  71          HD12      LEU  71  30.157  30.864  17.015
  582   HD13  LEU  71          HD13      LEU  71  29.010  31.728  18.040
  583   HD21  LEU  71          HD21      LEU  71  31.996  32.267  17.230
  584   HD22  LEU  71          HD22      LEU  71  32.595  32.830  18.790
  585   HD23  LEU  71          HD23      LEU  71  31.075  33.457  18.151
  586    H    ARG  72           HN       ARG  72  30.723  29.936  22.821
  587    HA   ARG  72           HA       ARG  72  29.036  31.276  24.901
  588    HB2  ARG  72           HB2      ARG  72  29.314  28.739  24.894
  589    HB3  ARG  72           HB1      ARG  72  31.012  29.011  25.284
  590    HG2  ARG  72           HG2      ARG  72  30.356  30.273  27.298
  591    HG3  ARG  72           HG1      ARG  72  28.655  30.006  26.912
  592    HD2  ARG  72           HD2      ARG  72  30.680  27.804  27.413
  593    HD3  ARG  72           HD1      ARG  72  29.503  28.379  28.596
  594    HE   ARG  72           HE       ARG  72  28.012  27.691  26.324
  595   HH11  ARG  72          HH11      ARG  72  27.072  25.643  26.132
  596   HH12  ARG  72          HH12      ARG  72  27.725  24.317  27.035
  597   HH21  ARG  72          HH21      ARG  72  30.214  26.214  28.527
  598   HH22  ARG  72          HH22      ARG  72  29.504  24.640  28.391
  599    H    LEU  73           HN       LEU  73  30.071  32.557  26.483
  600    HA   LEU  73           HA       LEU  73  32.681  33.642  25.702
  601    HB2  LEU  73           HB2      LEU  73  31.058  34.250  28.188
  602    HB3  LEU  73           HB1      LEU  73  32.337  35.238  27.487
  603    HG   LEU  73           HG       LEU  73  29.720  34.567  26.110
  604   HD11  LEU  73          HD11      LEU  73  29.157  36.935  26.534
  605   HD12  LEU  73          HD12      LEU  73  30.662  37.131  27.431
  606   HD13  LEU  73          HD13      LEU  73  29.402  36.062  28.046
  607   HD21  LEU  73          HD21      LEU  73  31.297  34.983  24.400
  608   HD22  LEU  73          HD22      LEU  73  32.149  36.198  25.354
  609   HD23  LEU  73          HD23      LEU  73  30.569  36.566  24.663
  610    H    ARG  74           HN       ARG  74  34.587  32.892  26.450
  611    HA   ARG  74           HA       ARG  74  36.137  31.691  27.739
  612    HB2  ARG  74           HB2      ARG  74  35.240  33.399  29.434
  613    HB3  ARG  74           HB1      ARG  74  34.225  32.094  30.048
  614    HG2  ARG  74           HG2      ARG  74  36.168  30.738  30.559
  615    HG3  ARG  74           HG1      ARG  74  37.239  31.908  29.785
  616    HD2  ARG  74           HD2      ARG  74  37.328  32.251  32.189
  617    HD3  ARG  74           HD1      ARG  74  36.492  33.620  31.455
  618    HE   ARG  74           HE       ARG  74  34.582  31.616  32.219
  619   HH11  ARG  74          HH11      ARG  74  33.351  32.003  34.077
  620   HH12  ARG  74          HH12      ARG  74  33.894  33.176  35.230
  621   HH21  ARG  74          HH21      ARG  74  36.752  33.998  33.447
  622   HH22  ARG  74          HH22      ARG  74  35.819  34.306  34.874
  623    H    GLY  75           HN       GLY  75  36.395  29.616  28.961
  624    HA2  GLY  75           HA3      GLY  75  34.344  27.830  29.628
  625    HA3  GLY  75           HA2      GLY  75  34.637  27.589  27.905
  626    H    GLY  76           HN       GLY  76  35.247  25.380  29.001
  627    HA2  GLY  76           HA3      GLY  76  38.063  25.028  28.758
  628    HA3  GLY  76           HA2      GLY  76  37.667  25.108  30.475